A0A087X777_POEFO Loading...

Desmocollin 1

A component of desmosome cell-cell junctions which are required for positive regulation of cellular adhesion. Involved in the interaction of plaque proteins and intermediate filaments mediating cell-cell adhesion.

AlphaFold DB , UniProt , Accession A0A087X777, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 897 aa.

						>A0A087X777_POEFO|A0A087X777
MTTVLVYPVLSLLVLSFVESCYIPDSLHVVSPQTIPVGYQVTKVEAVGCDPKTLRFTVEDPSFTIQSNGVIVALSPVSVATRGRTFSVRAQDNSGPGSEMEVHLVCSTKQETNENGQVILKRTKRRWSPPPINILENDAGPFPKFLETIVSDSEVQHDVYYTIAGRGANLDPAGIFTLKSDDGTLYVHKTLDREMIAQYTLTINALDKVSHQPRDLPLDIVVKVDDVNDNAPEFLGKLEFTVLEQSLAEVVGKVNATDKDDPETDHVRIRYRLLDGLDFFHIHADTGVITTISKKLDRETKETHMVTIELRDLKGGHGCLSSTATATITLKDINDNPPTFTQSSYKTTVPENESDKLILRIPVNDKDLKDTPNWISKFVITKGNGNGNFRIATDPKTNEGLLYVAKPLNYETTKKVMLEISAQNQEKLVGASAEWMSVPVEVAVTDVDEGPEFLPPTVRYVVQENLPNGTVIGMYKAIDPETNSSVGILYYKVSDPGSWVGVNSNTGELTVTNTIDRESPLVQDGTYNITVKAVDATSKSGIGTVVLVIEDENDNKPTIPKELTLCKKQDGSLNSLVVVAEDNDASPFSSPFTYSMPAKHDGNWEVSSYNGTAAMLKQKQALPLGLHKVSFIVKDMQGNGGTQTTTVRICQCTNGACVKRGRSIELGPLGILTLLLPLFLLLLLCLLLLSTCTTKPEKIPLGDGEYSKGILIPSNTEAPGDEVDSFAFHSTSLEQGVKDSMKGSVVNTGWLGNKSTSTIGGHSVHENGYQQSIGLNAMNTHSMSSRKFDHYGQHFDTMGSQRLNMNGMDYDQYTMDNNLARTWKTHDLYLKQKLALMGGERDERYAGDIMHSYDYEGNESVHGSVGCCSEYGDKENLDFLNTLGPKFKTLGEVCTKR
					

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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	34.7	Very low	37.1	Very low	228 Å²	228	141.8 Å²	141.8	100%	1.123	79%	0.787	S	S	*	*				0	141.8	0	-169.5	168.4	-179.1	0	0	107.1
2	T	33.1	Very low	36.8	Very low	111 Å²	111	142.4 Å²	142.4	68%	0.681	79%	0.787	S	S	*	*			trans	52.7	106.7	167.6	45.4	0	0	0	0	117.7
3	T	39.2	Very low	36.7	Very low	130 Å²	130	144.8 Å²	144.8	80%	0.798	80%	0.796	S	S	*	*				64	145.5	79.2	66.5	0	0	0	0	113.2
4	V	41.6	Very low	36.7	Very low	123 Å²	123	142.4 Å²	142.4	75%	0.745	79%	0.787	S	S	*	*			cis	-160.7	176.6	11.4	84.4	0	0	0	0	107.5
5	L	38.7	Very low	36.4	Very low	145 Å²	145	141.7 Å²	141.7	76%	0.759	78%	0.781	S	S	*	*			cis	-154.3	173.4	4.9	-103.8	-173.5	0	0	0	104.6
6	V	33.1	Very low	36.4	Very low	121 Å²	121	139.1 Å²	139.1	73%	0.733	78%	0.775	S	S	*	*			cis	-167.2	178.1	-13.1	61.5	0	0	0	0	109.2
7	Y	32.1	Very low	36.6	Very low	210 Å²	210	141.1 Å²	141.1	82%	0.824	77%	0.774	S	S	*	*			trans	-85.2	-168.9	172.7	-91.1	-125.7	0	0	0	112.2
8	P	57.3	Low	37.2	Very low	113 Å²	113	138.6 Å²	138.6	73%	0.734	76%	0.764	S	S	*	*			cis	-110.3	-146.9	-15.2	17.2	9	0	0	0	109.4
9	V	30.9	Very low	37.9	Very low	133 Å²	133	139.9 Å²	139.9	81%	0.806	76%	0.764	S	S	*	*			cis	-144.4	166.6	10.5	-174.7	0	0	0	0	108.9
10	L	32.1	Very low	39	Very low	151 Å²	151	136.3 Å²	136.3	79%	0.791	75%	0.75	S	S	*	*			trans	-136.6	163	177.7	-172.3	73.5	0	0	0	110.1
11	S	35.1	Very low	40.4	Very low	95 Å²	95	130 Å²	130	66%	0.664	72%	0.715	S	S	*	*			trans	89.3	143.9	161.7	-34.7	0	0	0	0	116
12	L	33.9	Very low	42.3	Very low	149 Å²	149	124.6 Å²	124.6	78%	0.78	68%	0.683	S	S	*	*			cis	-157	135.9	-8.8	-149.4	93.1	0	0	0	109.1
13	L	35.2	Very low	44.6	Very low	173 Å²	173	119.3 Å²	119.3	91%	0.906	65%	0.651	S	S	*	*			trans	-165.5	127.9	142.4	-115.6	164.3	0	0	0	112.8	L15	L13-L15 PolarHBondContact O-N 2.75Å
14	V	36.4	Very low	46.5	Very low	112 Å²	112	115.7 Å²	115.7	68%	0.679	63%	0.63	S	S	*	*			trans	-57.7	120	-174.3	178.9	0	0	0	0	113.4
15	L	33.2	Very low	48.2	Very low	131 Å²	131	115.1 Å²	115.1	69%	0.686	62%	0.622	S	S	*	*				-137	115.6	125	-98.8	175.4	0	0	0	108.4	L13 F17	L13-L15 PolarHBondContact O-N 2.75Å; L15-F17 HydrophobicContact CB-CD2 3.99Å; L15-F17 HydrophobicContact CB-CE2 3.75Å; L15-F17 HydrophobicContact CD1-CE2 3.8Å; L15-F17 HydrophobicContact CD1-CZ 3.9Å; L15-F17 HydrophobicContact CG-CE2 4.38Å; L15-F17 PolarHBondContact O-N 3.35Å
16	S	36.5	Very low	50.3	Low	100 Å²	100	111 Å²	111	70%	0.699	61%	0.606	S	S	*	*			trans	-76.8	81.1	168.3	54.4	0	0	0	0	108.7	V18	S16-V18 VanDerWaalsContact C-N 3.3Å; S16-V18 PolarHBondContact O-N 2.76Å
17	F	39.4	Very low	52.6	Low	173 Å²	173	107.7 Å²	107.7	76%	0.759	58%	0.584	S	S	*	*			trans	-63.7	101.3	157.7	-71.8	-78.5	0	0	0	107	L15 E19	L15-F17 HydrophobicContact CB-CD2 3.99Å; L15-F17 HydrophobicContact CB-CE2 3.75Å; L15-F17 HydrophobicContact CD1-CE2 3.8Å; L15-F17 HydrophobicContact CD1-CZ 3.9Å; L15-F17 HydrophobicContact CG-CE2 4.38Å; L15-F17 PolarHBondContact O-N 3.35Å; F17-E19 PolarHBondContact O-N 3.18Å
18	V	47.5	Very low	54.9	Low	96 Å²	96	103.8 Å²	103.8	58%	0.582	57%	0.572	S	S	*	*			trans	-50.1	133.3	153.9	178.8	0	0	0	0	106	S16 S20	S16-V18 VanDerWaalsContact C-N 3.3Å; S16-V18 PolarHBondContact O-N 2.76Å; V18-S20 PolarHBondContact O-N 3.48Å
19	E	50.6	Low	55.9	Low	164 Å²	164	99.1 Å²	99.1	77%	0.766	54%	0.542	S	S	*	.			trans	-65.5	89.5	171.3	-70.3	-174.4	148.1	0	0	107.5	F17 C21	F17-E19 PolarHBondContact O-N 3.18Å; E19-C21 PolarHBondContact O-N 3.33Å
20	S	59.2	Low	58.1	Low	68 Å²	68	97.6 Å²	97.6	48%	0.476	53%	0.533	S	S	.	.			trans	-64.3	124.8	-177.5	51.9	0	0	0	0	108.9	V18 Y22	V18-S20 PolarHBondContact O-N 3.48Å; S20-Y22 PolarHBondContact O-N 3.02Å
21	C	69	Low	59.9	Low	5 Å²	5	90.6 Å²	90.6	3%	0.034	50%	0.496	C	S	.	.			trans	-40.8	113.1	178.1	174.8	0	0	0	0	112.2	E19 C49 L54 D92 S98	E19-C21 PolarHBondContact O-N 3.33Å; C21-C49 WeakPolarHBondContact CA-SG 3.41Å; C21-C49 HydrophobicContact CB-CB 3.7Å; C21-C49 WeakPolarHBondContact CB-SG 3.34Å; C21-C49 WeakPolarHBondContact SG-CB 3.06Å; C21-C49 CovalentContact SG-SG 2.03Å; C21-C49 PolarHBondContact SG-SG 2.9Å; C21-L54 VanDerWaalsContact SG-CD1 3.59Å; C21-D92 WeakPolarHBondContact CB-OD2 3.29Å; C21-S98 VanDerWaalsContact O-CB 3.27Å; C21-S98 WeakPolarHBondContact O-CB 3.24Å
22	Y	74.7	Confident	61.5	Low	113 Å²	113	88.2 Å²	88.2	44%	0.443	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-119.2	132.1	-172	-178.8	-106.6	0	0	0	111.1	S20 D25 V47	S20-Y22 PolarHBondContact O-N 3.02Å; Y22-D25 WeakPolarHBondContact CE2-OD1 3.48Å; Y22-D25 PolarHBondContact OH-OD1 2.66Å; Y22-V47 PolarHBondContact N-O 3.49Å; Y22-V47 PolarHBondContact O-N 2.84Å
23	I	81.9	Confident	63.2	Low	0 Å²	0	86.5 Å²	86.5	0%	0	47%	0.467	C	S	.	.			trans	-116	152.9	162.6	55	171.5	0	0	0	108.7	V44 A46 F56 V88 A90 S98 M100	I23-V44 HydrophobicContact CB-CG1 4.26Å; I23-V44 HydrophobicContact CG2-CG1 3.71Å; I23-A46 HydrophobicContact CG2-CB 3.53Å; I23-F56 HydrophobicContact CG2-CE1 4.31Å; I23-V88 VanDerWaalsContact CD1-O 3.32Å; I23-V88 WeakPolarHBondContact CD1-O 3.31Å; I23-A90 HydrophobicContact CD1-CB 3.75Å; I23-A90 HydrophobicContact CG1-CB 4.1Å; I23-A90 HydrophobicContact CG2-CB 3.78Å; I23-S98 VanDerWaalsContact CG1-OG 3.3Å; I23-S98 WeakPolarHBondContact CG1-OG 3.33Å; I23-S98 PolarHBondContact N-OG 2.7Å; I23-S98 VanDerWaalsContact N-OG 3.09Å; I23-S98 PolarHBondContact O-OG 3.42Å; I23-M100 HydrophobicContact CD1-CB 3.66Å; I23-M100 HydrophobicContact CG1-CB 4.19Å
24	P	78.3	Confident	64.9	Low	55 Å²	55	82.5 Å²	82.5	36%	0.357	45%	0.449	S	S	.	.			trans	-58.3	143.4	-179.7	-22.6	33.6	0	0	0	112.3	S26 M100	P24-S26 PolarHBondContact O-N 3.36Å; P24-M100 HydrophobicContact CB-SD 4.35Å; P24-M100 WeakPolarHBondContact O-CA 3.46Å; P24-M100 WeakPolarHBondContact O-CB 3.32Å; P24-M100 WeakPolarHBondContact O-CG 3.43Å
25	D	77	Confident	66.9	Low	111 Å²	111	77.1 Å²	77.1	59%	0.594	42%	0.417	S	S	*	.	S	Bend	trans	-61.3	-29.7	-177	-55.3	8	0	0	0	113	Y22 M100 E101	Y22-D25 WeakPolarHBondContact CE2-OD1 3.48Å; Y22-D25 PolarHBondContact OH-OD1 2.66Å; D25-M100 WeakPolarHBondContact O-CA 3.35Å; D25-E101 PolarHBondContact O-N 2.86Å
26	S	82.3	Confident	68.6	Low	58 Å²	58	74.3 Å²	74.3	41%	0.406	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	158.8	172.2	70.8	0	0	0	0	113.7	P24 E101	P24-S26 PolarHBondContact O-N 3.36Å; S26-E101 CarbonylContact C-O 3.51Å; S26-E101 VanDerWaalsContact CA-O 3.24Å; S26-E101 WeakPolarHBondContact CA-O 3.26Å; S26-E101 WeakPolarHBondContact CB-O 3.45Å
27	L	82.7	Confident	70.6	Confident	52 Å²	52	73.9 Å²	73.9	27%	0.272	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	116	-177.1	180	63.6	0	0	0	111.6	V29 T42 M100 E101 V102 H103	L27-V29 HydrophobicContact CD2-CG2 4.24Å; L27-V29 HydrophobicContact CG-CG2 4.01Å; L27-T42 HydrophobicContact CD2-CG2 3.85Å; L27-M100 HydrophobicContact CB-CE 4.44Å; L27-M100 HydrophobicContact CB-CG 4.18Å; L27-M100 HydrophobicContact CB-SD 3.55Å; L27-M100 VanDerWaalsContact CB-SD 3.55Å; L27-M100 HydrophobicContact CD2-CE 4.1Å; L27-M100 HydrophobicContact CD2-SD 4.01Å; L27-M100 HydrophobicContact CG-SD 4.41Å; L27-E101 PolarHBondContact N-O 3.24Å; L27-V102 CarbonylContact O-C 3.49Å; L27-V102 WeakPolarHBondContact O-CA 3.41Å; L27-H103 PolarHBondContact O-N 3.39Å
28	H	79.3	Confident	72.3	Confident	127 Å²	127	67.9 Å²	67.9	59%	0.588	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.7	174.4	-66	-89.1	0	0	0	111.3	H103	H28-H103 WeakPolarHBondContact CA-O 3.3Å; H28-H103 AromaticContact CE1-CD2 3.27Å; H28-H103 PolarHBondContact CE1-CD2 2.62Å; H28-H103 AromaticContact CE1-CG 3.66Å; H28-H103 WeakPolarHBondContact ND1-CB 3.47Å; H28-H103 AromaticContact ND1-CD2 3.66Å; H28-H103 AromaticContact ND1-CG 3.79Å; H28-H103 AromaticContact NE2-CD2 3.51Å
29	V	79.6	Confident	74	Confident	15 Å²	15	67.6 Å²	67.6	9%	0.091	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122	-177.4	-175.6	0	0	0	0	110.3	L27 V41 T42 V102 H103 L104 V105	L27-V29 HydrophobicContact CD2-CG2 4.24Å; L27-V29 HydrophobicContact CG-CG2 4.01Å; V29-V41 HydrophobicContact CB-CG1 4.5Å; V29-V41 HydrophobicContact CG1-CG1 3.97Å; V29-V41 WeakPolarHBondContact CG1-O 3.45Å; V29-T42 HydrophobicContact CG2-CG2 3.8Å; V29-V102 HydrophobicContact CG2-CG1 4Å; V29-H103 PolarHBondContact N-O 2.85Å; V29-L104 HydrophobicContact CB-CD2 4.24Å; V29-L104 WeakPolarHBondContact O-CA 3.4Å; V29-V105 PolarHBondContact O-N 2.84Å
30	V	76.8	Confident	75.7	Confident	101 Å²	101	65.8 Å²	65.8	61%	0.612	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	123.5	177	177.7	0	0	0	0	109.7	V105	V30-V105 WeakPolarHBondContact CA-O 3.13Å
31	S	70.2	Confident	76.8	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.028	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.5	-169.6	53.1	0	0	0	0	112.5	V105 C106 S107	S31-V105 PolarHBondContact N-O 2.98Å; S31-V105 PolarHBondContact OG-O 3.1Å; S31-C106 CarbonylContact O-C 3.49Å; S31-C106 WeakPolarHBondContact O-CA 3.4Å; S31-S107 PolarHBondContact O-N 2.87Å
32	P	68.4	Low	77.5	Confident	46 Å²	46	65 Å²	65	30%	0.299	36%	0.359	S	S	.	.			trans	-69	154.7	174	29.4	-35.2	0	0	0	111.7	T34 I35 Y39	P32-T34 PolarHBondContact O-N 2.8Å; P32-T34 VanDerWaalsContact O-N 3.11Å; P32-I35 HydrophobicContact CG-CG1 4.27Å; P32-Y39 HydrophobicContact CG-CE2 4.15Å
33	Q	68.8	Low	77.9	Confident	113 Å²	113	64.4 Å²	64.4	53%	0.528	36%	0.359	S	S	.	.	S	Bend	trans	-59	-25.4	-179	-169.5	177.3	-11.6	0	0	113.4	S78 V79	Q33-S78 WeakPolarHBondContact O-CA 3.37Å; Q33-V79 PolarHBondContact O-N 3.28Å
34	T	72.3	Confident	78	Confident	88 Å²	88	64.6 Å²	64.6	54%	0.54	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.1	171.8	-47	0	0	0	0	108.7	P32 V77	P32-T34 PolarHBondContact O-N 2.8Å; P32-T34 VanDerWaalsContact O-N 3.11Å; T34-V77 WeakPolarHBondContact CA-O 3.39Å
35	I	77.6	Confident	78.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114	-179.6	-59.8	178.6	0	0	0	107.6	P32 Y39 F63 A73 P76 V77 V79 L104	P32-I35 HydrophobicContact CG-CG1 4.27Å; I35-Y39 HydrophobicContact CG2-CD1 3.76Å; I35-Y39 HydrophobicContact CG2-CG 3.84Å; I35-F63 HydrophobicContact CD1-CE1 4.43Å; I35-F63 HydrophobicContact CD1-CZ 4.38Å; I35-A73 HydrophobicContact CG2-CB 3.72Å; I35-P76 WeakPolarHBondContact O-CA 3.4Å; I35-V77 HydrophobicContact CB-CB 4.3Å; I35-V77 PolarHBondContact N-O 3.22Å; I35-V77 PolarHBondContact O-N 2.77Å; I35-V79 HydrophobicContact CD1-CG2 3.64Å; I35-V79 HydrophobicContact CG1-CG2 4.06Å; I35-L104 HydrophobicContact CD1-CD1 3.84Å
36	P	68.8	Low	78	Confident	72 Å²	72	64.5 Å²	64.5	47%	0.468	36%	0.357	S	S	.	.			trans	-76.3	160.9	177.8	31.4	-34.2	0	0	0	111.8	G38 Y39	P36-G38 PolarHBondContact O-N 3.37Å; P36-Y39 HydrophobicContact CG-CD2 4.36Å; P36-Y39 WeakPolarHBondContact O-CB 3.48Å; P36-Y39 PolarHBondContact O-N 2.79Å; P36-Y39 VanDerWaalsContact O-N 3.14Å
37	V	79.5	Confident	77.7	Confident	91 Å²	91	66.6 Å²	66.6	55%	0.552	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	135.6	174.9	-176.4	0	0	0	0	110.4	Y39 L74 P76	V37-Y39 VanDerWaalsContact C-N 3.3Å; V37-Y39 PolarHBondContact O-N 3.05Å; V37-L74 WeakPolarHBondContact CG1-O 3.23Å; V37-P76 HydrophobicContact CG2-CG 4.05Å
38	G	74.2	Confident	77	Confident	47 Å²	47	66.2 Å²	66.2	49%	0.485	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	-4.2	-178.2	0	0	0	0	0	115.2	P36 Q40 A73	P36-G38 PolarHBondContact O-N 3.37Å; G38-Q40 PolarHBondContact O-N 3.24Å; G38-A73 PolarHBondContact N-O 3.37Å
39	Y	82.3	Confident	76.6	Confident	89 Å²	89	61.1 Å²	61.1	35%	0.349	35%	0.354	S	S	.	.			trans	-65.4	128.2	174.1	-172.9	-82.1	0	0	0	111	P32 I35 P36 V37 V41 V72 A73	P32-Y39 HydrophobicContact CG-CE2 4.15Å; I35-Y39 HydrophobicContact CG2-CD1 3.76Å; I35-Y39 HydrophobicContact CG2-CG 3.84Å; P36-Y39 HydrophobicContact CG-CD2 4.36Å; P36-Y39 WeakPolarHBondContact O-CB 3.48Å; P36-Y39 PolarHBondContact O-N 2.79Å; P36-Y39 VanDerWaalsContact O-N 3.14Å; V37-Y39 VanDerWaalsContact C-N 3.3Å; V37-Y39 PolarHBondContact O-N 3.05Å; Y39-V41 HydrophobicContact CD1-CG2 4.48Å; Y39-V72 WeakPolarHBondContact O-CA 2.99Å; Y39-A73 PolarHBondContact O-N 2.78Å; Y39-A73 VanDerWaalsContact O-N 3.11Å
40	Q	86.2	Confident	76.3	Confident	126 Å²	126	63.2 Å²	63.2	59%	0.589	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	116.8	176.2	-59.3	-174.1	10.6	0	0	109.4	G38 V70 I71 V72	G38-Q40 PolarHBondContact O-N 3.24Å; Q40-V70 HydrophobicContact CB-CG1 4.1Å; Q40-V70 HydrophobicContact CG-CG1 4.08Å; Q40-I71 WeakPolarHBondContact CA-O 2.9Å; Q40-V72 HydrophobicContact CG-CG2 4.23Å
41	V	83.3	Confident	75.9	Confident	15 Å²	15	64 Å²	64	9%	0.091	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-57.1	-174.8	171.2	0	0	0	0	110.8	V29 Y39 F63 I71 L104	V29-V41 HydrophobicContact CB-CG1 4.5Å; V29-V41 HydrophobicContact CG1-CG1 3.97Å; V29-V41 WeakPolarHBondContact CG1-O 3.45Å; Y39-V41 HydrophobicContact CD1-CG2 4.48Å; V41-F63 HydrophobicContact CG2-CD1 4.04Å; V41-F63 HydrophobicContact CG2-CE1 3.73Å; V41-I71 HydrophobicContact CB-CB 4.21Å; V41-I71 HydrophobicContact CB-CG2 4.12Å; V41-I71 HydrophobicContact CG2-CG2 4.31Å; V41-I71 PolarHBondContact N-O 3.33Å; V41-L104 HydrophobicContact CG1-CD2 3.52Å
42	T	83.4	Confident	75.9	Confident	42 Å²	42	72.9 Å²	72.9	26%	0.258	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	177	178.6	-168	0	0	0	0	109.2	L27 V29 I71	L27-T42 HydrophobicContact CD2-CG2 3.85Å; V29-T42 HydrophobicContact CG2-CG2 3.8Å; T42-I71 HydrophobicContact CG2-CD1 4.04Å; T42-I71 PolarHBondContact O-N 2.96Å
43	K	84	Confident	76.1	Confident	101 Å²	101	72.6 Å²	72.6	44%	0.439	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	130.1	169.4	-176	-171.4	162.7	-135.2	0	109.7	E45 N68 G69 V70	K43-E45 IonicContact NZ-OE1 2.56Å; K43-E45 PolarHBondContact NZ-OE1 2.75Å; K43-N68 WeakPolarHBondContact CE-O 3.36Å; K43-G69 WeakPolarHBondContact CA-O 3.43Å; K43-V70 HydrophobicContact CB-CG2 4.08Å; K43-V70 HydrophobicContact CD-CG2 4.39Å; K43-V70 HydrophobicContact CG-CG2 3.95Å
44	V	83.4	Confident	76.6	Confident	4 Å²	4	69 Å²	69	2%	0.024	39%	0.392	C	S	.	.			trans	-78.5	126.8	170.6	-170.8	0	0	0	0	109	I23 F56 I65 G69 I71 V88 M100	I23-V44 HydrophobicContact CB-CG1 4.26Å; I23-V44 HydrophobicContact CG2-CG1 3.71Å; V44-F56 HydrophobicContact CB-CE1 4.13Å; V44-F56 HydrophobicContact CB-CZ 4.49Å; V44-F56 HydrophobicContact CG1-CE1 3.86Å; V44-I65 HydrophobicContact CB-CD1 4.34Å; V44-I65 HydrophobicContact CG2-CD1 3.65Å; V44-G69 PolarHBondContact N-O 3.2Å; V44-I71 HydrophobicContact CG2-CD1 3.84Å; V44-I71 HydrophobicContact CG2-CG1 4.18Å; V44-V88 HydrophobicContact CG2-CG1 4.43Å; V44-M100 HydrophobicContact CB-CE 4.16Å; V44-M100 HydrophobicContact CG1-CE 3.61Å; V44-M100 HydrophobicContact CG2-CE 3.58Å
45	E	79.8	Confident	76.9	Confident	129 Å²	129	73.9 Å²	73.9	60%	0.603	40%	0.4	S	S	*	.			trans	-103.9	115.8	172	-53.2	-143.4	125.9	0	0	108.6	K43	K43-E45 IonicContact NZ-OE1 2.56Å; K43-E45 PolarHBondContact NZ-OE1 2.75Å
46	A	76.1	Confident	77.2	Confident	34 Å²	34	75.4 Å²	75.4	28%	0.281	41%	0.407	S	S	.	.			trans	-106.6	133.8	-177.7	0	0	0	0	0	109.9	I23 C49 L54 F56	I23-A46 HydrophobicContact CG2-CB 3.53Å; A46-C49 VanDerWaalsContact CB-SG 3.57Å; A46-L54 HydrophobicContact CB-CD2 3.95Å; A46-F56 HydrophobicContact CB-CE1 4.16Å; A46-F56 HydrophobicContact CB-CZ 3.97Å
47	V	74.5	Confident	77.9	Confident	103 Å²	103	75.7 Å²	75.7	62%	0.624	41%	0.408	S	S	*	.	B	Isolated β-bridge	trans	-116.4	139.2	-170.2	-177.7	0	0	0	0	109.6	Y22 C49	Y22-V47 PolarHBondContact N-O 3.49Å; Y22-V47 PolarHBondContact O-N 2.84Å; V47-C49 PolarHBondContact O-N 2.85Å
48	G	68.8	Low	78.2	Confident	44 Å²	44	72.8 Å²	72.8	45%	0.454	39%	0.39	S	S	.	.	S	Bend	trans	79.5	-16.8	-176.6	0	0	0	0	0	115.6
49	C	71.6	Confident	78.6	Confident	19 Å²	19	75.3 Å²	75.3	13%	0.128	39%	0.389	C	S	.	.			trans	-72.7	146.6	-177.8	-43	0	0	0	0	113.8	C21 A46 V47 P51 L54	C21-C49 WeakPolarHBondContact CA-SG 3.41Å; C21-C49 HydrophobicContact CB-CB 3.7Å; C21-C49 WeakPolarHBondContact CB-SG 3.34Å; C21-C49 WeakPolarHBondContact SG-CB 3.06Å; C21-C49 CovalentContact SG-SG 2.03Å; C21-C49 PolarHBondContact SG-SG 2.9Å; A46-C49 VanDerWaalsContact CB-SG 3.57Å; V47-C49 PolarHBondContact O-N 2.85Å; C49-P51 WeakPolarHBondContact O-CD 3.12Å; C49-L54 HydrophobicContact CB-CB 4.47Å; C49-L54 HydrophobicContact CB-CD1 4.08Å; C49-L54 HydrophobicContact CB-CD2 3.9Å; C49-L54 HydrophobicContact CB-CG 4.39Å
50	D	72.5	Confident	78.5	Confident	60 Å²	60	72 Å²	72	32%	0.321	38%	0.377	S	S	.	.			trans	-75.6	114.6	165.8	164.7	37.9	0	0	0	111.5	K52 T53 L54	D50-K52 PolarHBondContact O-N 3.04Å; D50-K52 WeakPolarHBondContact OD1-CB 3.46Å; D50-K52 PolarHBondContact OD1-N 3.28Å; D50-T53 PolarHBondContact O-N 3.05Å; D50-T53 VanDerWaalsContact O-N 3.12Å; D50-T53 WeakPolarHBondContact OD2-CB 3.43Å; D50-T53 VanDerWaalsContact OD2-CG2 3.29Å; D50-T53 WeakPolarHBondContact OD2-CG2 3.17Å; D50-T53 PolarHBondContact OD2-N 2.84Å; D50-T53 VanDerWaalsContact OD2-N 3.14Å; D50-T53 PolarHBondContact OD2-OG1 2.97Å; D50-L54 VanDerWaalsContact O-CB 3.27Å; D50-L54 WeakPolarHBondContact O-CB 3.23Å; D50-L54 PolarHBondContact O-N 2.81Å
51	P	67.4	Low	78.4	Confident	116 Å²	116	71.5 Å²	71.5	75%	0.753	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-5.2	-177.8	30.4	-37.2	0	0	0	114.5	C49	C49-P51 WeakPolarHBondContact O-CD 3.12Å
52	K	70.9	Confident	78.3	Confident	192 Å²	192	71.6 Å²	71.6	84%	0.835	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-21.2	172.8	-66.7	-179.5	179.1	175.5	0	114	D50	D50-K52 PolarHBondContact O-N 3.04Å; D50-K52 WeakPolarHBondContact OD1-CB 3.46Å; D50-K52 PolarHBondContact OD1-N 3.28Å
53	T	72.6	Confident	78.5	Confident	40 Å²	40	70 Å²	70	25%	0.245	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-15.3	-178	55.5	0	0	0	0	114	D50 R55 N93	D50-T53 PolarHBondContact O-N 3.05Å; D50-T53 VanDerWaalsContact O-N 3.12Å; D50-T53 WeakPolarHBondContact OD2-CB 3.43Å; D50-T53 VanDerWaalsContact OD2-CG2 3.29Å; D50-T53 WeakPolarHBondContact OD2-CG2 3.17Å; D50-T53 PolarHBondContact OD2-N 2.84Å; D50-T53 VanDerWaalsContact OD2-N 3.14Å; D50-T53 PolarHBondContact OD2-OG1 2.97Å; T53-R55 PolarHBondContact O-N 2.84Å; T53-N93 WeakPolarHBondContact CB-ND2 3.42Å; T53-N93 VanDerWaalsContact CG2-ND2 3.35Å; T53-N93 WeakPolarHBondContact CG2-ND2 3.01Å
54	L	78.4	Confident	78.6	Confident	38 Å²	38	67.9 Å²	67.9	20%	0.199	37%	0.372	C	S	.	.			trans	-52.5	129.7	172	-179.7	58.6	0	0	0	112.5	C21 A46 C49 D50 F56 A90	C21-L54 VanDerWaalsContact SG-CD1 3.59Å; A46-L54 HydrophobicContact CB-CD2 3.95Å; C49-L54 HydrophobicContact CB-CB 4.47Å; C49-L54 HydrophobicContact CB-CD1 4.08Å; C49-L54 HydrophobicContact CB-CD2 3.9Å; C49-L54 HydrophobicContact CB-CG 4.39Å; D50-L54 VanDerWaalsContact O-CB 3.27Å; D50-L54 WeakPolarHBondContact O-CB 3.23Å; D50-L54 PolarHBondContact O-N 2.81Å; L54-F56 HydrophobicContact CD2-CE1 4.37Å; L54-F56 HydrophobicContact CD2-CE2 3.72Å; L54-F56 HydrophobicContact CD2-CZ 3.6Å; L54-F56 HydrophobicContact CG-CD2 4.46Å; L54-F56 HydrophobicContact CG-CE2 4.04Å; L54-F56 HydrophobicContact CG-CZ 4.17Å; L54-A90 HydrophobicContact CD1-CB 4.13Å
55	R	78.7	Confident	78.8	Confident	189 Å²	189	68.6 Å²	68.6	71%	0.713	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.6	171.4	-62.3	-179.1	-178.9	-169.2	-0.9	109.2	T53 A90 Q91	T53-R55 PolarHBondContact O-N 2.84Å; R55-A90 WeakPolarHBondContact O-CA 3.39Å; R55-Q91 PolarHBondContact N-O 2.69Å; R55-Q91 PolarHBondContact O-N 3.07Å
56	F	85.1	Confident	79	Confident	32 Å²	32	66.4 Å²	66.4	14%	0.14	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.5	170.1	-63.3	-80.4	0	0	0	110.1	I23 V44 A46 L54 I65 R89 A90	I23-F56 HydrophobicContact CG2-CE1 4.31Å; V44-F56 HydrophobicContact CB-CE1 4.13Å; V44-F56 HydrophobicContact CB-CZ 4.49Å; V44-F56 HydrophobicContact CG1-CE1 3.86Å; A46-F56 HydrophobicContact CB-CE1 4.16Å; A46-F56 HydrophobicContact CB-CZ 3.97Å; L54-F56 HydrophobicContact CD2-CE1 4.37Å; L54-F56 HydrophobicContact CD2-CE2 3.72Å; L54-F56 HydrophobicContact CD2-CZ 3.6Å; L54-F56 HydrophobicContact CG-CD2 4.46Å; L54-F56 HydrophobicContact CG-CE2 4.04Å; L54-F56 HydrophobicContact CG-CZ 4.17Å; F56-I65 HydrophobicContact CB-CB 4.25Å; F56-I65 HydrophobicContact CB-CD1 3.63Å; F56-I65 HydrophobicContact CB-CG1 3.81Å; F56-I65 HydrophobicContact CB-CG2 3.45Å; F56-I65 VanDerWaalsContact CB-CG2 3.45Å; F56-I65 HydrophobicContact CD1-CD1 3.93Å; F56-I65 HydrophobicContact CD2-CD1 4.27Å; F56-I65 HydrophobicContact CD2-CG1 4.42Å; F56-I65 HydrophobicContact CG-CD1 3.73Å; F56-I65 HydrophobicContact CG-CG1 4.17Å; F56-R89 CarbonylContact C-O 3.57Å; F56-R89 WeakPolarHBondContact CA-O 2.99Å; F56-A90 HydrophobicContact CD1-CB 3.8Å; F56-A90 HydrophobicContact CE1-CB 3.85Å
57	T	82.1	Confident	78.9	Confident	79 Å²	79	71 Å²	71	49%	0.485	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.8	174.8	50.4	0	0	0	0	109.9	V88 R89	T57-V88 CarbonylContact O-C 3.6Å; T57-V88 WeakPolarHBondContact O-CA 3.14Å; T57-R89 PolarHBondContact N-O 3.45Å; T57-R89 PolarHBondContact O-N 3.35Å; T57-R89 PolarHBondContact OG1-O 3.35Å
58	V	87.5	Confident	79	Confident	29 Å²	29	70.1 Å²	70.1	18%	0.176	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.6	172.7	-177.9	0	0	0	0	108	D60 F63 I65 F86 V88	V58-D60 HydrophobicContact CG1-CB 4.33Å; V58-F63 HydrophobicContact CG1-CB 4.14Å; V58-I65 HydrophobicContact CG2-CB 3.76Å; V58-I65 HydrophobicContact CG2-CG2 3.71Å; V58-F86 HydrophobicContact CG1-CD2 3.58Å; V58-F86 HydrophobicContact CG1-CE2 3.8Å; V58-V88 HydrophobicContact CG1-CG2 4.48Å; V58-V88 HydrophobicContact CG2-CG1 4.22Å; V58-V88 HydrophobicContact CG2-CG2 4.09Å
59	E	82.4	Confident	79.3	Confident	100 Å²	100	68 Å²	68	47%	0.467	37%	0.365	S	S	.	.	S	Bend	trans	-87.7	-18	-178.5	-56.8	-170.6	149.3	0	0	113.3	P61 S87 R89	E59-P61 WeakPolarHBondContact O-CD 3.37Å; E59-S87 WeakPolarHBondContact CB-OG 3.48Å; E59-S87 WeakPolarHBondContact CG-OG 3.48Å; E59-S87 PolarHBondContact N-O 3.49Å; E59-S87 PolarHBondContact OE2-OG 3.23Å; E59-R89 IonicContact OE1-CZ 2.83Å; E59-R89 VanDerWaalsContact OE1-CZ 3.25Å; E59-R89 IonicContact OE1-NH1 2.71Å; E59-R89 PolarHBondContact OE1-NH1 2.99Å; E59-R89 IonicContact OE1-NH2 3.12Å; E59-R89 PolarHBondContact OE1-NH2 2.96Å
60	D	80.4	Confident	80.1	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.102	36%	0.364	C	S	.	.	S	Bend	trans	-82.4	114.4	172.2	-174.7	-25.9	0	0	0	111.2	V58 S62 F63 R84 F86	V58-D60 HydrophobicContact CG1-CB 4.33Å; D60-S62 PolarHBondContact O-N 3.36Å; D60-S62 WeakPolarHBondContact OD1-CB 3.25Å; D60-S62 PolarHBondContact OD1-N 3.25Å; D60-S62 PolarHBondContact OD1-OG 3.41Å; D60-F63 HydrophobicContact CB-CD2 4.22Å; D60-F63 PolarHBondContact O-N 2.55Å; D60-F63 VanDerWaalsContact O-N 3.15Å; D60-R84 VanDerWaalsContact CG-NH2 3.27Å; D60-R84 IonicContact OD1-NH2 3.99Å; D60-R84 PolarHBondContact OD1-NH2 2.97Å; D60-R84 IonicContact OD2-CZ 3.33Å; D60-R84 VanDerWaalsContact OD2-CZ 3.23Å; D60-R84 IonicContact OD2-NE 3.91Å; D60-R84 PolarHBondContact OD2-NE 3.34Å; D60-R84 IonicContact OD2-NH2 3.08Å; D60-R84 PolarHBondContact OD2-NH2 3.4Å; D60-F86 HydrophobicContact CB-CB 3.6Å; D60-F86 HydrophobicContact CB-CG 4.07Å
61	P	82.6	Confident	80.8	Confident	116 Å²	116	65 Å²	65	75%	0.753	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.7	-175.1	30.5	-37.4	0	0	0	114.2	E59	E59-P61 WeakPolarHBondContact O-CD 3.37Å
62	S	82.3	Confident	81.7	Confident	18 Å²	18	60.2 Å²	60.2	13%	0.126	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.8	174.8	-32.6	0	0	0	0	112.6	D60 L74 S75 R84	D60-S62 PolarHBondContact O-N 3.36Å; D60-S62 WeakPolarHBondContact OD1-CB 3.25Å; D60-S62 PolarHBondContact OD1-N 3.25Å; D60-S62 PolarHBondContact OD1-OG 3.41Å; S62-L74 PolarHBondContact O-N 3.35Å; S62-S75 PolarHBondContact O-N 3.4Å; S62-R84 PolarHBondContact OG-NH2 2.81Å
63	F	86.3	Confident	82.4	Confident	7 Å²	7	51.1 Å²	51.1	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	161.5	-176.3	-62.6	-79.7	0	0	0	111.4	I35 V41 V58 D60 I71 V72 A73 V77 F86 L104	I35-F63 HydrophobicContact CD1-CE1 4.43Å; I35-F63 HydrophobicContact CD1-CZ 4.38Å; V41-F63 HydrophobicContact CG2-CD1 4.04Å; V41-F63 HydrophobicContact CG2-CE1 3.73Å; V58-F63 HydrophobicContact CG1-CB 4.14Å; D60-F63 HydrophobicContact CB-CD2 4.22Å; D60-F63 PolarHBondContact O-N 2.55Å; D60-F63 VanDerWaalsContact O-N 3.15Å; F63-I71 HydrophobicContact CB-CG2 4.24Å; F63-I71 HydrophobicContact CD1-CG2 4.34Å; F63-V72 CarbonylContact C-O 3.6Å; F63-V72 WeakPolarHBondContact CA-O 3.41Å; F63-A73 HydrophobicContact CD1-CB 4.04Å; F63-A73 HydrophobicContact CE1-CB 3.97Å; F63-V77 HydrophobicContact CE1-CG2 4.35Å; F63-V77 HydrophobicContact CE2-CG1 4.21Å; F63-V77 HydrophobicContact CE2-CG2 4.06Å; F63-V77 HydrophobicContact CZ-CB 4.01Å; F63-V77 HydrophobicContact CZ-CG1 3.81Å; F63-V77 HydrophobicContact CZ-CG2 3.81Å; F63-F86 HydrophobicContact CD2-CD1 4.06Å; F63-F86 AromaticContact CD2-CE1 3.86Å; F63-F86 HydrophobicContact CD2-CE1 3.86Å; F63-F86 HydrophobicContact CD2-CZ 4.19Å; F63-F86 AromaticContact CE2-CD1 3.98Å; F63-F86 HydrophobicContact CE2-CD1 3.98Å; F63-F86 AromaticContact CE2-CE1 3.76Å; F63-F86 HydrophobicContact CE2-CE1 3.76Å; F63-F86 HydrophobicContact CE2-CZ 4.48Å; F63-F86 HydrophobicContact CG-CE1 4.37Å; F63-F86 HydrophobicContact CG-CZ 4.3Å; F63-F86 HydrophobicContact CZ-CE1 4.2Å; F63-L104 HydrophobicContact CE1-CD1 4.47Å; F63-L104 HydrophobicContact CE2-CD1 4.19Å; F63-L104 HydrophobicContact CZ-CD1 3.66Å
64	T	87.9	Confident	82.9	Confident	57 Å²	57	54 Å²	54	35%	0.35	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.7	169.3	-165.1	0	0	0	0	109.9	I71 V72 L74	T64-I71 CarbonylContact O-C 3.42Å; T64-I71 WeakPolarHBondContact O-CA 3.49Å; T64-V72 HydrophobicContact CG2-CB 4.33Å; T64-V72 PolarHBondContact N-O 3.46Å; T64-V72 PolarHBondContact O-N 3.03Å; T64-L74 HydrophobicContact CG2-CD1 4.33Å; T64-L74 HydrophobicContact CG2-CD2 3.75Å; T64-L74 HydrophobicContact CG2-CG 3.88Å
65	I	87.3	Confident	82.6	Confident	20 Å²	20	54.4 Å²	54.4	10%	0.103	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.8	175.2	-174.7	155.4	0	0	0	109.6	V44 F56 V58 V70 I71 V88	V44-I65 HydrophobicContact CB-CD1 4.34Å; V44-I65 HydrophobicContact CG2-CD1 3.65Å; F56-I65 HydrophobicContact CB-CB 4.25Å; F56-I65 HydrophobicContact CB-CD1 3.63Å; F56-I65 HydrophobicContact CB-CG1 3.81Å; F56-I65 HydrophobicContact CB-CG2 3.45Å; F56-I65 VanDerWaalsContact CB-CG2 3.45Å; F56-I65 HydrophobicContact CD1-CD1 3.93Å; F56-I65 HydrophobicContact CD2-CD1 4.27Å; F56-I65 HydrophobicContact CD2-CG1 4.42Å; F56-I65 HydrophobicContact CG-CD1 3.73Å; F56-I65 HydrophobicContact CG-CG1 4.17Å; V58-I65 HydrophobicContact CG2-CB 3.76Å; V58-I65 HydrophobicContact CG2-CG2 3.71Å; I65-V70 WeakPolarHBondContact CA-O 3.27Å; I65-I71 HydrophobicContact CB-CG1 4.36Å; I65-I71 HydrophobicContact CD1-CG1 3.82Å; I65-I71 HydrophobicContact CG1-CG1 4.21Å; I65-V88 HydrophobicContact CD1-CG1 3.89Å
66	Q	84.4	Confident	82.5	Confident	83 Å²	83	50.1 Å²	50.1	39%	0.388	29%	0.294	S	S	.	.			trans	-75.4	158.1	176.6	-67.7	-177.7	1.9	0	0	110.5	N68 G69 V70 V72	Q66-N68 WeakPolarHBondContact CB-OD1 2.87Å; Q66-N68 PolarHBondContact O-N 2.93Å; Q66-N68 PolarHBondContact OE1-ND2 3.39Å; Q66-N68 VanDerWaalsContact OE1-ND2 3.12Å; Q66-G69 PolarHBondContact O-N 3.08Å; Q66-V70 PolarHBondContact N-O 3.35Å; Q66-V72 HydrophobicContact CG-CG2 4.37Å
67	S	73.8	Confident	82	Confident	129 Å²	129	48.7 Å²	48.7	90%	0.902	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-9.1	179	51.8	0	0	0	0	114.9
68	N	75.8	Confident	81.5	Confident	85 Å²	85	48.7 Å²	48.7	46%	0.455	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	2.7	172.9	61.8	14.9	0	0	0	113.6	K43 Q66 V70	K43-N68 WeakPolarHBondContact CE-O 3.36Å; Q66-N68 WeakPolarHBondContact CB-OD1 2.87Å; Q66-N68 PolarHBondContact O-N 2.93Å; Q66-N68 PolarHBondContact OE1-ND2 3.39Å; Q66-N68 VanDerWaalsContact OE1-ND2 3.12Å; N68-V70 WeakPolarHBondContact OD1-CB 3.48Å; N68-V70 WeakPolarHBondContact OD1-CG2 3.14Å; N68-V70 PolarHBondContact OD1-N 3.49Å
69	G	76.3	Confident	80.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	87.9	0.2	-177.7	0	0	0	0	0	115.8	K43 V44 Q66	K43-G69 WeakPolarHBondContact CA-O 3.43Å; V44-G69 PolarHBondContact N-O 3.2Å; Q66-G69 PolarHBondContact O-N 3.08Å
70	V	87.3	Confident	79.5	Confident	17 Å²	17	45.2 Å²	45.2	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	125.8	-178.2	-179.4	0	0	0	0	111.5	Q40 K43 I65 Q66 N68 V72	Q40-V70 HydrophobicContact CB-CG1 4.1Å; Q40-V70 HydrophobicContact CG-CG1 4.08Å; K43-V70 HydrophobicContact CB-CG2 4.08Å; K43-V70 HydrophobicContact CD-CG2 4.39Å; K43-V70 HydrophobicContact CG-CG2 3.95Å; I65-V70 WeakPolarHBondContact CA-O 3.27Å; Q66-V70 PolarHBondContact N-O 3.35Å; N68-V70 WeakPolarHBondContact OD1-CB 3.48Å; N68-V70 WeakPolarHBondContact OD1-CG2 3.14Å; N68-V70 PolarHBondContact OD1-N 3.49Å; V70-V72 HydrophobicContact CG1-CG2 4.04Å
71	I	86.6	Confident	78.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	132.3	175.7	-58	168.7	0	0	0	109.8	Q40 V41 T42 V44 F63 T64 I65 F86 V88 V102	Q40-I71 WeakPolarHBondContact CA-O 2.9Å; V41-I71 HydrophobicContact CB-CB 4.21Å; V41-I71 HydrophobicContact CB-CG2 4.12Å; V41-I71 HydrophobicContact CG2-CG2 4.31Å; V41-I71 PolarHBondContact N-O 3.33Å; T42-I71 HydrophobicContact CG2-CD1 4.04Å; T42-I71 PolarHBondContact O-N 2.96Å; V44-I71 HydrophobicContact CG2-CD1 3.84Å; V44-I71 HydrophobicContact CG2-CG1 4.18Å; F63-I71 HydrophobicContact CB-CG2 4.24Å; F63-I71 HydrophobicContact CD1-CG2 4.34Å; T64-I71 CarbonylContact O-C 3.42Å; T64-I71 WeakPolarHBondContact O-CA 3.49Å; I65-I71 HydrophobicContact CB-CG1 4.36Å; I65-I71 HydrophobicContact CD1-CG1 3.82Å; I65-I71 HydrophobicContact CG1-CG1 4.21Å; I71-F86 HydrophobicContact CD1-CE2 4.26Å; I71-F86 HydrophobicContact CD1-CZ 4.46Å; I71-F86 HydrophobicContact CG2-CE2 4.32Å; I71-F86 HydrophobicContact CG2-CZ 4.07Å; I71-V88 HydrophobicContact CD1-CG2 3.96Å; I71-V102 HydrophobicContact CD1-CG2 4.13Å
72	V	87.4	Confident	77	Confident	14 Å²	14	52.9 Å²	52.9	9%	0.085	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.1	-174.8	-169.8	0	0	0	0	110.6	Y39 Q40 F63 T64 Q66 V70	Y39-V72 WeakPolarHBondContact O-CA 2.99Å; Q40-V72 HydrophobicContact CG-CG2 4.23Å; F63-V72 CarbonylContact C-O 3.6Å; F63-V72 WeakPolarHBondContact CA-O 3.41Å; T64-V72 HydrophobicContact CG2-CB 4.33Å; T64-V72 PolarHBondContact N-O 3.46Å; T64-V72 PolarHBondContact O-N 3.03Å; Q66-V72 HydrophobicContact CG-CG2 4.37Å; V70-V72 HydrophobicContact CG1-CG2 4.04Å
73	A	85.3	Confident	76.3	Confident	1 Å²	1	53 Å²	53	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.6	175	0	0	0	0	0	112.4	I35 G38 Y39 F63	I35-A73 HydrophobicContact CG2-CB 3.72Å; G38-A73 PolarHBondContact N-O 3.37Å; Y39-A73 PolarHBondContact O-N 2.78Å; Y39-A73 VanDerWaalsContact O-N 3.11Å; F63-A73 HydrophobicContact CD1-CB 4.04Å; F63-A73 HydrophobicContact CE1-CB 3.97Å
74	L	83.1	Confident	76	Confident	102 Å²	102	56.3 Å²	56.3	53%	0.534	32%	0.324	S	S	.	.	S	Bend	trans	-92.9	-28.6	174.4	-72.9	-177.7	0	0	0	113	V37 S62 T64	V37-L74 WeakPolarHBondContact CG1-O 3.23Å; S62-L74 PolarHBondContact O-N 3.35Å; T64-L74 HydrophobicContact CG2-CD1 4.33Å; T64-L74 HydrophobicContact CG2-CD2 3.75Å; T64-L74 HydrophobicContact CG2-CG 3.88Å
75	S	72.3	Confident	75.7	Confident	45 Å²	45	57 Å²	57	32%	0.315	33%	0.328	S	S	.	.	S	Bend	trans	-127.4	163.6	176.6	60.4	0	0	0	0	110.5	S62 V77	S62-S75 PolarHBondContact O-N 3.4Å; S75-V77 PolarHBondContact O-N 2.88Å
76	P	75.4	Confident	75.6	Confident	99 Å²	99	56.5 Å²	56.5	64%	0.643	33%	0.326	S	S	*	.			trans	-66.1	117.1	174.7	-17.9	31.5	0	0	0	110.5	I35 V37	I35-P76 WeakPolarHBondContact O-CA 3.4Å; V37-P76 HydrophobicContact CG2-CG 4.05Å
77	V	75	Confident	75.7	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.7	-177.8	172.7	0	0	0	0	110.8	T34 I35 F63 S75 V79	T34-V77 WeakPolarHBondContact CA-O 3.39Å; I35-V77 HydrophobicContact CB-CB 4.3Å; I35-V77 PolarHBondContact N-O 3.22Å; I35-V77 PolarHBondContact O-N 2.77Å; F63-V77 HydrophobicContact CE1-CG2 4.35Å; F63-V77 HydrophobicContact CE2-CG1 4.21Å; F63-V77 HydrophobicContact CE2-CG2 4.06Å; F63-V77 HydrophobicContact CZ-CB 4.01Å; F63-V77 HydrophobicContact CZ-CG1 3.81Å; F63-V77 HydrophobicContact CZ-CG2 3.81Å; S75-V77 PolarHBondContact O-N 2.88Å; V77-V79 HydrophobicContact CG1-CG2 4.27Å
78	S	71.9	Confident	76.2	Confident	79 Å²	79	47.6 Å²	47.6	55%	0.552	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.1	164.5	-170.1	0	0	0	0	109.9	Q33	Q33-S78 WeakPolarHBondContact O-CA 3.37Å
79	V	70.3	Confident	76.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-102.5	116	173.9	-178.2	0	0	0	0	107.8	Q33 I35 V77 R84 L104 C106	Q33-V79 PolarHBondContact O-N 3.28Å; I35-V79 HydrophobicContact CD1-CG2 3.64Å; I35-V79 HydrophobicContact CG1-CG2 4.06Å; V77-V79 HydrophobicContact CG1-CG2 4.27Å; V79-R84 HydrophobicContact CG1-CB 4.42Å; V79-L104 HydrophobicContact CG1-CB 4.07Å; V79-L104 HydrophobicContact CG2-CB 4.34Å; V79-L104 HydrophobicContact CG2-CD1 3.89Å; V79-C106 HydrophobicContact CG1-CB 4.38Å
80	A	58.3	Low	77	Confident	55 Å²	55	47.3 Å²	47.3	46%	0.455	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-67.8	161.8	178.7	0	0	0	0	0	111.7	R82 G83	A80-R82 PolarHBondContact O-N 2.97Å; A80-R82 VanDerWaalsContact O-N 3.14Å; A80-G83 WeakPolarHBondContact O-CA 3.46Å; A80-G83 PolarHBondContact O-N 3.32Å
81	T	55.5	Low	76.6	Confident	116 Å²	116	51.8 Å²	51.8	71%	0.712	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.8	177.6	48.4	0	0	0	0	114.1	G83	T81-G83 VanDerWaalsContact C-N 3.27Å
82	R	54.4	Low	76.1	Confident	180 Å²	180	52.3 Å²	52.3	68%	0.679	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-3.2	171.1	-58.8	-179.7	-174.1	148.1	7.1	113.5	A80 E870	A80-R82 PolarHBondContact O-N 2.97Å; A80-R82 VanDerWaalsContact O-N 3.14Å; R82-E870 PolarHBondContact NH2-O 2.88Å
83	G	68.3	Low	75.2	Confident	21 Å²	21	57.8 Å²	57.8	22%	0.216	32%	0.316	C	S	.	.			trans	83.1	-179.1	-169.8	0	0	0	0	0	114	A80 T81 L104	A80-G83 WeakPolarHBondContact O-CA 3.46Å; A80-G83 PolarHBondContact O-N 3.32Å; T81-G83 VanDerWaalsContact C-N 3.27Å; G83-L104 CarbonylContact C-O 3.58Å; G83-L104 WeakPolarHBondContact CA-O 3.26Å
84	R	79.3	Confident	74.1	Confident	76 Å²	76	61.3 Å²	61.3	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	122.8	171.4	177.8	177.2	-179.6	148.5	-5.9	109.1	D60 S62 V79 L104	D60-R84 VanDerWaalsContact CG-NH2 3.27Å; D60-R84 IonicContact OD1-NH2 3.99Å; D60-R84 PolarHBondContact OD1-NH2 2.97Å; D60-R84 IonicContact OD2-CZ 3.33Å; D60-R84 VanDerWaalsContact OD2-CZ 3.23Å; D60-R84 IonicContact OD2-NE 3.91Å; D60-R84 PolarHBondContact OD2-NE 3.34Å; D60-R84 IonicContact OD2-NH2 3.08Å; D60-R84 PolarHBondContact OD2-NH2 3.4Å; S62-R84 PolarHBondContact OG-NH2 2.81Å; V79-R84 HydrophobicContact CG1-CB 4.42Å; R84-L104 HydrophobicContact CB-CB 4.37Å; R84-L104 HydrophobicContact CB-CD1 4.45Å; R84-L104 PolarHBondContact N-O 2.82Å; R84-L104 VanDerWaalsContact O-CB 3.3Å; R84-L104 WeakPolarHBondContact O-CB 3.14Å; R84-L104 PolarHBondContact O-N 3.27Å
85	T	82.6	Confident	73.1	Confident	72 Å²	72	57.6 Å²	57.6	44%	0.442	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	143.6	175.8	-51.8	0	0	0	0	110.6	E101 V102 H103	T85-E101 HydrophobicContact CG2-CB 3.95Å; T85-E101 HydrophobicContact CG2-CG 4.21Å; T85-E101 WeakPolarHBondContact CG2-OE2 3.39Å; T85-V102 WeakPolarHBondContact CA-O 3.47Å; T85-H103 VanDerWaalsContact CG2-ND1 3.31Å; T85-H103 WeakPolarHBondContact CG2-ND1 3.31Å; T85-H103 PolarHBondContact OG1-ND1 2.6Å
86	F	84.9	Confident	72.6	Confident	10 Å²	10	60.6 Å²	60.6	4%	0.044	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.2	163.7	60.7	-93.7	0	0	0	111.9	V58 D60 F63 I71 V88 V102 L104	V58-F86 HydrophobicContact CG1-CD2 3.58Å; V58-F86 HydrophobicContact CG1-CE2 3.8Å; D60-F86 HydrophobicContact CB-CB 3.6Å; D60-F86 HydrophobicContact CB-CG 4.07Å; F63-F86 HydrophobicContact CD2-CD1 4.06Å; F63-F86 AromaticContact CD2-CE1 3.86Å; F63-F86 HydrophobicContact CD2-CE1 3.86Å; F63-F86 HydrophobicContact CD2-CZ 4.19Å; F63-F86 AromaticContact CE2-CD1 3.98Å; F63-F86 HydrophobicContact CE2-CD1 3.98Å; F63-F86 AromaticContact CE2-CE1 3.76Å; F63-F86 HydrophobicContact CE2-CE1 3.76Å; F63-F86 HydrophobicContact CE2-CZ 4.48Å; F63-F86 HydrophobicContact CG-CE1 4.37Å; F63-F86 HydrophobicContact CG-CZ 4.3Å; F63-F86 HydrophobicContact CZ-CE1 4.2Å; I71-F86 HydrophobicContact CD1-CE2 4.26Å; I71-F86 HydrophobicContact CD1-CZ 4.46Å; I71-F86 HydrophobicContact CG2-CE2 4.32Å; I71-F86 HydrophobicContact CG2-CZ 4.07Å; F86-V88 HydrophobicContact CD2-CG2 3.84Å; F86-V88 HydrophobicContact CE2-CG2 3.61Å; F86-V102 HydrophobicContact CD2-CB 4.21Å; F86-V102 HydrophobicContact CE1-CB 4.26Å; F86-V102 HydrophobicContact CE1-CG1 4.03Å; F86-V102 HydrophobicContact CE2-CB 3.84Å; F86-V102 HydrophobicContact CE2-CG1 4.17Å; F86-V102 HydrophobicContact CE2-CG2 4.18Å; F86-V102 HydrophobicContact CZ-CB 3.87Å; F86-V102 HydrophobicContact CZ-CG1 3.69Å; F86-V102 PolarHBondContact N-O 2.89Å; F86-V102 PolarHBondContact O-N 2.93Å; F86-L104 HydrophobicContact CE1-CD1 3.94Å; F86-L104 HydrophobicContact CE1-CD2 4.21Å; F86-L104 HydrophobicContact CE1-CG 3.91Å
87	S	85.4	Confident	72.3	Confident	24 Å²	24	57.7 Å²	57.7	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	141.7	177.8	37	0	0	0	0	112.3	E59 E99 M100	E59-S87 WeakPolarHBondContact CB-OG 3.48Å; E59-S87 WeakPolarHBondContact CG-OG 3.48Å; E59-S87 PolarHBondContact N-O 3.49Å; E59-S87 PolarHBondContact OE2-OG 3.23Å; S87-E99 VanDerWaalsContact CB-OE1 3.31Å; S87-E99 WeakPolarHBondContact CB-OE1 3.38Å; S87-M100 WeakPolarHBondContact CA-O 3.46Å
88	V	85.9	Confident	72.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119.5	170.6	-172.8	0	0	0	0	108.5	I23 V44 T57 V58 I65 I71 F86 E99 M100 V102	I23-V88 VanDerWaalsContact CD1-O 3.32Å; I23-V88 WeakPolarHBondContact CD1-O 3.31Å; V44-V88 HydrophobicContact CG2-CG1 4.43Å; T57-V88 CarbonylContact O-C 3.6Å; T57-V88 WeakPolarHBondContact O-CA 3.14Å; V58-V88 HydrophobicContact CG1-CG2 4.48Å; V58-V88 HydrophobicContact CG2-CG1 4.22Å; V58-V88 HydrophobicContact CG2-CG2 4.09Å; I65-V88 HydrophobicContact CD1-CG1 3.89Å; I71-V88 HydrophobicContact CD1-CG2 3.96Å; F86-V88 HydrophobicContact CD2-CG2 3.84Å; F86-V88 HydrophobicContact CE2-CG2 3.61Å; V88-E99 WeakPolarHBondContact O-CA 3.47Å; V88-M100 HydrophobicContact CB-CE 4.48Å; V88-M100 PolarHBondContact N-O 2.93Å; V88-M100 PolarHBondContact O-N 3.34Å; V88-V102 HydrophobicContact CG2-CG2 3.66Å
89	R	85.4	Confident	73	Confident	80 Å²	80	58.4 Å²	58.4	30%	0.302	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.3	179.6	-161.1	176.7	-67.3	120.5	7.2	110.6	F56 T57 E59 S98 E99	F56-R89 CarbonylContact C-O 3.57Å; F56-R89 WeakPolarHBondContact CA-O 2.99Å; T57-R89 PolarHBondContact N-O 3.45Å; T57-R89 PolarHBondContact O-N 3.35Å; T57-R89 PolarHBondContact OG1-O 3.35Å; E59-R89 IonicContact OE1-CZ 2.83Å; E59-R89 VanDerWaalsContact OE1-CZ 3.25Å; E59-R89 IonicContact OE1-NH1 2.71Å; E59-R89 PolarHBondContact OE1-NH1 2.99Å; E59-R89 IonicContact OE1-NH2 3.12Å; E59-R89 PolarHBondContact OE1-NH2 2.96Å; R89-S98 CarbonylContact C-O 3.59Å; R89-S98 WeakPolarHBondContact CA-O 3.29Å; R89-S98 WeakPolarHBondContact CG-O 3.37Å; R89-E99 HydrophobicContact CB-CG 4.33Å; R89-E99 HydrophobicContact CG-CB 4.2Å; R89-E99 HydrophobicContact CG-CG 4.47Å; R89-E99 IonicContact CZ-OE1 3.93Å; R89-E99 IonicContact CZ-OE2 2.76Å; R89-E99 IonicContact NE-OE2 3.02Å; R89-E99 PolarHBondContact NE-OE2 3.1Å; R89-E99 IonicContact NH2-OE1 3.2Å; R89-E99 PolarHBondContact NH2-OE1 3.18Å; R89-E99 IonicContact NH2-OE2 3.85Å; R89-E99 PolarHBondContact NH2-OE2 3.03Å
90	A	82.4	Confident	73.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.8	173.1	0	0	0	0	0	109.9	I23 L54 R55 F56 G97 S98	I23-A90 HydrophobicContact CD1-CB 3.75Å; I23-A90 HydrophobicContact CG1-CB 4.1Å; I23-A90 HydrophobicContact CG2-CB 3.78Å; L54-A90 HydrophobicContact CD1-CB 4.13Å; R55-A90 WeakPolarHBondContact O-CA 3.39Å; F56-A90 HydrophobicContact CD1-CB 3.8Å; F56-A90 HydrophobicContact CE1-CB 3.85Å; A90-G97 CarbonylContact O-C 3.59Å; A90-G97 WeakPolarHBondContact O-CA 3.43Å; A90-S98 PolarHBondContact N-O 3.09Å; A90-S98 PolarHBondContact O-N 3.11Å
91	Q	78.1	Confident	75	Confident	111 Å²	111	60.8 Å²	60.8	52%	0.519	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	134.6	179	-173.3	172	23.4	0	0	110.9	R55	R55-Q91 PolarHBondContact N-O 2.69Å; R55-Q91 PolarHBondContact O-N 3.07Å
92	D	76.4	Confident	76.5	Confident	11 Å²	11	55.2 Å²	55.2	6%	0.059	30%	0.298	C	S	.	.			trans	-113.6	-177.8	166.2	76.4	22.3	0	0	0	111.3	C21 S94 G95	C21-D92 WeakPolarHBondContact CB-OD2 3.29Å; D92-S94 PolarHBondContact O-N 2.96Å; D92-S94 WeakPolarHBondContact OD1-CA 3.26Å; D92-S94 WeakPolarHBondContact OD1-CB 3.37Å; D92-S94 PolarHBondContact OD1-N 2.51Å; D92-S94 PolarHBondContact OD1-OG 3.42Å; D92-S94 PolarHBondContact OD2-OG 2.95Å; D92-G95 PolarHBondContact OD1-N 2.94Å
93	N	69.2	Low	77.8	Confident	129 Å²	129	48.3 Å²	48.3	69%	0.69	27%	0.273	S	S	*	.	S	Bend	trans	-81.3	5.3	-176.4	-69.5	-29.9	0	0	0	114.2	T53	T53-N93 WeakPolarHBondContact CB-ND2 3.42Å; T53-N93 VanDerWaalsContact CG2-ND2 3.35Å; T53-N93 WeakPolarHBondContact CG2-ND2 3.01Å
94	S	61.4	Low	78.4	Confident	75 Å²	75	47.3 Å²	47.3	52%	0.524	26%	0.263	S	S	.	.	S	Bend	trans	-122.3	-9.3	-164.8	8.2	0	0	0	0	114.7	D92	D92-S94 PolarHBondContact O-N 2.96Å; D92-S94 WeakPolarHBondContact OD1-CA 3.26Å; D92-S94 WeakPolarHBondContact OD1-CB 3.37Å; D92-S94 PolarHBondContact OD1-N 2.51Å; D92-S94 PolarHBondContact OD1-OG 3.42Å; D92-S94 PolarHBondContact OD2-OG 2.95Å
95	G	62.9	Low	78.2	Confident	24 Å²	24	46.8 Å²	46.8	25%	0.247	27%	0.268	C	S	.	.	S	Bend	trans	-154.5	176.1	-179.2	0	0	0	0	0	115	D92	D92-G95 PolarHBondContact OD1-N 2.94Å
96	P	61.8	Low	77.2	Confident	108 Å²	108	44 Å²	44	70%	0.701	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-63.9	144.5	166.3	30.2	-34.2	0	0	0	110
97	G	69.4	Low	75.8	Confident	37 Å²	37	47 Å²	47	38%	0.381	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-67.7	143.9	178.6	0	0	0	0	0	112.7	A90	A90-G97 CarbonylContact O-C 3.59Å; A90-G97 WeakPolarHBondContact O-CA 3.43Å
98	S	77.4	Confident	74.1	Confident	20 Å²	20	49.4 Å²	49.4	14%	0.14	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	149.5	175.9	172.8	0	0	0	0	109.6	C21 I23 R89 A90	C21-S98 VanDerWaalsContact O-CB 3.27Å; C21-S98 WeakPolarHBondContact O-CB 3.24Å; I23-S98 VanDerWaalsContact CG1-OG 3.3Å; I23-S98 WeakPolarHBondContact CG1-OG 3.33Å; I23-S98 PolarHBondContact N-OG 2.7Å; I23-S98 VanDerWaalsContact N-OG 3.09Å; I23-S98 PolarHBondContact O-OG 3.42Å; R89-S98 CarbonylContact C-O 3.59Å; R89-S98 WeakPolarHBondContact CA-O 3.29Å; R89-S98 WeakPolarHBondContact CG-O 3.37Å; A90-S98 PolarHBondContact N-O 3.09Å; A90-S98 PolarHBondContact O-N 3.11Å
99	E	83.9	Confident	72.1	Confident	78 Å²	78	58.7 Å²	58.7	36%	0.364	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	141	-169.8	-171.4	165.8	176.3	0	0	111.8	S87 V88 R89	S87-E99 VanDerWaalsContact CB-OE1 3.31Å; S87-E99 WeakPolarHBondContact CB-OE1 3.38Å; V88-E99 WeakPolarHBondContact O-CA 3.47Å; R89-E99 HydrophobicContact CB-CG 4.33Å; R89-E99 HydrophobicContact CG-CB 4.2Å; R89-E99 HydrophobicContact CG-CG 4.47Å; R89-E99 IonicContact CZ-OE1 3.93Å; R89-E99 IonicContact CZ-OE2 2.76Å; R89-E99 IonicContact NE-OE2 3.02Å; R89-E99 PolarHBondContact NE-OE2 3.1Å; R89-E99 IonicContact NH2-OE1 3.2Å; R89-E99 PolarHBondContact NH2-OE1 3.18Å; R89-E99 IonicContact NH2-OE2 3.85Å; R89-E99 PolarHBondContact NH2-OE2 3.03Å
100	M	84.9	Confident	70.2	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.2	-174	178.5	169.9	63.4	0	0	111	I23 P24 D25 L27 V44 S87 V88 V102	I23-M100 HydrophobicContact CD1-CB 3.66Å; I23-M100 HydrophobicContact CG1-CB 4.19Å; P24-M100 HydrophobicContact CB-SD 4.35Å; P24-M100 WeakPolarHBondContact O-CA 3.46Å; P24-M100 WeakPolarHBondContact O-CB 3.32Å; P24-M100 WeakPolarHBondContact O-CG 3.43Å; D25-M100 WeakPolarHBondContact O-CA 3.35Å; L27-M100 HydrophobicContact CB-CE 4.44Å; L27-M100 HydrophobicContact CB-CG 4.18Å; L27-M100 HydrophobicContact CB-SD 3.55Å; L27-M100 VanDerWaalsContact CB-SD 3.55Å; L27-M100 HydrophobicContact CD2-CE 4.1Å; L27-M100 HydrophobicContact CD2-SD 4.01Å; L27-M100 HydrophobicContact CG-SD 4.41Å; V44-M100 HydrophobicContact CB-CE 4.16Å; V44-M100 HydrophobicContact CG1-CE 3.61Å; V44-M100 HydrophobicContact CG2-CE 3.58Å; S87-M100 WeakPolarHBondContact CA-O 3.46Å; V88-M100 HydrophobicContact CB-CE 4.48Å; V88-M100 PolarHBondContact N-O 2.93Å; V88-M100 PolarHBondContact O-N 3.34Å; M100-V102 HydrophobicContact CE-CG2 3.77Å; M100-V102 HydrophobicContact CG-CG2 4.36Å
101	E	86.1	Confident	68.3	Low	102 Å²	102	66.3 Å²	66.3	48%	0.477	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	115.8	166	-73.3	-164.6	-172.6	0	0	111.2	D25 S26 L27 T85 H103	D25-E101 PolarHBondContact O-N 2.86Å; S26-E101 CarbonylContact C-O 3.51Å; S26-E101 VanDerWaalsContact CA-O 3.24Å; S26-E101 WeakPolarHBondContact CA-O 3.26Å; S26-E101 WeakPolarHBondContact CB-O 3.45Å; L27-E101 PolarHBondContact N-O 3.24Å; T85-E101 HydrophobicContact CG2-CB 3.95Å; T85-E101 HydrophobicContact CG2-CG 4.21Å; T85-E101 WeakPolarHBondContact CG2-OE2 3.39Å; E101-H103 IonicContact OE2-CE1 3.96Å; E101-H103 PolarHBondContact OE2-CE1 3Å; E101-H103 IonicContact OE2-NE2 3.44Å
102	V	85.9	Confident	66.7	Low	0 Å²	0	64.8 Å²	64.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.1	173.7	179.4	0	0	0	0	109.3	L27 V29 I71 T85 F86 V88 M100 L104	L27-V102 CarbonylContact O-C 3.49Å; L27-V102 WeakPolarHBondContact O-CA 3.41Å; V29-V102 HydrophobicContact CG2-CG1 4Å; I71-V102 HydrophobicContact CD1-CG2 4.13Å; T85-V102 WeakPolarHBondContact CA-O 3.47Å; F86-V102 HydrophobicContact CD2-CB 4.21Å; F86-V102 HydrophobicContact CE1-CB 4.26Å; F86-V102 HydrophobicContact CE1-CG1 4.03Å; F86-V102 HydrophobicContact CE2-CB 3.84Å; F86-V102 HydrophobicContact CE2-CG1 4.17Å; F86-V102 HydrophobicContact CE2-CG2 4.18Å; F86-V102 HydrophobicContact CZ-CB 3.87Å; F86-V102 HydrophobicContact CZ-CG1 3.69Å; F86-V102 PolarHBondContact N-O 2.89Å; F86-V102 PolarHBondContact O-N 2.93Å; V88-V102 HydrophobicContact CG2-CG2 3.66Å; M100-V102 HydrophobicContact CE-CG2 3.77Å; M100-V102 HydrophobicContact CG-CG2 4.36Å; V102-L104 HydrophobicContact CG1-CD2 4.42Å
103	H	82.5	Confident	65.5	Low	34 Å²	34	67.6 Å²	67.6	16%	0.157	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	101.3	178.6	-54.3	-68.5	0	0	0	110.5	L27 H28 V29 T85 E101 V105	L27-H103 PolarHBondContact O-N 3.39Å; H28-H103 WeakPolarHBondContact CA-O 3.3Å; H28-H103 AromaticContact CE1-CD2 3.27Å; H28-H103 PolarHBondContact CE1-CD2 2.62Å; H28-H103 AromaticContact CE1-CG 3.66Å; H28-H103 WeakPolarHBondContact ND1-CB 3.47Å; H28-H103 AromaticContact ND1-CD2 3.66Å; H28-H103 AromaticContact ND1-CG 3.79Å; H28-H103 AromaticContact NE2-CD2 3.51Å; V29-H103 PolarHBondContact N-O 2.85Å; T85-H103 VanDerWaalsContact CG2-ND1 3.31Å; T85-H103 WeakPolarHBondContact CG2-ND1 3.31Å; T85-H103 PolarHBondContact OG1-ND1 2.6Å; E101-H103 IonicContact OE2-CE1 3.96Å; E101-H103 PolarHBondContact OE2-CE1 3Å; E101-H103 IonicContact OE2-NE2 3.44Å; H103-V105 PolarHBondContact O-N 2.71Å
104	L	81.4	Confident	64.6	Low	1 Å²	1	71.1 Å²	71.1	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	116	168.9	-58.8	-178.2	0	0	0	109.6	V29 I35 V41 F63 V79 G83 R84 F86 V102	V29-L104 HydrophobicContact CB-CD2 4.24Å; V29-L104 WeakPolarHBondContact O-CA 3.4Å; I35-L104 HydrophobicContact CD1-CD1 3.84Å; V41-L104 HydrophobicContact CG1-CD2 3.52Å; F63-L104 HydrophobicContact CE1-CD1 4.47Å; F63-L104 HydrophobicContact CE2-CD1 4.19Å; F63-L104 HydrophobicContact CZ-CD1 3.66Å; V79-L104 HydrophobicContact CG1-CB 4.07Å; V79-L104 HydrophobicContact CG2-CB 4.34Å; V79-L104 HydrophobicContact CG2-CD1 3.89Å; G83-L104 CarbonylContact C-O 3.58Å; G83-L104 WeakPolarHBondContact CA-O 3.26Å; R84-L104 HydrophobicContact CB-CB 4.37Å; R84-L104 HydrophobicContact CB-CD1 4.45Å; R84-L104 PolarHBondContact N-O 2.82Å; R84-L104 VanDerWaalsContact O-CB 3.3Å; R84-L104 WeakPolarHBondContact O-CB 3.14Å; R84-L104 PolarHBondContact O-N 3.27Å; F86-L104 HydrophobicContact CE1-CD1 3.94Å; F86-L104 HydrophobicContact CE1-CD2 4.21Å; F86-L104 HydrophobicContact CE1-CG 3.91Å; V102-L104 HydrophobicContact CG1-CD2 4.42Å
105	V	74.9	Confident	64	Low	65 Å²	65	74.8 Å²	74.8	39%	0.394	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	173.5	-174.9	0	0	0	0	108.5	V29 V30 S31 H103 S107	V29-V105 PolarHBondContact O-N 2.84Å; V30-V105 WeakPolarHBondContact CA-O 3.13Å; S31-V105 PolarHBondContact N-O 2.98Å; S31-V105 PolarHBondContact OG-O 3.1Å; H103-V105 PolarHBondContact O-N 2.71Å; V105-S107 PolarHBondContact O-N 2.85Å
106	C	61.7	Low	63.3	Low	12 Å²	12	76.1 Å²	76.1	8%	0.081	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	128.4	-179.3	-175.7	0	0	0	0	111.2	S31 V79 T108	S31-C106 CarbonylContact O-C 3.49Å; S31-C106 WeakPolarHBondContact O-CA 3.4Å; V79-C106 HydrophobicContact CG1-CB 4.38Å; C106-T108 PolarHBondContact O-N 2.87Å
107	S	53.8	Low	62.5	Low	73 Å²	73	77.5 Å²	77.5	51%	0.51	42%	0.416	S	S	.	.			trans	-71.8	69.7	174.1	-161.2	0	0	0	0	111.5	S31 V105 K109	S31-S107 PolarHBondContact O-N 2.87Å; V105-S107 PolarHBondContact O-N 2.85Å; S107-K109 PolarHBondContact O-N 2.86Å
108	T	50.2	Low	61.1	Low	76 Å²	76	78.9 Å²	78.9	47%	0.466	42%	0.417	S	S	.	.			trans	-80.1	97.2	166.6	49.1	0	0	0	0	108.8	C106 Q110	C106-T108 PolarHBondContact O-N 2.87Å; T108-Q110 PolarHBondContact O-N 3.39Å
109	K	45.2	Very low	59.5	Low	194 Å²	194	82.3 Å²	82.3	84%	0.843	43%	0.433	S	S	*	.			trans	-61.1	97.6	148.7	-86.2	-169.4	175.2	-175.5	0	106.2	S107 E111	S107-K109 PolarHBondContact O-N 2.86Å; K109-E111 PolarHBondContact O-N 2.87Å
110	Q	44.7	Very low	57.4	Low	115 Å²	115	86 Å²	86	54%	0.537	45%	0.454	S	S	.	.			trans	-68.3	104.3	172.1	-69.9	179	-10.7	0	0	107	T108 T112 V118	T108-Q110 PolarHBondContact O-N 3.39Å; Q110-T112 PolarHBondContact O-N 2.86Å; Q110-V118 HydrophobicContact CB-CG1 4.11Å; Q110-V118 HydrophobicContact CB-CG2 4.34Å; Q110-V118 HydrophobicContact CG-CG1 3.92Å; Q110-V118 HydrophobicContact CG-CG2 4.49Å
111	E	42.4	Very low	55.2	Low	126 Å²	126	92.5 Å²	92.5	59%	0.589	48%	0.483	S	S	*	.			trans	-66.3	105.1	168.9	-70.3	-166.1	151.9	0	0	107.6	K109 I119 Y855	K109-E111 PolarHBondContact O-N 2.87Å; E111-I119 WeakPolarHBondContact O-CD1 3.21Å; E111-I119 WeakPolarHBondContact O-CG1 3.22Å; E111-I119 PolarHBondContact O-N 2.86Å; E111-Y855 PolarHBondContact OE2-OH 3.32Å
112	T	45	Very low	52.9	Low	79 Å²	79	98.7 Å²	98.7	49%	0.485	50%	0.502	S	S	.	.	B	Isolated β-bridge	trans	-83.5	133.6	167.9	52	0	0	0	0	108.9	Q110 Q117	Q110-T112 PolarHBondContact O-N 2.86Å; T112-Q117 WeakPolarHBondContact CA-O 3.28Å
113	N	51	Low	50.5	Low	69 Å²	69	105 Å²	105	37%	0.369	54%	0.54	S	S	.	.			trans	-61.4	169	159.7	54.2	27.6	0	0	0	110.5	N115 G116 Q117	N113-N115 PolarHBondContact O-N 2.93Å; N113-G116 PolarHBondContact O-N 3.01Å; N113-Q117 PolarHBondContact N-O 3.28Å; N113-Q117 PolarHBondContact OD1-N 3.44Å; N113-Q117 VanDerWaalsContact OD1-N 3.12Å; N113-Q117 PolarHBondContact OD1-O 3.36Å
114	E	49.2	Very low	48.5	Very low	204 Å²	204	110.7 Å²	110.7	95%	0.953	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-19	-170.7	-61.8	-172.5	140.4	0	0	114.8
115	N	49.3	Very low	46.5	Very low	152 Å²	152	118.3 Å²	118.3	81%	0.813	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	10.4	177	-65.4	-36.4	0	0	0	114.4	N113	N113-N115 PolarHBondContact O-N 2.93Å
116	G	48.7	Very low	45.3	Very low	51 Å²	51	119.8 Å²	119.8	53%	0.526	59%	0.592	S	S	.	*			trans	81.5	14.9	170.8	0	0	0	0	0	116.2	N113	N113-G116 PolarHBondContact O-N 3.01Å
117	Q	44.5	Very low	44.8	Very low	137 Å²	137	128.1 Å²	128.1	64%	0.64	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-93.6	136.3	179.7	-67.1	-175	-20.9	0	0	112.3	T112 N113 I119	T112-Q117 WeakPolarHBondContact CA-O 3.28Å; N113-Q117 PolarHBondContact N-O 3.28Å; N113-Q117 PolarHBondContact OD1-N 3.44Å; N113-Q117 VanDerWaalsContact OD1-N 3.12Å; N113-Q117 PolarHBondContact OD1-O 3.36Å; Q117-I119 PolarHBondContact O-N 2.87Å
118	V	40.9	Very low	45	Very low	67 Å²	67	126.8 Å²	126.8	41%	0.406	61%	0.613	S	S	.	*	B	Isolated β-bridge	trans	-71.8	120.8	-178.9	-178.8	0	0	0	0	110.8	Q110	Q110-V118 HydrophobicContact CB-CG1 4.11Å; Q110-V118 HydrophobicContact CB-CG2 4.34Å; Q110-V118 HydrophobicContact CG-CG1 3.92Å; Q110-V118 HydrophobicContact CG-CG2 4.49Å
119	I	43.5	Very low	46.1	Very low	92 Å²	92	125.3 Å²	125.3	47%	0.472	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-76.2	123.5	177.1	-59.7	171.2	0	0	0	109.9	E111 Q117	E111-I119 WeakPolarHBondContact O-CD1 3.21Å; E111-I119 WeakPolarHBondContact O-CG1 3.22Å; E111-I119 PolarHBondContact O-N 2.86Å; Q117-I119 PolarHBondContact O-N 2.87Å
120	L	40.6	Very low	47.6	Very low	154 Å²	154	118.2 Å²	118.2	81%	0.806	58%	0.578	S	S	*	*			trans	-96	103.1	-177.6	-68.6	174.8	0	0	0	111.7
121	K	38	Very low	49.6	Very low	139 Å²	139	114.5 Å²	114.5	60%	0.604	56%	0.564	S	S	*	*			trans	-76.1	135.1	175.1	-160.9	165.9	-171.5	170	0	111.1	D854	K121-D854 IonicContact NZ-OD1 2.92Å; K121-D854 PolarHBondContact NZ-OD1 3.45Å
122	R	38.5	Very low	51.9	Low	232 Å²	232	109.8 Å²	109.8	88%	0.875	54%	0.542	S	S	*	.			trans	-117	153.9	174.1	-85.5	-177.1	164.9	174.3	-3.5	110.9
123	T	35.7	Very low	54	Low	132 Å²	132	109.8 Å²	109.8	81%	0.81	54%	0.539	S	S	*	.			trans	-125.9	144.2	177	39.9	0	0	0	0	111.3
124	K	39.8	Very low	56	Low	154 Å²	154	106.9 Å²	106.9	67%	0.67	52%	0.524	S	S	*	.			trans	-111.8	133.7	179.8	-178.5	-179.5	175.7	-174.5	0	107.4	D152	K124-D152 IonicContact NZ-OD2 3.25Å; K124-D152 PolarHBondContact NZ-OD2 3.37Å
125	R	39.1	Very low	58	Low	162 Å²	162	101.4 Å²	101.4	61%	0.611	50%	0.5	S	S	*	.			trans	-75.6	135.3	169.6	-61.7	-166.2	-165.5	-162.5	9.3	108.8	D848	R125-D848 IonicContact CZ-OD2 2.81Å; R125-D848 IonicContact NH1-OD2 3.96Å; R125-D848 PolarHBondContact NH1-OD2 3.47Å
126	R	50.4	Low	60.2	Low	96 Å²	96	94.2 Å²	94.2	36%	0.362	46%	0.462	S	S	.	.			trans	-103.4	113.9	170.3	-160.5	178.5	-131.6	-174.5	7.8	107.4	D215 Y853	R126-D215 IonicContact CZ-OD2 2.69Å; R126-D215 IonicContact NH1-OD2 3.23Å; R126-D215 IonicContact NH2-OD2 3.05Å; R126-D215 PolarHBondContact NH2-OD2 2.71Å; R126-Y853 PolarHBondContact NH1-OH 3.23Å
127	W	50.5	Low	62.2	Low	186 Å²	186	95.5 Å²	95.5	71%	0.705	46%	0.457	S	S	*	.	B	Isolated β-bridge	trans	-69	135.9	164.9	-58.8	107.8	0	0	0	107.8	A846	W127-A846 HydrophobicContact CB-CB 3.69Å; W127-A846 HydrophobicContact CD2-CB 4.31Å; W127-A846 HydrophobicContact CE3-CB 3.72Å; W127-A846 HydrophobicContact CG-CB 4.37Å
128	S	58.7	Low	64.4	Low	46 Å²	46	90.7 Å²	90.7	32%	0.322	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-63.5	149.8	164.4	24.6	0	0	0	0	110	A846 G847	S128-A846 WeakPolarHBondContact O-CB 3.32Å; S128-A846 WeakPolarHBondContact OG-CA 3.33Å; S128-G847 PolarHBondContact OG-N 2.03Å; S128-G847 PolarHBondContact OG-O 2.96Å
129	P	73.5	Confident	66.5	Low	44 Å²	44	92 Å²	92	29%	0.286	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-66.6	152.7	178.9	27.6	-31.5	0	0	0	110.3	L218 I220	P129-L218 HydrophobicContact CG-CD1 4.34Å; P129-L218 HydrophobicContact CG-CG 4.38Å; P129-I220 HydrophobicContact CG-CG1 4.04Å
130	P	76.3	Confident	68.4	Low	45 Å²	45	89 Å²	89	29%	0.292	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-61.4	156.6	170.4	30.4	-36.5	0	0	0	110.6	I132 R844	P130-I132 PolarHBondContact O-N 3.32Å; P130-R844 HydrophobicContact CB-CB 3.91Å; P130-R844 HydrophobicContact CB-CG 3.64Å
131	P	86.9	Confident	70.7	Confident	38 Å²	38	87.4 Å²	87.4	25%	0.247	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-60.1	139.2	168.9	27.4	-33.8	0	0	0	110.1	V221 K223	P131-V221 CarbonylContact C-O 3.56Å; P131-V221 WeakPolarHBondContact CA-O 3.43Å; P131-V221 HydrophobicContact CB-CB 4.28Å; P131-V221 HydrophobicContact CB-CG1 4.07Å; P131-K223 HydrophobicContact CB-CD 4.12Å; P131-K223 HydrophobicContact CB-CG 4.05Å; P131-K223 HydrophobicContact CG-CD 4.44Å
132	I	90.3	Very high	73.2	Confident	26 Å²	26	84 Å²	84	13%	0.133	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.1	168.6	-58.9	175.2	0	0	0	106.9	P130 L146 E147 L185 I220 V221 V222 K223	P130-I132 PolarHBondContact O-N 3.32Å; I132-L146 HydrophobicContact CG2-CB 4.24Å; I132-L146 HydrophobicContact CG2-CD2 4.49Å; I132-E147 HydrophobicContact CD1-CB 3.73Å; I132-E147 HydrophobicContact CD1-CG 4.45Å; I132-L185 HydrophobicContact CD1-CD2 3.95Å; I132-I220 HydrophobicContact CD1-CG2 3.77Å; I132-I220 HydrophobicContact CG1-CG2 4.18Å; I132-V221 PolarHBondContact N-O 3.27Å; I132-V222 HydrophobicContact CB-CG2 4.38Å; I132-V222 CarbonylContact O-C 3.56Å; I132-V222 VanDerWaalsContact O-CA 3.26Å; I132-V222 WeakPolarHBondContact O-CA 3.32Å; I132-K223 PolarHBondContact O-N 2.94Å
133	N	89.8	Confident	75.7	Confident	79 Å²	79	76.4 Å²	76.4	42%	0.422	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.6	178.3	-72.5	24.8	0	0	0	111.2	K223 D225	N133-K223 WeakPolarHBondContact CA-O 3.45Å; N133-D225 WeakPolarHBondContact CB-OD2 3.39Å; N133-D225 PolarHBondContact ND2-OD1 3.49Å; N133-D225 PolarHBondContact ND2-OD2 2.77Å
134	I	91.4	Very high	78.3	Confident	8 Å²	8	73.8 Å²	73.8	4%	0.041	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	120.2	176.7	-53.8	175.2	0	0	0	108.7	E136 L146 F176 V187 L191 V222 K223 V224 D225	I134-E136 PolarHBondContact O-N 3.13Å; I134-L146 HydrophobicContact CD1-CD1 3.66Å; I134-L146 HydrophobicContact CD1-CD2 3.5Å; I134-L146 HydrophobicContact CD1-CG 4.25Å; I134-L146 HydrophobicContact CG1-CD2 3.74Å; I134-F176 HydrophobicContact CD1-CE1 3.8Å; I134-F176 HydrophobicContact CD1-CZ 4.39Å; I134-V187 HydrophobicContact CD1-CB 4.5Å; I134-V187 HydrophobicContact CD1-CG1 4.43Å; I134-L191 HydrophobicContact CB-CD1 4.15Å; I134-L191 HydrophobicContact CD1-CD1 3.94Å; I134-L191 HydrophobicContact CG2-CD1 4.01Å; I134-V222 HydrophobicContact CD1-CG1 3.37Å; I134-V222 HydrophobicContact CG1-CG1 3.9Å; I134-K223 PolarHBondContact N-O 2.98Å; I134-V224 CarbonylContact O-C 3.6Å; I134-V224 VanDerWaalsContact O-CA 3.29Å; I134-V224 WeakPolarHBondContact O-CA 3.4Å; I134-D225 PolarHBondContact O-N 3.46Å
135	L	92	Very high	80.8	Confident	89 Å²	89	71.4 Å²	71.4	47%	0.466	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	133.1	172.6	-162.8	73.7	0	0	0	110.8	D225 V227	L135-D225 HydrophobicContact CD1-CB 4.05Å; L135-V227 HydrophobicContact CD1-CG2 3.54Å; L135-V227 HydrophobicContact CD2-CG2 4.02Å; L135-V227 HydrophobicContact CG-CG2 3.59Å
136	E	94.6	Very high	83.3	Confident	2 Å²	2	65 Å²	65	1%	0.009	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	167.3	173.9	73.1	-169.8	124.1	0	0	113.4	I134 D138 L191 R193 V224 D225 D226 V227	I134-E136 PolarHBondContact O-N 3.13Å; E136-D138 PolarHBondContact O-N 3.2Å; E136-L191 WeakPolarHBondContact CB-O 3.18Å; E136-R193 VanDerWaalsContact CD-CB 3.44Å; E136-R193 WeakPolarHBondContact OE1-CB 3.35Å; E136-R193 WeakPolarHBondContact OE2-CB 3.37Å; E136-R193 PolarHBondContact OE2-N 3.43Å; E136-V224 HydrophobicContact CB-CG1 3.61Å; E136-D225 PolarHBondContact N-O 3.12Å; E136-D225 VanDerWaalsContact N-O 3.07Å; E136-D226 WeakPolarHBondContact OE1-CA 3.05Å; E136-V227 HydrophobicContact CG-CB 3.8Å; E136-V227 HydrophobicContact CG-CG2 3.78Å; E136-V227 PolarHBondContact OE1-N 3.33Å
137	N	92.2	Very high	85.1	Confident	77 Å²	77	65 Å²	65	41%	0.412	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	11.1	179.9	-73.6	-56.1	0	0	0	115.6	A139 L191 D229	N137-A139 PolarHBondContact O-N 3.03Å; N137-L191 PolarHBondContact N-O 2.68Å; N137-D229 PolarHBondContact ND2-OD2 2.65Å
138	D	90.2	Very high	87	Confident	36 Å²	36	58.7 Å²	58.7	19%	0.193	34%	0.341	C	S	.	.			trans	-57.7	118.1	-178.4	177.6	13.4	0	0	0	111.9	E136 G140 F142 K144 T190	E136-D138 PolarHBondContact O-N 3.2Å; D138-G140 PolarHBondContact O-N 3.49Å; D138-G140 VanDerWaalsContact O-N 3.07Å; D138-G140 PolarHBondContact OD1-N 3.26Å; D138-G140 VanDerWaalsContact OD1-N 3.1Å; D138-F142 WeakPolarHBondContact O-CE2 3.09Å; D138-F142 WeakPolarHBondContact O-CZ 3.18Å; D138-K144 WeakPolarHBondContact OD2-CD 3.38Å; D138-K144 IonicContact OD2-NZ 3.78Å; D138-K144 PolarHBondContact OD2-NZ 3.44Å; D138-T190 WeakPolarHBondContact O-CG2 3.14Å
139	A	83.9	Confident	88.4	Confident	96 Å²	96	57.4 Å²	57.4	79%	0.793	33%	0.331	S	S	*	.			trans	-67.7	-6.5	-176.4	0	0	0	0	0	114.3	N137	N137-A139 PolarHBondContact O-N 3.03Å
140	G	83.4	Confident	89	Confident	29 Å²	29	59.4 Å²	59.4	30%	0.299	34%	0.342	S	S	.	.			trans	88.4	-150.2	174.7	0	0	0	0	0	113.7	D138	D138-G140 PolarHBondContact O-N 3.49Å; D138-G140 VanDerWaalsContact O-N 3.07Å; D138-G140 PolarHBondContact OD1-N 3.26Å; D138-G140 VanDerWaalsContact OD1-N 3.1Å
141	P	89.1	Confident	89.4	Confident	120 Å²	120	57.6 Å²	57.6	78%	0.779	33%	0.33	S	S	*	.	P	Polyproline II helix	cis	-75.2	154.2	15.4	30.3	-37.2	0	0	0	114.6
142	F	90.1	Very high	89.1	Confident	66 Å²	66	60.3 Å²	60.3	29%	0.289	34%	0.343	S	S	.	.	S	Bend	trans	-103.5	151.2	174.3	-63.6	-74.8	0	0	0	111.6	D138 K144 V187 H188 K189 T190	D138-F142 WeakPolarHBondContact O-CE2 3.09Å; D138-F142 WeakPolarHBondContact O-CZ 3.18Å; F142-K144 HydrophobicContact CD1-CB 4.22Å; F142-K144 HydrophobicContact CE1-CB 4.47Å; F142-V187 HydrophobicContact CD1-CG1 4.45Å; F142-V187 HydrophobicContact CE1-CG1 4.21Å; F142-H188 WeakPolarHBondContact CB-O 3.1Å; F142-K189 VanDerWaalsContact CE1-C 3.47Å; F142-K189 VanDerWaalsContact CE1-O 3.24Å; F142-K189 WeakPolarHBondContact CE1-O 3.48Å; F142-K189 WeakPolarHBondContact CZ-O 3.45Å; F142-T190 HydrophobicContact CE2-CG2 4.13Å; F142-T190 HydrophobicContact CZ-CG2 4.28Å
143	P	92.1	Very high	88.7	Confident	73 Å²	73	60.4 Å²	60.4	47%	0.474	35%	0.346	S	S	.	.	S	Bend	cis	-73.4	134.9	-3.1	29.7	-34.3	0	0	0	112.7	Y186 V187	P143-Y186 HydrophobicContact CB-CD1 4.08Å; P143-Y186 HydrophobicContact CB-CG 4.37Å; P143-V187 CarbonylContact C-O 3.56Å; P143-V187 VanDerWaalsContact CA-O 3.24Å; P143-V187 WeakPolarHBondContact CA-O 3.06Å
144	K	91	Very high	88.3	Confident	78 Å²	78	60.2 Å²	60.2	34%	0.339	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.7	-179.7	180	174.2	172.6	177.6	0	109.5	D138 F142 Y186 V187	D138-K144 WeakPolarHBondContact OD2-CD 3.38Å; D138-K144 IonicContact OD2-NZ 3.78Å; D138-K144 PolarHBondContact OD2-NZ 3.44Å; F142-K144 HydrophobicContact CD1-CB 4.22Å; F142-K144 HydrophobicContact CE1-CB 4.47Å; K144-Y186 WeakPolarHBondContact O-CA 3.43Å; K144-V187 HydrophobicContact CB-CG1 3.86Å; K144-V187 PolarHBondContact N-O 2.97Å; K144-V187 PolarHBondContact O-N 3.26Å
145	F	92.2	Very high	87.7	Confident	104 Å²	104	66 Å²	66	46%	0.456	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	139.9	174.2	174.4	-80.9	0	0	0	110.2	T148 T184 Y186	F145-T148 WeakPolarHBondContact CE2-OG1 3.09Å; F145-T184 HydrophobicContact CD2-CG2 3.44Å; F145-T184 VanDerWaalsContact CD2-CG2 3.44Å; F145-T184 HydrophobicContact CE2-CG2 3.44Å; F145-T184 VanDerWaalsContact CE2-CG2 3.44Å; F145-Y186 HydrophobicContact CB-CD1 4.43Å; F145-Y186 HydrophobicContact CB-CE1 4.15Å
146	L	90	Very high	87	Confident	26 Å²	26	68.1 Å²	68.1	14%	0.136	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-64.8	174.7	-63.5	-175.5	0	0	0	112.1	I132 I134 F176 L185 V187	I132-L146 HydrophobicContact CG2-CB 4.24Å; I132-L146 HydrophobicContact CG2-CD2 4.49Å; I134-L146 HydrophobicContact CD1-CD1 3.66Å; I134-L146 HydrophobicContact CD1-CD2 3.5Å; I134-L146 HydrophobicContact CD1-CG 4.25Å; I134-L146 HydrophobicContact CG1-CD2 3.74Å; L146-F176 HydrophobicContact CD1-CD1 3.85Å; L146-F176 HydrophobicContact CD1-CE1 3.91Å; L146-L185 HydrophobicContact CB-CB 4.38Å; L146-L185 HydrophobicContact CB-CD2 4.24Å; L146-L185 HydrophobicContact CB-CG 4.29Å; L146-L185 HydrophobicContact CD1-CD2 3.94Å; L146-L185 HydrophobicContact CD1-CG 4.06Å; L146-L185 PolarHBondContact N-O 3.05Å; L146-V187 HydrophobicContact CD1-CB 4.13Å; L146-V187 HydrophobicContact CD1-CG1 4.42Å; L146-V187 HydrophobicContact CD2-CB 4.48Å; L146-V187 HydrophobicContact CD2-CG1 3.88Å; L146-V187 HydrophobicContact CG-CB 4.43Å; L146-V187 HydrophobicContact CG-CG1 4.25Å
147	E	89.4	Confident	86.3	Confident	97 Å²	97	71.1 Å²	71.1	45%	0.453	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	159.1	-176.3	-174	54.8	-76.4	0	0	109.8	I132 I149 L185	I132-E147 HydrophobicContact CD1-CB 3.73Å; I132-E147 HydrophobicContact CD1-CG 4.45Å; E147-I149 HydrophobicContact CB-CD1 4.49Å; E147-L185 WeakPolarHBondContact O-CB 3.31Å; E147-L185 PolarHBondContact O-N 2.81Å
148	T	89.9	Confident	86.1	Confident	53 Å²	53	72.3 Å²	72.3	33%	0.325	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.5	172.8	-60.7	0	0	0	0	110.9	F145 V150 D182 T184	F145-T148 WeakPolarHBondContact CE2-OG1 3.09Å; T148-V150 HydrophobicContact CG2-CG2 3.93Å; T148-D182 VanDerWaalsContact CG2-O 3.27Å; T148-D182 WeakPolarHBondContact CG2-O 3.46Å; T148-T184 PolarHBondContact OG1-OG1 3.42Å
149	I	87.6	Confident	86	Confident	19 Å²	19	70.8 Å²	70.8	10%	0.097	40%	0.397	C	S	.	.			trans	-111.1	110.4	-172.5	-61.8	109.1	0	0	0	110.3	E147 L178 G183 L185 I203 L218 I220	E147-I149 HydrophobicContact CB-CD1 4.49Å; I149-L178 HydrophobicContact CD1-CD1 4.18Å; I149-G183 PolarHBondContact N-O 3.19Å; I149-G183 WeakPolarHBondContact O-CA 3.35Å; I149-L185 HydrophobicContact CD1-CB 3.89Å; I149-L185 HydrophobicContact CD1-CD2 4.41Å; I149-I203 HydrophobicContact CD1-CD1 3.9Å; I149-I203 HydrophobicContact CG1-CD1 4.38Å; I149-I203 HydrophobicContact CG2-CD1 4.47Å; I149-I203 HydrophobicContact CG2-CG2 4.41Å; I149-L218 HydrophobicContact CG2-CD2 3.72Å; I149-I220 HydrophobicContact CD1-CD1 3.72Å; I149-I220 HydrophobicContact CG1-CD1 3.61Å; I149-I220 HydrophobicContact CG2-CD1 4.47Å
150	V	86.8	Confident	86.4	Confident	87 Å²	87	68.3 Å²	68.3	53%	0.527	37%	0.368	S	S	.	.			trans	-119.1	138.6	-173.6	-170.3	0	0	0	0	110.8	T148 E154	T148-V150 HydrophobicContact CG2-CG2 3.93Å; V150-E154 WeakPolarHBondContact CG1-OE2 3.2Å
151	S	84.7	Confident	86.9	Confident	6 Å²	6	67.2 Å²	67.2	4%	0.042	36%	0.355	C	S	.	.			trans	-92.9	138.5	173.9	168.4	0	0	0	0	111.5	S153 E154 Y161 D215	S151-S153 PolarHBondContact O-N 2.82Å; S151-S153 VanDerWaalsContact OG-CB 3.22Å; S151-S153 WeakPolarHBondContact OG-CB 3.49Å; S151-S153 PolarHBondContact OG-N 3.4Å; S151-S153 PolarHBondContact OG-OG 3.27Å; S151-E154 PolarHBondContact O-N 2.83Å; S151-Y161 PolarHBondContact N-OH 2.95Å; S151-D215 WeakPolarHBondContact CB-OD2 3.39Å; S151-D215 PolarHBondContact OG-OD1 3.16Å; S151-D215 PolarHBondContact OG-OD2 3.48Å
152	D	81.1	Confident	87.1	Confident	95 Å²	95	63.5 Å²	63.5	51%	0.508	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-66.5	-12.3	171.2	38.2	-5.7	0	0	0	113.2	K124 E154	K124-D152 IonicContact NZ-OD2 3.25Å; K124-D152 PolarHBondContact NZ-OD2 3.37Å; D152-E154 VanDerWaalsContact C-N 3.28Å; D152-E154 PolarHBondContact O-N 2.69Å
153	S	80.8	Confident	87.3	Confident	28 Å²	28	62 Å²	62	20%	0.196	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-68.1	-19.9	173	-63	0	0	0	0	114.2	S151 V155 Q156 H157 D215	S151-S153 PolarHBondContact O-N 2.82Å; S151-S153 VanDerWaalsContact OG-CB 3.22Å; S151-S153 WeakPolarHBondContact OG-CB 3.49Å; S151-S153 PolarHBondContact OG-N 3.4Å; S151-S153 PolarHBondContact OG-OG 3.27Å; S153-V155 PolarHBondContact O-N 2.99Å; S153-Q156 PolarHBondContact O-N 3.42Å; S153-Q156 VanDerWaalsContact O-N 3.13Å; S153-H157 PolarHBondContact O-N 3.22Å; S153-D215 PolarHBondContact OG-OD1 3.25Å
154	E	82.5	Confident	87.4	Confident	76 Å²	76	59.9 Å²	59.9	36%	0.355	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-58	-26.3	177	-79.9	-174.1	-175.8	0	0	113.7	V150 S151 D152 Q156 H157 V159 Y161	V150-E154 WeakPolarHBondContact CG1-OE2 3.2Å; S151-E154 PolarHBondContact O-N 2.83Å; D152-E154 VanDerWaalsContact C-N 3.28Å; D152-E154 PolarHBondContact O-N 2.69Å; E154-Q156 PolarHBondContact O-N 2.8Å; E154-H157 WeakPolarHBondContact CA-O 3.27Å; E154-V159 HydrophobicContact CG-CB 4.05Å; E154-V159 HydrophobicContact CG-CG2 4.44Å; E154-Y161 WeakPolarHBondContact OE1-CE2 3.32Å; E154-Y161 VanDerWaalsContact OE1-CZ 3.29Å; E154-Y161 PolarHBondContact OE1-OH 2.9Å
155	V	78.8	Confident	87.5	Confident	130 Å²	130	56.7 Å²	56.7	79%	0.788	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-65.7	-20.9	-179.8	-177.3	0	0	0	0	112	S153	S153-V155 PolarHBondContact O-N 2.99Å
156	Q	77.4	Confident	87.5	Confident	132 Å²	132	57.6 Å²	57.6	62%	0.617	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-19.2	-176.6	-62.6	179.7	12	0	0	113.8	S153 E154	S153-Q156 PolarHBondContact O-N 3.42Å; S153-Q156 VanDerWaalsContact O-N 3.13Å; E154-Q156 PolarHBondContact O-N 2.8Å
157	H	79.9	Confident	87.5	Confident	65 Å²	65	56.3 Å²	56.3	30%	0.301	30%	0.297	S	S	.	.	S	Bend	trans	-133.5	144.6	-174	-59.4	91.5	0	0	0	111.3	S153 E154 V159 D207 R214	S153-H157 PolarHBondContact O-N 3.22Å; E154-H157 WeakPolarHBondContact CA-O 3.27Å; H157-V159 HydrophobicContact CB-CG2 4.09Å; H157-V159 PolarHBondContact O-N 2.84Å; H157-D207 IonicContact CD2-OD2 2.97Å; H157-R214 HydrophobicContact CB-CG 4.37Å; H157-R214 PolarHBondContact CD2-NE 3.09Å; H157-R214 VanDerWaalsContact CD2-NE 3.29Å; H157-R214 PolarHBondContact CD2-NH2 3.02Å
158	D	86.7	Confident	87.7	Confident	102 Å²	102	52.3 Å²	52.3	55%	0.545	28%	0.28	S	S	.	.			trans	-80.6	100.4	172.6	-168.1	10.4	0	0	0	109.3	K208	D158-K208 WeakPolarHBondContact O-CB 3.33Å; D158-K208 WeakPolarHBondContact O-CG 3.45Å; D158-K208 PolarHBondContact O-N 2.81Å; D158-K208 IonicContact OD1-NZ 3.5Å; D158-K208 PolarHBondContact OD1-NZ 2.84Å
159	V	89.4	Confident	87.7	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.024	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	150	-170.1	170.2	0	0	0	0	111.8	E154 H157 Y161 A205 L206 K208 R214	E154-V159 HydrophobicContact CG-CB 4.05Å; E154-V159 HydrophobicContact CG-CG2 4.44Å; H157-V159 HydrophobicContact CB-CG2 4.09Å; H157-V159 PolarHBondContact O-N 2.84Å; V159-Y161 HydrophobicContact CG1-CE1 4.28Å; V159-Y161 HydrophobicContact CG1-CE2 4.35Å; V159-A205 HydrophobicContact CG1-CB 3.82Å; V159-L206 CarbonylContact C-O 3.58Å; V159-L206 VanDerWaalsContact CA-O 3.32Å; V159-L206 WeakPolarHBondContact CA-O 3.28Å; V159-K208 WeakPolarHBondContact O-CE 3.48Å; V159-K208 PolarHBondContact O-NZ 3.12Å; V159-R214 HydrophobicContact CG2-CB 4.48Å; V159-R214 HydrophobicContact CG2-CG 4.21Å
160	Y	91.7	Very high	87.9	Confident	45 Å²	45	58.5 Å²	58.5	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.3	165	74.5	-77.4	0	0	0	110.9	T162 S180 L206 D207 K208 H211	Y160-T162 HydrophobicContact CD2-CG2 4.09Å; Y160-T162 HydrophobicContact CE2-CG2 3.65Å; Y160-S180 CarbonylContact C-O 3.55Å; Y160-S180 VanDerWaalsContact CA-O 3.25Å; Y160-S180 WeakPolarHBondContact CA-O 2.9Å; Y160-S180 WeakPolarHBondContact CB-O 3.33Å; Y160-S180 WeakPolarHBondContact CD2-OG 3.35Å; Y160-L206 HydrophobicContact CD1-CB 3.98Å; Y160-L206 WeakPolarHBondContact CD1-O 3.35Å; Y160-L206 HydrophobicContact CE1-CB 3.49Å; Y160-L206 VanDerWaalsContact CE1-CB 3.49Å; Y160-L206 HydrophobicContact CE2-CB 4.2Å; Y160-L206 HydrophobicContact CE2-CD1 4.04Å; Y160-L206 PolarHBondContact N-O 2.94Å; Y160-L206 PolarHBondContact O-N 2.9Å; Y160-L206 WeakPolarHBondContact OH-CD1 3.25Å; Y160-D207 WeakPolarHBondContact CE1-O 3.4Å; Y160-K208 HydrophobicContact CD1-CB 4.29Å; Y160-K208 HydrophobicContact CD1-CG 3.71Å; Y160-K208 HydrophobicContact CG-CG 4.21Å; Y160-H211 AromaticContact CE1-ND1 3.63Å; Y160-H211 AromaticContact CZ-ND1 3.59Å; Y160-H211 PolarHBondContact OH-ND1 2.96Å
161	Y	93.2	Very high	88	Confident	6 Å²	6	60.7 Å²	60.7	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	144.8	-175	-60.6	-83.7	0	0	0	112.5	S151 E154 V159 S180 I203 A205	S151-Y161 PolarHBondContact N-OH 2.95Å; E154-Y161 WeakPolarHBondContact OE1-CE2 3.32Å; E154-Y161 VanDerWaalsContact OE1-CZ 3.29Å; E154-Y161 PolarHBondContact OE1-OH 2.9Å; V159-Y161 HydrophobicContact CG1-CE1 4.28Å; V159-Y161 HydrophobicContact CG1-CE2 4.35Å; Y161-S180 PolarHBondContact N-O 2.9Å; Y161-S180 WeakPolarHBondContact O-CB 3.38Å; Y161-S180 PolarHBondContact O-OG 3.11Å; Y161-I203 HydrophobicContact CD1-CG2 4.38Å; Y161-A205 HydrophobicContact CD1-CB 4.15Å; Y161-A205 HydrophobicContact CE1-CB 3.84Å
162	T	93.3	Very high	88.3	Confident	41 Å²	41	62 Å²	62	25%	0.252	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.8	172.8	58.9	0	0	0	0	110.4	Y160 I203 N204 L206	Y160-T162 HydrophobicContact CD2-CG2 4.09Å; Y160-T162 HydrophobicContact CE2-CG2 3.65Å; T162-I203 WeakPolarHBondContact O-CA 3.5Å; T162-N204 PolarHBondContact N-O 2.83Å; T162-N204 PolarHBondContact O-N 3.23Å; T162-N204 PolarHBondContact OG1-ND2 2.56Å; T162-N204 PolarHBondContact OG1-O 2.8Å; T162-L206 HydrophobicContact CG2-CD1 3.73Å
163	I	94.6	Very high	88.7	Confident	34 Å²	34	59.9 Å²	59.9	17%	0.174	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.8	-179.2	-173.5	169.2	0	0	0	110.6	A168 F176 L178 L185 L201 I203	I163-A168 HydrophobicContact CD1-CB 4.17Å; I163-A168 HydrophobicContact CG1-CB 3.86Å; I163-A168 HydrophobicContact CG2-CB 4.23Å; I163-F176 HydrophobicContact CD1-CB 4.49Å; I163-L178 HydrophobicContact CB-CB 3.78Å; I163-L178 HydrophobicContact CB-CD2 4.12Å; I163-L178 HydrophobicContact CD1-CB 4.28Å; I163-L178 HydrophobicContact CG2-CB 3.67Å; I163-L185 HydrophobicContact CD1-CD1 3.58Å; I163-L201 HydrophobicContact CD1-CB 4.18Å; I163-L201 HydrophobicContact CD1-CD1 4.17Å; I163-L201 HydrophobicContact CD1-CD2 4.35Å; I163-L201 HydrophobicContact CD1-CG 4.47Å; I163-L201 HydrophobicContact CG1-CB 4.42Å; I163-I203 HydrophobicContact CB-CG1 4.45Å; I163-I203 HydrophobicContact CD1-CG1 4.46Å; I163-I203 HydrophobicContact CG1-CG1 4.19Å
164	A	93.5	Very high	89.2	Confident	29 Å²	29	60.2 Å²	60.2	24%	0.24	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	160	174.5	0	0	0	0	0	110.5	N169 L201 T202	A164-N169 WeakPolarHBondContact CA-OD1 3.25Å; A164-L201 CarbonylContact O-C 3.57Å; A164-T202 PolarHBondContact N-O 3.02Å; A164-T202 PolarHBondContact O-N 3.28Å
165	G	93.2	Very high	89.8	Confident	12 Å²	12	57.1 Å²	57.1	12%	0.124	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124.7	175.9	180	0	0	0	0	0	113.1	A168 N169 L170	G165-A168 PolarHBondContact O-N 2.98Å; G165-A168 VanDerWaalsContact O-N 3.13Å; G165-N169 PolarHBondContact N-OD1 3.29Å; G165-N169 PolarHBondContact O-N 2.75Å; G165-N169 PolarHBondContact O-OD1 2.76Å; G165-L170 PolarHBondContact O-N 3.46Å
166	R	92.9	Very high	90.6	Very high	122 Å²	122	51 Å²	51	46%	0.46	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-66.3	133.8	175.7	-167.5	170.8	-164.1	-145.7	-1.4	109.3	A168 D171 I196 Y199 L201	R166-A168 VanDerWaalsContact C-N 3.3Å; R166-D171 VanDerWaalsContact CG-O 3.31Å; R166-D171 WeakPolarHBondContact CG-O 3.31Å; R166-D171 PolarHBondContact NE-O 2.84Å; R166-I196 VanDerWaalsContact CZ-CD1 3.44Å; R166-Y199 HydrophobicContact CG-CD1 4.5Å; R166-Y199 WeakPolarHBondContact O-CD1 3.33Å; R166-L201 WeakPolarHBondContact O-CD2 3.46Å
167	G	90.4	Very high	91.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	-25.1	-170.8	0	0	0	0	0	113.5	L170 P172 G174 I175 F176	G167-L170 PolarHBondContact N-O 2.91Å; G167-L170 VanDerWaalsContact N-O 3.14Å; G167-P172 CarbonylContact C-O 3.45Å; G167-P172 WeakPolarHBondContact CA-O 3.28Å; G167-P172 PolarHBondContact N-O 3.33Å; G167-P172 VanDerWaalsContact N-O 3.15Å; G167-G174 PolarHBondContact O-N 2.73Å; G167-I175 WeakPolarHBondContact O-CA 3.46Å; G167-I175 WeakPolarHBondContact O-CB 3.43Å; G167-I175 PolarHBondContact O-N 3.44Å; G167-F176 PolarHBondContact O-N 2.86Å
168	A	92.3	Very high	92.1	Very high	13 Å²	13	45.1 Å²	45.1	11%	0.107	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-85.1	178	0	0	0	0	0	111.2	I163 G165 R166 G174 L201	I163-A168 HydrophobicContact CD1-CB 4.17Å; I163-A168 HydrophobicContact CG1-CB 3.86Å; I163-A168 HydrophobicContact CG2-CB 4.23Å; G165-A168 PolarHBondContact O-N 2.98Å; G165-A168 VanDerWaalsContact O-N 3.13Å; R166-A168 VanDerWaalsContact C-N 3.3Å; A168-G174 PolarHBondContact O-N 3.36Å; A168-L201 HydrophobicContact CB-CD2 4.06Å
169	N	91.2	Very high	92.5	Very high	96 Å²	96	43.7 Å²	43.7	51%	0.513	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-9.6	-179.4	71	-24.4	0	0	0	113.9	A164 G165	A164-N169 WeakPolarHBondContact CA-OD1 3.25Å; G165-N169 PolarHBondContact N-OD1 3.29Å; G165-N169 PolarHBondContact O-N 2.75Å; G165-N169 PolarHBondContact O-OD1 2.76Å
170	L	91.3	Very high	92.5	Very high	106 Å²	106	45.9 Å²	45.9	56%	0.555	26%	0.261	S	S	*	.	B	Isolated β-bridge	trans	-110.2	151	173.8	-57.6	176.9	0	0	0	111	G165 G167 P172	G165-L170 PolarHBondContact O-N 3.46Å; G167-L170 PolarHBondContact N-O 2.91Å; G167-L170 VanDerWaalsContact N-O 3.14Å; L170-P172 CarbonylContact O-C 3.49Å; L170-P172 VanDerWaalsContact O-C 3.25Å
171	D	88.6	Confident	92.4	Very high	132 Å²	132	48.5 Å²	48.5	71%	0.706	28%	0.279	S	S	*	.	S	Bend	trans	-67.8	129.3	-167.8	-168.1	73.3	0	0	0	114.6	R166	R166-D171 VanDerWaalsContact CG-O 3.31Å; R166-D171 WeakPolarHBondContact CG-O 3.31Å; R166-D171 PolarHBondContact NE-O 2.84Å
172	P	91	Very high	92.1	Very high	33 Å²	33	50.9 Å²	50.9	21%	0.214	29%	0.292	C	S	.	.	S	Bend	cis	-73.9	122.8	3	29.1	-36	0	0	0	113.2	G167 L170 I175 I196 Y199	G167-P172 CarbonylContact C-O 3.45Å; G167-P172 WeakPolarHBondContact CA-O 3.28Å; G167-P172 PolarHBondContact N-O 3.33Å; G167-P172 VanDerWaalsContact N-O 3.15Å; L170-P172 CarbonylContact O-C 3.49Å; L170-P172 VanDerWaalsContact O-C 3.25Å; P172-I175 HydrophobicContact CB-CD1 3.89Å; P172-I175 HydrophobicContact CB-CG1 4.45Å; P172-I175 HydrophobicContact CG-CD1 3.54Å; P172-I196 HydrophobicContact CG-CD1 3.64Å; P172-Y199 HydrophobicContact CG-CE1 4.41Å
173	A	90.4	Very high	91.8	Very high	51 Å²	51	49 Å²	49	42%	0.421	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-86.5	153.9	-175.5	0	0	0	0	0	113.2	I175	A173-I175 PolarHBondContact O-N 3.22Å
174	G	90.8	Very high	91.8	Very high	35 Å²	35	47.8 Å²	47.8	36%	0.361	27%	0.274	S	S	.	.	S	Bend	trans	65.5	34	176.2	0	0	0	0	0	114.4	G167 A168	G167-G174 PolarHBondContact O-N 2.73Å; A168-G174 PolarHBondContact O-N 3.36Å
175	I	94.5	Very high	91.8	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.056	26%	0.263	C	S	.	.	S	Bend	trans	-83.3	-47.9	163.4	-64.3	-174.4	0	0	0	109.2	G167 P172 A173 V187 H188 L191 Y199	G167-I175 WeakPolarHBondContact O-CA 3.46Å; G167-I175 WeakPolarHBondContact O-CB 3.43Å; G167-I175 PolarHBondContact O-N 3.44Å; P172-I175 HydrophobicContact CB-CD1 3.89Å; P172-I175 HydrophobicContact CB-CG1 4.45Å; P172-I175 HydrophobicContact CG-CD1 3.54Å; A173-I175 PolarHBondContact O-N 3.22Å; I175-V187 HydrophobicContact CG2-CG2 3.96Å; I175-V187 CarbonylContact O-C 3.54Å; I175-V187 WeakPolarHBondContact O-CA 3.13Å; I175-H188 PolarHBondContact O-N 2.91Å; I175-L191 HydrophobicContact CD1-CD2 4.45Å; I175-L191 HydrophobicContact CG2-CD2 3.48Å; I175-L191 VanDerWaalsContact CG2-CD2 3.48Å; I175-Y199 HydrophobicContact CD1-CE1 4.11Å
176	F	95.4	Very high	91.8	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.013	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.5	179.5	-54.8	-76.5	0	0	0	111.4	I134 L146 I163 G167 L185 Y186 V187 L191 Y199 L201 V222	I134-F176 HydrophobicContact CD1-CE1 3.8Å; I134-F176 HydrophobicContact CD1-CZ 4.39Å; L146-F176 HydrophobicContact CD1-CD1 3.85Å; L146-F176 HydrophobicContact CD1-CE1 3.91Å; I163-F176 HydrophobicContact CD1-CB 4.49Å; G167-F176 PolarHBondContact O-N 2.86Å; F176-L185 HydrophobicContact CB-CD1 4.41Å; F176-Y186 CarbonylContact C-O 3.59Å; F176-Y186 VanDerWaalsContact CA-O 3.29Å; F176-Y186 WeakPolarHBondContact CA-O 3.19Å; F176-V187 HydrophobicContact CD1-CB 3.93Å; F176-V187 HydrophobicContact CD1-CG2 4.11Å; F176-V187 HydrophobicContact CE1-CB 3.89Å; F176-V187 HydrophobicContact CE1-CG2 3.8Å; F176-L191 HydrophobicContact CZ-CD1 4.09Å; F176-L191 HydrophobicContact CZ-CD2 4.42Å; F176-Y199 AromaticContact CE2-CD1 3.76Å; F176-Y199 HydrophobicContact CE2-CD1 3.76Å; F176-Y199 AromaticContact CE2-CD2 3.84Å; F176-Y199 HydrophobicContact CE2-CD2 3.84Å; F176-Y199 HydrophobicContact CE2-CE1 4.12Å; F176-Y199 HydrophobicContact CE2-CE2 4.24Å; F176-Y199 AromaticContact CE2-CG 3.59Å; F176-Y199 HydrophobicContact CE2-CG 3.59Å; F176-Y199 AromaticContact CZ-CD2 3.97Å; F176-Y199 HydrophobicContact CZ-CD2 3.97Å; F176-Y199 HydrophobicContact CZ-CE2 4.31Å; F176-Y199 HydrophobicContact CZ-CG 4.16Å; F176-L201 HydrophobicContact CB-CD1 4.04Å; F176-L201 HydrophobicContact CD1-CD1 4.27Å; F176-L201 HydrophobicContact CD2-CD1 3.75Å; F176-L201 HydrophobicContact CD2-CD2 4.07Å; F176-L201 HydrophobicContact CD2-CG 4.48Å; F176-L201 HydrophobicContact CE2-CD1 4.29Å; F176-L201 HydrophobicContact CG-CD1 3.74Å; F176-V222 HydrophobicContact CE1-CG1 4.05Å; F176-V222 HydrophobicContact CZ-CB 4.4Å; F176-V222 HydrophobicContact CZ-CG1 3.94Å
177	T	94.9	Very high	91.9	Very high	54 Å²	54	43.3 Å²	43.3	33%	0.331	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.3	171.1	65.6	0	0	0	0	110.6	Y186 H188	T177-Y186 PolarHBondContact N-O 3.25Å; T177-Y186 PolarHBondContact O-N 2.96Å; T177-H188 WeakPolarHBondContact CG2-NE2 3.27Å; T177-H188 PolarHBondContact OG1-NE2 3.39Å
178	L	94.9	Very high	92	Very high	19 Å²	19	46.7 Å²	46.7	10%	0.099	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.8	171.9	-167.9	68.5	0	0	0	109.3	I149 I163 S180 G183 L185 I203	I149-L178 HydrophobicContact CD1-CD1 4.18Å; I163-L178 HydrophobicContact CB-CB 3.78Å; I163-L178 HydrophobicContact CB-CD2 4.12Å; I163-L178 HydrophobicContact CD1-CB 4.28Å; I163-L178 HydrophobicContact CG2-CB 3.67Å; L178-S180 PolarHBondContact O-N 3.22Å; L178-G183 VanDerWaalsContact CD1-O 3.22Å; L178-G183 WeakPolarHBondContact CD1-O 3.15Å; L178-L185 HydrophobicContact CB-CD1 4.43Å; L178-L185 HydrophobicContact CD1-CB 3.97Å; L178-L185 HydrophobicContact CD1-CD1 4.09Å; L178-I203 HydrophobicContact CD1-CD1 3.96Å; L178-I203 HydrophobicContact CD2-CB 4.32Å; L178-I203 HydrophobicContact CD2-CD1 3.8Å; L178-I203 HydrophobicContact CD2-CG1 3.95Å; L178-I203 HydrophobicContact CD2-CG2 3.54Å
179	K	94.5	Very high	91.9	Very high	71 Å²	71	51.1 Å²	51.1	31%	0.309	28%	0.28	S	S	.	.			trans	-73.5	116.6	176.6	-177.9	169.1	177.5	-63.3	0	108.8	D181 D182 G183 T184 Y186	K179-D181 VanDerWaalsContact C-N 3.32Å; K179-D181 WeakPolarHBondContact CE-OD1 3.47Å; K179-D181 WeakPolarHBondContact CG-OD1 3.46Å; K179-D181 IonicContact NZ-OD1 3.79Å; K179-D181 PolarHBondContact NZ-OD1 2.99Å; K179-D181 IonicContact NZ-OD2 2.87Å; K179-D181 PolarHBondContact NZ-OD2 2.87Å; K179-D181 PolarHBondContact O-N 2.74Å; K179-D182 WeakPolarHBondContact CB-OD1 3.43Å; K179-D182 WeakPolarHBondContact CD-OD1 3.37Å; K179-D182 WeakPolarHBondContact CD-OD2 3.48Å; K179-D182 WeakPolarHBondContact CE-OD2 3.46Å; K179-D182 WeakPolarHBondContact CG-OD1 3.18Å; K179-D182 VanDerWaalsContact NZ-CG 3.28Å; K179-D182 IonicContact NZ-OD1 2.7Å; K179-D182 IonicContact NZ-OD2 3.2Å; K179-D182 PolarHBondContact NZ-OD2 3.13Å; K179-G183 WeakPolarHBondContact O-CA 3.27Å; K179-G183 PolarHBondContact O-N 3.21Å; K179-T184 WeakPolarHBondContact CB-O 3.39Å; K179-T184 PolarHBondContact N-O 2.97Å; K179-Y186 HydrophobicContact CB-CE2 4.38Å
180	S	90.9	Very high	92	Very high	50 Å²	50	50.2 Å²	50.2	35%	0.35	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.8	-159.7	-161.9	0	0	0	0	114.3	Y160 Y161 L178	Y160-S180 CarbonylContact C-O 3.55Å; Y160-S180 VanDerWaalsContact CA-O 3.25Å; Y160-S180 WeakPolarHBondContact CA-O 2.9Å; Y160-S180 WeakPolarHBondContact CB-O 3.33Å; Y160-S180 WeakPolarHBondContact CD2-OG 3.35Å; Y161-S180 PolarHBondContact N-O 2.9Å; Y161-S180 WeakPolarHBondContact O-CB 3.38Å; Y161-S180 PolarHBondContact O-OG 3.11Å; L178-S180 PolarHBondContact O-N 3.22Å
181	D	87.9	Confident	92.1	Very high	101 Å²	101	45.5 Å²	45.5	54%	0.54	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-13.8	-176.5	59.5	-48	0	0	0	115	K179	K179-D181 VanDerWaalsContact C-N 3.32Å; K179-D181 WeakPolarHBondContact CE-OD1 3.47Å; K179-D181 WeakPolarHBondContact CG-OD1 3.46Å; K179-D181 IonicContact NZ-OD1 3.79Å; K179-D181 PolarHBondContact NZ-OD1 2.99Å; K179-D181 IonicContact NZ-OD2 2.87Å; K179-D181 PolarHBondContact NZ-OD2 2.87Å; K179-D181 PolarHBondContact O-N 2.74Å
182	D	87.3	Confident	92.4	Very high	56 Å²	56	42.2 Å²	42.2	30%	0.299	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.8	-0	177.8	65.8	20.9	0	0	0	115.3	T148 K179 T184	T148-D182 VanDerWaalsContact CG2-O 3.27Å; T148-D182 WeakPolarHBondContact CG2-O 3.46Å; K179-D182 WeakPolarHBondContact CB-OD1 3.43Å; K179-D182 WeakPolarHBondContact CD-OD1 3.37Å; K179-D182 WeakPolarHBondContact CD-OD2 3.48Å; K179-D182 WeakPolarHBondContact CE-OD2 3.46Å; K179-D182 WeakPolarHBondContact CG-OD1 3.18Å; K179-D182 VanDerWaalsContact NZ-CG 3.28Å; K179-D182 IonicContact NZ-OD1 2.7Å; K179-D182 IonicContact NZ-OD2 3.2Å; K179-D182 PolarHBondContact NZ-OD2 3.13Å; D182-T184 VanDerWaalsContact C-N 3.31Å; D182-T184 PolarHBondContact O-N 3.13Å; D182-T184 VanDerWaalsContact OD1-CB 3.24Å; D182-T184 WeakPolarHBondContact OD1-CB 3.4Å; D182-T184 PolarHBondContact OD1-N 3.42Å; D182-T184 PolarHBondContact OD1-OG1 2.99Å
183	G	88	Confident	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.			trans	75	13.1	177	0	0	0	0	0	115	I149 L178 K179 L185	I149-G183 PolarHBondContact N-O 3.19Å; I149-G183 WeakPolarHBondContact O-CA 3.35Å; L178-G183 VanDerWaalsContact CD1-O 3.22Å; L178-G183 WeakPolarHBondContact CD1-O 3.15Å; K179-G183 WeakPolarHBondContact O-CA 3.27Å; K179-G183 PolarHBondContact O-N 3.21Å; G183-L185 PolarHBondContact O-N 2.68Å
184	T	93.3	Very high	92.8	Very high	10 Å²	10	42.4 Å²	42.4	6%	0.061	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.3	-179.8	-56.8	0	0	0	0	112.6	F145 T148 K179 D182 Y186	F145-T184 HydrophobicContact CD2-CG2 3.44Å; F145-T184 VanDerWaalsContact CD2-CG2 3.44Å; F145-T184 HydrophobicContact CE2-CG2 3.44Å; F145-T184 VanDerWaalsContact CE2-CG2 3.44Å; T148-T184 PolarHBondContact OG1-OG1 3.42Å; K179-T184 WeakPolarHBondContact CB-O 3.39Å; K179-T184 PolarHBondContact N-O 2.97Å; D182-T184 VanDerWaalsContact C-N 3.31Å; D182-T184 PolarHBondContact O-N 3.13Å; D182-T184 VanDerWaalsContact OD1-CB 3.24Å; D182-T184 WeakPolarHBondContact OD1-CB 3.4Å; D182-T184 PolarHBondContact OD1-N 3.42Å; D182-T184 PolarHBondContact OD1-OG1 2.99Å; T184-Y186 HydrophobicContact CG2-CD2 4.09Å; T184-Y186 HydrophobicContact CG2-CE1 4.44Å; T184-Y186 HydrophobicContact CG2-CE2 3.45Å; T184-Y186 VanDerWaalsContact CG2-CE2 3.45Å
185	L	93.3	Very high	92.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.2	178.6	-173.6	68.6	0	0	0	111.4	I132 L146 E147 I149 I163 F176 L178 G183	I132-L185 HydrophobicContact CD1-CD2 3.95Å; L146-L185 HydrophobicContact CB-CB 4.38Å; L146-L185 HydrophobicContact CB-CD2 4.24Å; L146-L185 HydrophobicContact CB-CG 4.29Å; L146-L185 HydrophobicContact CD1-CD2 3.94Å; L146-L185 HydrophobicContact CD1-CG 4.06Å; L146-L185 PolarHBondContact N-O 3.05Å; E147-L185 WeakPolarHBondContact O-CB 3.31Å; E147-L185 PolarHBondContact O-N 2.81Å; I149-L185 HydrophobicContact CD1-CB 3.89Å; I149-L185 HydrophobicContact CD1-CD2 4.41Å; I163-L185 HydrophobicContact CD1-CD1 3.58Å; F176-L185 HydrophobicContact CB-CD1 4.41Å; L178-L185 HydrophobicContact CB-CD1 4.43Å; L178-L185 HydrophobicContact CD1-CB 3.97Å; L178-L185 HydrophobicContact CD1-CD1 4.09Å; G183-L185 PolarHBondContact O-N 2.68Å
186	Y	93.9	Very high	92.8	Very high	68 Å²	68	47.9 Å²	47.9	27%	0.267	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.7	177.8	-68.7	-85.9	0	0	0	112.1	P143 K144 F145 F176 T177 K179 T184	P143-Y186 HydrophobicContact CB-CD1 4.08Å; P143-Y186 HydrophobicContact CB-CG 4.37Å; K144-Y186 WeakPolarHBondContact O-CA 3.43Å; F145-Y186 HydrophobicContact CB-CD1 4.43Å; F145-Y186 HydrophobicContact CB-CE1 4.15Å; F176-Y186 CarbonylContact C-O 3.59Å; F176-Y186 VanDerWaalsContact CA-O 3.29Å; F176-Y186 WeakPolarHBondContact CA-O 3.19Å; T177-Y186 PolarHBondContact N-O 3.25Å; T177-Y186 PolarHBondContact O-N 2.96Å; K179-Y186 HydrophobicContact CB-CE2 4.38Å; T184-Y186 HydrophobicContact CG2-CD2 4.09Å; T184-Y186 HydrophobicContact CG2-CE1 4.44Å; T184-Y186 HydrophobicContact CG2-CE2 3.45Å; T184-Y186 VanDerWaalsContact CG2-CE2 3.45Å
187	V	95.1	Very high	92.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.4	163.6	62.9	0	0	0	0	110.5	I134 F142 P143 K144 L146 I175 F176 K189 L191	I134-V187 HydrophobicContact CD1-CB 4.5Å; I134-V187 HydrophobicContact CD1-CG1 4.43Å; F142-V187 HydrophobicContact CD1-CG1 4.45Å; F142-V187 HydrophobicContact CE1-CG1 4.21Å; P143-V187 CarbonylContact C-O 3.56Å; P143-V187 VanDerWaalsContact CA-O 3.24Å; P143-V187 WeakPolarHBondContact CA-O 3.06Å; K144-V187 HydrophobicContact CB-CG1 3.86Å; K144-V187 PolarHBondContact N-O 2.97Å; K144-V187 PolarHBondContact O-N 3.26Å; L146-V187 HydrophobicContact CD1-CB 4.13Å; L146-V187 HydrophobicContact CD1-CG1 4.42Å; L146-V187 HydrophobicContact CD2-CB 4.48Å; L146-V187 HydrophobicContact CD2-CG1 3.88Å; L146-V187 HydrophobicContact CG-CB 4.43Å; L146-V187 HydrophobicContact CG-CG1 4.25Å; I175-V187 HydrophobicContact CG2-CG2 3.96Å; I175-V187 CarbonylContact O-C 3.54Å; I175-V187 WeakPolarHBondContact O-CA 3.13Å; F176-V187 HydrophobicContact CD1-CB 3.93Å; F176-V187 HydrophobicContact CD1-CG2 4.11Å; F176-V187 HydrophobicContact CE1-CB 3.89Å; F176-V187 HydrophobicContact CE1-CG2 3.8Å; V187-K189 WeakPolarHBondContact CG2-O 3.26Å; V187-L191 HydrophobicContact CG2-CD2 4.27Å
188	H	93.1	Very high	92.7	Very high	71 Å²	71	51.9 Å²	51.9	33%	0.329	27%	0.265	S	S	.	.			trans	-111.2	-8.3	-171.5	-75.3	-103.2	0	0	0	115.4	F142 I175 T177	F142-H188 WeakPolarHBondContact CB-O 3.1Å; I175-H188 PolarHBondContact O-N 2.91Å; T177-H188 WeakPolarHBondContact CG2-NE2 3.27Å; T177-H188 PolarHBondContact OG1-NE2 3.39Å
189	K	90.4	Very high	92.6	Very high	105 Å²	105	51.4 Å²	51.4	46%	0.457	26%	0.262	S	S	.	.	S	Bend	trans	-144.8	160.2	-172.3	-61.2	175.9	-171.7	161.5	0	110.3	F142 V187	F142-K189 VanDerWaalsContact CE1-C 3.47Å; F142-K189 VanDerWaalsContact CE1-O 3.24Å; F142-K189 WeakPolarHBondContact CE1-O 3.48Å; F142-K189 WeakPolarHBondContact CZ-O 3.45Å; V187-K189 WeakPolarHBondContact CG2-O 3.26Å
190	T	92.6	Very high	92.6	Very high	78 Å²	78	51.1 Å²	51.1	48%	0.479	27%	0.266	S	S	.	.			trans	-53.6	145.3	161.3	47.8	0	0	0	0	110.2	D138 F142	D138-T190 WeakPolarHBondContact O-CG2 3.14Å; F142-T190 HydrophobicContact CE2-CG2 4.13Å; F142-T190 HydrophobicContact CZ-CG2 4.28Å
191	L	93.8	Very high	92.7	Very high	6 Å²	6	48.8 Å²	48.8	3%	0.031	25%	0.25	C	C	.	.			trans	-107.2	159.1	169.1	-53.3	-177.3	0	0	0	108.9	I134 E136 N137 I175 F176 V187 Y199 V224	I134-L191 HydrophobicContact CB-CD1 4.15Å; I134-L191 HydrophobicContact CD1-CD1 3.94Å; I134-L191 HydrophobicContact CG2-CD1 4.01Å; E136-L191 WeakPolarHBondContact CB-O 3.18Å; N137-L191 PolarHBondContact N-O 2.68Å; I175-L191 HydrophobicContact CD1-CD2 4.45Å; I175-L191 HydrophobicContact CG2-CD2 3.48Å; I175-L191 VanDerWaalsContact CG2-CD2 3.48Å; F176-L191 HydrophobicContact CZ-CD1 4.09Å; F176-L191 HydrophobicContact CZ-CD2 4.42Å; V187-L191 HydrophobicContact CG2-CD2 4.27Å; L191-Y199 HydrophobicContact CD1-CE2 4.33Å; L191-Y199 HydrophobicContact CD2-CE2 4.33Å; L191-V224 HydrophobicContact CB-CG1 4.15Å; L191-V224 HydrophobicContact CB-CG2 4.22Å; L191-V224 HydrophobicContact CD1-CG2 3.82Å
192	D	94.8	Very high	93	Very high	63 Å²	63	46 Å²	46	34%	0.337	24%	0.236	S	C	.	.			trans	-137.1	120.6	-178.8	166.6	-37.6	0	0	0	104.8	E194 M195 I196	D192-E194 PolarHBondContact OD1-N 2.88Å; D192-M195 HydrophobicContact CB-CB 4.26Å; D192-M195 HydrophobicContact CB-CG 4.39Å; D192-M195 VanDerWaalsContact OD1-CB 3.24Å; D192-M195 WeakPolarHBondContact OD1-CB 3.2Å; D192-M195 VanDerWaalsContact OD1-CG 3.26Å; D192-M195 WeakPolarHBondContact OD1-CG 3.12Å; D192-M195 PolarHBondContact OD1-N 2.93Å; D192-I196 PolarHBondContact O-N 3.03Å
193	R	95	Very high	93.2	Very high	28 Å²	28	43.5 Å²	43.5	11%	0.106	22%	0.223	C	C	.	.	H	α-helix	trans	-82.4	-36.9	-168.8	-169.8	-153.9	76	98.5	6.5	111.3	E136 M195 I196 A197 V224 D226 K259 D260 D261	E136-R193 VanDerWaalsContact CD-CB 3.44Å; E136-R193 WeakPolarHBondContact OE1-CB 3.35Å; E136-R193 WeakPolarHBondContact OE2-CB 3.37Å; E136-R193 PolarHBondContact OE2-N 3.43Å; R193-M195 PolarHBondContact O-N 2.97Å; R193-I196 CarbonylContact O-C 3.58Å; R193-I196 PolarHBondContact O-N 2.87Å; R193-A197 HydrophobicContact CG-CB 3.75Å; R193-A197 WeakPolarHBondContact O-CA 3.43Å; R193-A197 PolarHBondContact O-N 2.9Å; R193-V224 HydrophobicContact CB-CB 4.31Å; R193-V224 HydrophobicContact CB-CG1 3.83Å; R193-V224 HydrophobicContact CG-CB 4.17Å; R193-V224 HydrophobicContact CG-CG1 4.15Å; R193-D226 WeakPolarHBondContact CD-OD1 3.4Å; R193-D226 IonicContact CZ-OD1 3.82Å; R193-D226 IonicContact NE-OD1 3.41Å; R193-D226 PolarHBondContact NE-OD1 2.85Å; R193-D226 VanDerWaalsContact NE-OD1 3.07Å; R193-D226 IonicContact NH1-OD1 2.71Å; R193-D226 IonicContact NH2-OD1 2.64Å; R193-K259 PolarHBondContact NH2-O 3.46Å; R193-D260 PolarHBondContact NH2-O 2.9Å; R193-D261 VanDerWaalsContact NH1-CA 3.27Å; R193-D261 VanDerWaalsContact NH1-CB 3.26Å; R193-D261 IonicContact NH1-OD2 2.64Å
194	E	94.8	Very high	93.4	Very high	61 Å²	61	45.2 Å²	45.2	29%	0.285	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-32.5	174.3	-74.1	56.4	-118.5	0	0	111.2	D192 K259	D192-E194 PolarHBondContact OD1-N 2.88Å; E194-K259 HydrophobicContact CG-CB 3.79Å
195	M	92.7	Very high	93.3	Very high	147 Å²	147	45 Å²	45	72%	0.724	23%	0.232	S	C	*	.	H	α-helix	trans	-75.4	-54.1	168.7	-72.7	-168	71.9	0	0	112.5	D192 R193	D192-M195 HydrophobicContact CB-CB 4.26Å; D192-M195 HydrophobicContact CB-CG 4.39Å; D192-M195 VanDerWaalsContact OD1-CB 3.24Å; D192-M195 WeakPolarHBondContact OD1-CB 3.2Å; D192-M195 VanDerWaalsContact OD1-CG 3.26Å; D192-M195 WeakPolarHBondContact OD1-CG 3.12Å; D192-M195 PolarHBondContact OD1-N 2.93Å; R193-M195 PolarHBondContact O-N 2.97Å
196	I	93.1	Very high	93.2	Very high	14 Å²	14	46.1 Å²	46.1	7%	0.072	24%	0.237	C	C	.	.	H	α-helix	trans	-149.4	87.1	-177.4	-48	176.2	0	0	0	112.2	R166 P172 D192 R193 Q198 Y199 V224	R166-I196 VanDerWaalsContact CZ-CD1 3.44Å; P172-I196 HydrophobicContact CG-CD1 3.64Å; D192-I196 PolarHBondContact O-N 3.03Å; R193-I196 CarbonylContact O-C 3.58Å; R193-I196 PolarHBondContact O-N 2.87Å; I196-Q198 VanDerWaalsContact C-N 3.26Å; I196-Q198 WeakPolarHBondContact CG2-O 3.42Å; I196-Q198 PolarHBondContact O-N 2.79Å; I196-Y199 HydrophobicContact CB-CE1 4.27Å; I196-Y199 HydrophobicContact CB-CE2 4.07Å; I196-Y199 HydrophobicContact CD1-CE1 3.82Å; I196-Y199 HydrophobicContact CG2-CD1 4.12Å; I196-Y199 HydrophobicContact CG2-CD2 4.16Å; I196-Y199 HydrophobicContact CG2-CE1 3.81Å; I196-Y199 HydrophobicContact CG2-CE2 3.81Å; I196-Y199 HydrophobicContact CG2-CG 4.3Å; I196-V224 WeakPolarHBondContact O-CG2 3.32Å
197	A	92.6	Very high	93	Very high	44 Å²	44	43.4 Å²	43.4	36%	0.364	23%	0.227	S	C	.	.	S	Bend	trans	-62.6	-20.8	177.7	0	0	0	0	0	115.8	R193 V224	R193-A197 HydrophobicContact CG-CB 3.75Å; R193-A197 WeakPolarHBondContact O-CA 3.43Å; R193-A197 PolarHBondContact O-N 2.9Å; A197-V224 PolarHBondContact O-N 2.87Å
198	Q	94.1	Very high	92.6	Very high	96 Å²	96	47.1 Å²	47.1	45%	0.449	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	137.6	179.5	-164.2	-172.7	-71	0	0	112.6	I196 V221 V222 K223	I196-Q198 VanDerWaalsContact C-N 3.26Å; I196-Q198 WeakPolarHBondContact CG2-O 3.42Å; I196-Q198 PolarHBondContact O-N 2.79Å; Q198-V221 VanDerWaalsContact CD-CG1 3.42Å; Q198-V221 HydrophobicContact CG-CG1 3.62Å; Q198-V222 WeakPolarHBondContact CA-O 3.31Å; Q198-V222 WeakPolarHBondContact CG-O 3.38Å; Q198-K223 HydrophobicContact CG-CG 4.42Å
199	Y	94.3	Very high	92.2	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.1	169.5	-58.5	-100.1	0	0	0	110.1	R166 P172 I175 F176 L191 I196 V222 V224	R166-Y199 HydrophobicContact CG-CD1 4.5Å; R166-Y199 WeakPolarHBondContact O-CD1 3.33Å; P172-Y199 HydrophobicContact CG-CE1 4.41Å; I175-Y199 HydrophobicContact CD1-CE1 4.11Å; F176-Y199 AromaticContact CE2-CD1 3.76Å; F176-Y199 HydrophobicContact CE2-CD1 3.76Å; F176-Y199 AromaticContact CE2-CD2 3.84Å; F176-Y199 HydrophobicContact CE2-CD2 3.84Å; F176-Y199 HydrophobicContact CE2-CE1 4.12Å; F176-Y199 HydrophobicContact CE2-CE2 4.24Å; F176-Y199 AromaticContact CE2-CG 3.59Å; F176-Y199 HydrophobicContact CE2-CG 3.59Å; F176-Y199 AromaticContact CZ-CD2 3.97Å; F176-Y199 HydrophobicContact CZ-CD2 3.97Å; F176-Y199 HydrophobicContact CZ-CE2 4.31Å; F176-Y199 HydrophobicContact CZ-CG 4.16Å; L191-Y199 HydrophobicContact CD1-CE2 4.33Å; L191-Y199 HydrophobicContact CD2-CE2 4.33Å; I196-Y199 HydrophobicContact CB-CE1 4.27Å; I196-Y199 HydrophobicContact CB-CE2 4.07Å; I196-Y199 HydrophobicContact CD1-CE1 3.82Å; I196-Y199 HydrophobicContact CG2-CD1 4.12Å; I196-Y199 HydrophobicContact CG2-CD2 4.16Å; I196-Y199 HydrophobicContact CG2-CE1 3.81Å; I196-Y199 HydrophobicContact CG2-CE2 3.81Å; I196-Y199 HydrophobicContact CG2-CG 4.3Å; Y199-V222 PolarHBondContact N-O 3.35Å; Y199-V222 PolarHBondContact O-N 2.93Å; Y199-V224 HydrophobicContact CD2-CG2 4.31Å; Y199-V224 HydrophobicContact CE2-CG2 3.99Å
200	T	93.7	Very high	92	Very high	66 Å²	66	47.3 Å²	47.3	41%	0.405	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.5	170.2	-54.3	0	0	0	0	108.3	D219 I220	T200-D219 HydrophobicContact CG2-CB 4.38Å; T200-I220 WeakPolarHBondContact CA-O 3.17Å
201	L	93.5	Very high	91.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	114.2	-170.1	-61.7	174	0	0	0	109.3	I163 A164 R166 A168 F176 I220 V222	I163-L201 HydrophobicContact CD1-CB 4.18Å; I163-L201 HydrophobicContact CD1-CD1 4.17Å; I163-L201 HydrophobicContact CD1-CD2 4.35Å; I163-L201 HydrophobicContact CD1-CG 4.47Å; I163-L201 HydrophobicContact CG1-CB 4.42Å; A164-L201 CarbonylContact O-C 3.57Å; R166-L201 WeakPolarHBondContact O-CD2 3.46Å; A168-L201 HydrophobicContact CB-CD2 4.06Å; F176-L201 HydrophobicContact CB-CD1 4.04Å; F176-L201 HydrophobicContact CD1-CD1 4.27Å; F176-L201 HydrophobicContact CD2-CD1 3.75Å; F176-L201 HydrophobicContact CD2-CD2 4.07Å; F176-L201 HydrophobicContact CD2-CG 4.48Å; F176-L201 HydrophobicContact CE2-CD1 4.29Å; F176-L201 HydrophobicContact CG-CD1 3.74Å; L201-I220 PolarHBondContact N-O 3.32Å; L201-I220 PolarHBondContact O-N 3Å; L201-V222 HydrophobicContact CD1-CG2 3.67Å
202	T	93.9	Very high	91.3	Very high	42 Å²	42	54.2 Å²	54.2	26%	0.258	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120	179.8	-53.2	0	0	0	0	109.6	A164 P217 D219	A164-T202 PolarHBondContact N-O 3.02Å; A164-T202 PolarHBondContact O-N 3.28Å; T202-P217 HydrophobicContact CG2-CB 3.55Å; T202-D219 VanDerWaalsContact CB-OD1 3.29Å; T202-D219 WeakPolarHBondContact CB-OD1 3.46Å; T202-D219 WeakPolarHBondContact CG2-OD1 3.34Å; T202-D219 PolarHBondContact OG1-OD1 3.39Å
203	I	92	Very high	90.9	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.8	-179	-64.9	-177.5	0	0	0	110.6	I149 Y161 T162 I163 L178 P217 L218 I220	I149-I203 HydrophobicContact CD1-CD1 3.9Å; I149-I203 HydrophobicContact CG1-CD1 4.38Å; I149-I203 HydrophobicContact CG2-CD1 4.47Å; I149-I203 HydrophobicContact CG2-CG2 4.41Å; Y161-I203 HydrophobicContact CD1-CG2 4.38Å; T162-I203 WeakPolarHBondContact O-CA 3.5Å; I163-I203 HydrophobicContact CB-CG1 4.45Å; I163-I203 HydrophobicContact CD1-CG1 4.46Å; I163-I203 HydrophobicContact CG1-CG1 4.19Å; L178-I203 HydrophobicContact CD1-CD1 3.96Å; L178-I203 HydrophobicContact CD2-CB 4.32Å; L178-I203 HydrophobicContact CD2-CD1 3.8Å; L178-I203 HydrophobicContact CD2-CG1 3.95Å; L178-I203 HydrophobicContact CD2-CG2 3.54Å; I203-P217 CarbonylContact O-C 3.59Å; I203-P217 WeakPolarHBondContact O-CA 3.33Å; I203-L218 PolarHBondContact N-O 2.93Å; I203-L218 PolarHBondContact O-N 3Å; I203-I220 HydrophobicContact CD1-CD1 3.56Å; I203-I220 HydrophobicContact CD1-CG1 4.22Å; I203-I220 HydrophobicContact CG1-CD1 4.49Å
204	N	92.3	Very high	90.5	Very high	36 Å²	36	57.6 Å²	57.6	19%	0.193	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.6	176.8	-38.1	-85.6	0	0	0	110.7	T162 L206 P217	T162-N204 PolarHBondContact N-O 2.83Å; T162-N204 PolarHBondContact O-N 3.23Å; T162-N204 PolarHBondContact OG1-ND2 2.56Å; T162-N204 PolarHBondContact OG1-O 2.8Å; N204-L206 HydrophobicContact CB-CD2 3.87Å; N204-L206 HydrophobicContact CB-CG 4.2Å; N204-P217 WeakPolarHBondContact OD1-CB 3.47Å; N204-P217 WeakPolarHBondContact OD1-CG 3.37Å
205	A	91.4	Very high	90	Very high	6 Å²	6	55.3 Å²	55.3	5%	0.05	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110	169.3	0	0	0	0	0	109.2	V159 Y161 P213 R214 D215	V159-A205 HydrophobicContact CG1-CB 3.82Å; Y161-A205 HydrophobicContact CD1-CB 4.15Å; Y161-A205 HydrophobicContact CE1-CB 3.84Å; A205-P213 WeakPolarHBondContact O-CA 3.22Å; A205-R214 PolarHBondContact O-N 3.22Å; A205-D215 HydrophobicContact CB-CB 4.1Å
206	L	91.1	Very high	89.5	Confident	23 Å²	23	51.3 Å²	51.3	12%	0.12	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.3	-172.9	-55.9	-176.2	0	0	0	111	V159 Y160 T162 N204 Q212 P213	V159-L206 CarbonylContact C-O 3.58Å; V159-L206 VanDerWaalsContact CA-O 3.32Å; V159-L206 WeakPolarHBondContact CA-O 3.28Å; Y160-L206 HydrophobicContact CD1-CB 3.98Å; Y160-L206 WeakPolarHBondContact CD1-O 3.35Å; Y160-L206 HydrophobicContact CE1-CB 3.49Å; Y160-L206 VanDerWaalsContact CE1-CB 3.49Å; Y160-L206 HydrophobicContact CE2-CB 4.2Å; Y160-L206 HydrophobicContact CE2-CD1 4.04Å; Y160-L206 PolarHBondContact N-O 2.94Å; Y160-L206 PolarHBondContact O-N 2.9Å; Y160-L206 WeakPolarHBondContact OH-CD1 3.25Å; T162-L206 HydrophobicContact CG2-CD1 3.73Å; N204-L206 HydrophobicContact CB-CD2 3.87Å; N204-L206 HydrophobicContact CB-CG 4.2Å; L206-Q212 WeakPolarHBondContact CA-O 3.34Å; L206-P213 HydrophobicContact CD2-CB 4.1Å; L206-P213 HydrophobicContact CD2-CG 3.91Å
207	D	89.8	Confident	89.2	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.059	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	126.4	178	-175.7	-93.6	0	0	0	112.4	H157 Y160 V209 S210 H211 Q212 R214	H157-D207 IonicContact CD2-OD2 2.97Å; Y160-D207 WeakPolarHBondContact CE1-O 3.4Å; D207-V209 PolarHBondContact O-N 3Å; D207-V209 VanDerWaalsContact O-N 3.08Å; D207-V209 PolarHBondContact OD1-N 2.7Å; D207-V209 VanDerWaalsContact OD1-N 3.13Å; D207-S210 VanDerWaalsContact CB-OG 3.32Å; D207-S210 WeakPolarHBondContact CB-OG 3.47Å; D207-S210 WeakPolarHBondContact OD1-CB 3.32Å; D207-S210 PolarHBondContact OD1-N 2.96Å; D207-S210 PolarHBondContact OD1-OG 2.89Å; D207-H211 VanDerWaalsContact O-CA 3.23Å; D207-H211 WeakPolarHBondContact O-CA 3.33Å; D207-H211 PolarHBondContact O-N 3.02Å; D207-Q212 PolarHBondContact N-O 2.83Å; D207-R214 HydrophobicContact CB-CG 4.02Å; D207-R214 VanDerWaalsContact CG-NH2 3.27Å; D207-R214 IonicContact OD1-NH2 2.61Å; D207-R214 IonicContact OD2-CZ 3.46Å; D207-R214 IonicContact OD2-NE 2.79Å; D207-R214 PolarHBondContact OD2-NE 2.83Å; D207-R214 IonicContact OD2-NH2 3.27Å; D207-R214 PolarHBondContact OD2-NH2 3.23Å
208	K	86.7	Confident	88.9	Confident	80 Å²	80	53.9 Å²	53.9	35%	0.348	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.8	-175.3	-73.2	-165	-174.5	87.8	0	114.9	D158 V159 Y160	D158-K208 WeakPolarHBondContact O-CB 3.33Å; D158-K208 WeakPolarHBondContact O-CG 3.45Å; D158-K208 PolarHBondContact O-N 2.81Å; D158-K208 IonicContact OD1-NZ 3.5Å; D158-K208 PolarHBondContact OD1-NZ 2.84Å; V159-K208 WeakPolarHBondContact O-CE 3.48Å; V159-K208 PolarHBondContact O-NZ 3.12Å; Y160-K208 HydrophobicContact CD1-CB 4.29Å; Y160-K208 HydrophobicContact CD1-CG 3.71Å; Y160-K208 HydrophobicContact CG-CG 4.21Å
209	V	84.6	Confident	88.7	Confident	128 Å²	128	53.7 Å²	53.7	78%	0.776	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-41.4	-176.2	-177.1	0	0	0	0	112.1	D207	D207-V209 PolarHBondContact O-N 3Å; D207-V209 VanDerWaalsContact O-N 3.08Å; D207-V209 PolarHBondContact OD1-N 2.7Å; D207-V209 VanDerWaalsContact OD1-N 3.13Å
210	S	85.3	Confident	88.5	Confident	51 Å²	51	53.5 Å²	53.5	36%	0.357	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-9	-174.7	61.8	0	0	0	0	114.3	D207 Q212	D207-S210 VanDerWaalsContact CB-OG 3.32Å; D207-S210 WeakPolarHBondContact CB-OG 3.47Å; D207-S210 WeakPolarHBondContact OD1-CB 3.32Å; D207-S210 PolarHBondContact OD1-N 2.96Å; D207-S210 PolarHBondContact OD1-OG 2.89Å; S210-Q212 PolarHBondContact O-N 2.96Å; S210-Q212 PolarHBondContact O-NE2 2.83Å; S210-Q212 VanDerWaalsContact O-NE2 3.16Å
211	H	86.3	Confident	88.4	Confident	113 Å²	113	52.4 Å²	52.4	52%	0.523	28%	0.282	S	S	.	.			trans	53.5	16.1	-177.1	-58.5	-73.3	0	0	0	114.9	Y160 D207	Y160-H211 AromaticContact CE1-ND1 3.63Å; Y160-H211 AromaticContact CZ-ND1 3.59Å; Y160-H211 PolarHBondContact OH-ND1 2.96Å; D207-H211 VanDerWaalsContact O-CA 3.23Å; D207-H211 WeakPolarHBondContact O-CA 3.33Å; D207-H211 PolarHBondContact O-N 3.02Å
212	Q	86.2	Confident	88.4	Confident	116 Å²	116	52.4 Å²	52.4	54%	0.542	28%	0.282	S	S	.	.			trans	-82.2	147.3	174.9	-60.9	-50.1	-66.9	0	0	110.4	L206 D207 S210 R214	L206-Q212 WeakPolarHBondContact CA-O 3.34Å; D207-Q212 PolarHBondContact N-O 2.83Å; S210-Q212 PolarHBondContact O-N 2.96Å; S210-Q212 PolarHBondContact O-NE2 2.83Å; S210-Q212 VanDerWaalsContact O-NE2 3.16Å; Q212-R214 PolarHBondContact O-N 2.93Å
213	P	86.3	Confident	88.4	Confident	77 Å²	77	53.9 Å²	53.9	50%	0.5	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-57.8	129.8	166.6	-20.6	32.4	0	0	0	110.8	A205 L206 D215	A205-P213 WeakPolarHBondContact O-CA 3.22Å; L206-P213 HydrophobicContact CD2-CB 4.1Å; L206-P213 HydrophobicContact CD2-CG 3.91Å; P213-D215 WeakPolarHBondContact CB-O 3.45Å
214	R	86.3	Confident	88.5	Confident	85 Å²	85	54.2 Å²	54.2	32%	0.321	29%	0.287	S	S	.	.	S	Bend	trans	-90.6	-40.8	167.9	-66.5	-58.2	-175.1	-167.8	-1.5	110.6	H157 V159 A205 D207 Q212	H157-R214 HydrophobicContact CB-CG 4.37Å; H157-R214 PolarHBondContact CD2-NE 3.09Å; H157-R214 VanDerWaalsContact CD2-NE 3.29Å; H157-R214 PolarHBondContact CD2-NH2 3.02Å; V159-R214 HydrophobicContact CG2-CB 4.48Å; V159-R214 HydrophobicContact CG2-CG 4.21Å; A205-R214 PolarHBondContact O-N 3.22Å; D207-R214 HydrophobicContact CB-CG 4.02Å; D207-R214 VanDerWaalsContact CG-NH2 3.27Å; D207-R214 IonicContact OD1-NH2 2.61Å; D207-R214 IonicContact OD2-CZ 3.46Å; D207-R214 IonicContact OD2-NE 2.79Å; D207-R214 PolarHBondContact OD2-NE 2.83Å; D207-R214 IonicContact OD2-NH2 3.27Å; D207-R214 PolarHBondContact OD2-NH2 3.23Å; Q212-R214 PolarHBondContact O-N 2.93Å
215	D	83.5	Confident	88.5	Confident	13 Å²	13	55.4 Å²	55.4	7%	0.07	29%	0.293	C	S	.	.	S	Bend	trans	-104.2	156.7	168.2	-69.1	24.5	0	0	0	110.8	R126 S151 S153 A205 P213	R126-D215 IonicContact CZ-OD2 2.69Å; R126-D215 IonicContact NH1-OD2 3.23Å; R126-D215 IonicContact NH2-OD2 3.05Å; R126-D215 PolarHBondContact NH2-OD2 2.71Å; S151-D215 WeakPolarHBondContact CB-OD2 3.39Å; S151-D215 PolarHBondContact OG-OD1 3.16Å; S151-D215 PolarHBondContact OG-OD2 3.48Å; S153-D215 PolarHBondContact OG-OD1 3.25Å; A205-D215 HydrophobicContact CB-CB 4.1Å; P213-D215 WeakPolarHBondContact CB-O 3.45Å
216	L	82.5	Confident	88.6	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.335	30%	0.296	S	S	.	.			trans	-61.6	152.8	160.6	-66.8	162.3	0	0	0	110.3	L218 H851 Y853	L216-L218 PolarHBondContact O-N 2.71Å; L216-H851 HydrophobicContact CD1-CB 3.34Å; L216-Y853 HydrophobicContact CB-CE1 4.4Å; L216-Y853 WeakPolarHBondContact CB-OH 3.42Å; L216-Y853 HydrophobicContact CD1-CE1 4.08Å; L216-Y853 HydrophobicContact CD1-CE2 3.96Å; L216-Y853 HydrophobicContact CG-CE1 3.76Å; L216-Y853 HydrophobicContact CG-CE2 4.48Å; L216-Y853 WeakPolarHBondContact CG-OH 3.01Å; L216-Y853 PolarHBondContact N-OH 2.9Å
217	P	87.9	Confident	88.7	Confident	72 Å²	72	57.1 Å²	57.1	47%	0.468	30%	0.303	S	S	.	.			trans	-54	139.9	175.2	-21.7	31.3	0	0	0	112.3	T202 I203 N204	T202-P217 HydrophobicContact CG2-CB 3.55Å; I203-P217 CarbonylContact O-C 3.59Å; I203-P217 WeakPolarHBondContact O-CA 3.33Å; N204-P217 WeakPolarHBondContact OD1-CB 3.47Å; N204-P217 WeakPolarHBondContact OD1-CG 3.37Å
218	L	86.3	Confident	89	Confident	39 Å²	39	58 Å²	58	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	109.8	176.1	-173.9	71	0	0	0	109	P129 I149 I203 L216 I220	P129-L218 HydrophobicContact CG-CD1 4.34Å; P129-L218 HydrophobicContact CG-CG 4.38Å; I149-L218 HydrophobicContact CG2-CD2 3.72Å; I203-L218 PolarHBondContact N-O 2.93Å; I203-L218 PolarHBondContact O-N 3Å; L216-L218 PolarHBondContact O-N 2.71Å; L218-I220 HydrophobicContact CD2-CD1 4.27Å; L218-I220 HydrophobicContact CD2-CG1 4.36Å; L218-I220 HydrophobicContact CG-CG1 4.34Å
219	D	89.4	Confident	89.3	Confident	93 Å²	93	57.9 Å²	57.9	50%	0.497	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.5	171.8	-69.9	-35.2	0	0	0	110.4	T200 T202	T200-D219 HydrophobicContact CG2-CB 4.38Å; T202-D219 VanDerWaalsContact CB-OD1 3.29Å; T202-D219 WeakPolarHBondContact CB-OD1 3.46Å; T202-D219 WeakPolarHBondContact CG2-OD1 3.34Å; T202-D219 PolarHBondContact OG1-OD1 3.39Å
220	I	89.8	Confident	89.8	Confident	4 Å²	4	53 Å²	53	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.8	175	-55.7	-164.1	0	0	0	108.6	P129 I132 I149 T200 L201 I203 L218	P129-I220 HydrophobicContact CG-CG1 4.04Å; I132-I220 HydrophobicContact CD1-CG2 3.77Å; I132-I220 HydrophobicContact CG1-CG2 4.18Å; I149-I220 HydrophobicContact CD1-CD1 3.72Å; I149-I220 HydrophobicContact CG1-CD1 3.61Å; I149-I220 HydrophobicContact CG2-CD1 4.47Å; T200-I220 WeakPolarHBondContact CA-O 3.17Å; L201-I220 PolarHBondContact N-O 3.32Å; L201-I220 PolarHBondContact O-N 3Å; I203-I220 HydrophobicContact CD1-CD1 3.56Å; I203-I220 HydrophobicContact CD1-CG1 4.22Å; I203-I220 HydrophobicContact CG1-CD1 4.49Å; L218-I220 HydrophobicContact CD2-CD1 4.27Å; L218-I220 HydrophobicContact CD2-CG1 4.36Å; L218-I220 HydrophobicContact CG-CG1 4.34Å
221	V	92	Very high	90.3	Very high	43 Å²	43	52.3 Å²	52.3	26%	0.261	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	127	170.9	174.2	0	0	0	0	108.6	P131 I132 Q198 K223	P131-V221 CarbonylContact C-O 3.56Å; P131-V221 WeakPolarHBondContact CA-O 3.43Å; P131-V221 HydrophobicContact CB-CB 4.28Å; P131-V221 HydrophobicContact CB-CG1 4.07Å; I132-V221 PolarHBondContact N-O 3.27Å; Q198-V221 VanDerWaalsContact CD-CG1 3.42Å; Q198-V221 HydrophobicContact CG-CG1 3.62Å; V221-K223 HydrophobicContact CG1-CG 4.09Å
222	V	93.3	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	113	165.6	-178.7	0	0	0	0	107.4	I132 I134 F176 Q198 Y199 L201	I132-V222 HydrophobicContact CB-CG2 4.38Å; I132-V222 CarbonylContact O-C 3.56Å; I132-V222 VanDerWaalsContact O-CA 3.26Å; I132-V222 WeakPolarHBondContact O-CA 3.32Å; I134-V222 HydrophobicContact CD1-CG1 3.37Å; I134-V222 HydrophobicContact CG1-CG1 3.9Å; F176-V222 HydrophobicContact CE1-CG1 4.05Å; F176-V222 HydrophobicContact CZ-CB 4.4Å; F176-V222 HydrophobicContact CZ-CG1 3.94Å; Q198-V222 WeakPolarHBondContact CA-O 3.31Å; Q198-V222 WeakPolarHBondContact CG-O 3.38Å; Y199-V222 PolarHBondContact N-O 3.35Å; Y199-V222 PolarHBondContact O-N 2.93Å; L201-V222 HydrophobicContact CD1-CG2 3.67Å
223	K	92.8	Very high	91.3	Very high	73 Å²	73	45.8 Å²	45.8	32%	0.317	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	143.8	171.8	-73.5	-172.1	173.6	-170.3	0	109.5	P131 I132 N133 I134 Q198 V221	P131-K223 HydrophobicContact CB-CD 4.12Å; P131-K223 HydrophobicContact CB-CG 4.05Å; P131-K223 HydrophobicContact CG-CD 4.44Å; I132-K223 PolarHBondContact O-N 2.94Å; N133-K223 WeakPolarHBondContact CA-O 3.45Å; I134-K223 PolarHBondContact N-O 2.98Å; Q198-K223 HydrophobicContact CG-CG 4.42Å; V221-K223 HydrophobicContact CG1-CG 4.09Å
224	V	94.4	Very high	91.9	Very high	11 Å²	11	44.2 Å²	44.2	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	121.5	169	-173.9	0	0	0	0	107.9	I134 E136 L191 R193 I196 A197 Y199	I134-V224 CarbonylContact O-C 3.6Å; I134-V224 VanDerWaalsContact O-CA 3.29Å; I134-V224 WeakPolarHBondContact O-CA 3.4Å; E136-V224 HydrophobicContact CB-CG1 3.61Å; L191-V224 HydrophobicContact CB-CG1 4.15Å; L191-V224 HydrophobicContact CB-CG2 4.22Å; L191-V224 HydrophobicContact CD1-CG2 3.82Å; R193-V224 HydrophobicContact CB-CB 4.31Å; R193-V224 HydrophobicContact CB-CG1 3.83Å; R193-V224 HydrophobicContact CG-CB 4.17Å; R193-V224 HydrophobicContact CG-CG1 4.15Å; I196-V224 WeakPolarHBondContact O-CG2 3.32Å; A197-V224 PolarHBondContact O-N 2.87Å; Y199-V224 HydrophobicContact CD2-CG2 4.31Å; Y199-V224 HydrophobicContact CE2-CG2 3.99Å
225	D	92.4	Very high	92.3	Very high	61 Å²	61	44.3 Å²	44.3	33%	0.326	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.2	179	-79.4	-3.7	0	0	0	110.3	N133 I134 L135 E136	N133-D225 WeakPolarHBondContact CB-OD2 3.39Å; N133-D225 PolarHBondContact ND2-OD1 3.49Å; N133-D225 PolarHBondContact ND2-OD2 2.77Å; I134-D225 PolarHBondContact O-N 3.46Å; L135-D225 HydrophobicContact CD1-CB 4.05Å; E136-D225 PolarHBondContact N-O 3.12Å; E136-D225 VanDerWaalsContact N-O 3.07Å
226	D	93.8	Very high	92.7	Very high	21 Å²	21	47.1 Å²	47.1	11%	0.112	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-71.1	132.9	-169.5	-174	63.5	0	0	0	114.7	E136 R193 D261 T264 H266	E136-D226 WeakPolarHBondContact OE1-CA 3.05Å; R193-D226 WeakPolarHBondContact CD-OD1 3.4Å; R193-D226 IonicContact CZ-OD1 3.82Å; R193-D226 IonicContact NE-OD1 3.41Å; R193-D226 PolarHBondContact NE-OD1 2.85Å; R193-D226 VanDerWaalsContact NE-OD1 3.07Å; R193-D226 IonicContact NH1-OD1 2.71Å; R193-D226 IonicContact NH2-OD1 2.64Å; D226-D261 HydrophobicContact CB-CB 3.75Å; D226-D261 VanDerWaalsContact CG-N 3.35Å; D226-D261 WeakPolarHBondContact OD1-CB 3.21Å; D226-D261 PolarHBondContact OD1-N 2.7Å; D226-D261 VanDerWaalsContact OD2-CB 3.25Å; D226-D261 WeakPolarHBondContact OD2-CB 3.11Å; D226-D261 PolarHBondContact OD2-N 2.87Å; D226-T264 HydrophobicContact CB-CG2 4.17Å; D226-T264 VanDerWaalsContact OD2-CG2 3.31Å; D226-T264 WeakPolarHBondContact OD2-CG2 3.31Å; D226-T264 PolarHBondContact OD2-OG1 2.97Å; D226-H266 IonicContact OD2-CE1 3.7Å; D226-H266 PolarHBondContact OD2-CE1 2.88Å; D226-H266 VanDerWaalsContact OD2-CE1 3.23Å; D226-H266 IonicContact OD2-CG 2.71Å; D226-H266 IonicContact OD2-ND1 3.41Å; D226-H266 PolarHBondContact OD2-ND1 2.89Å
227	V	93.8	Very high	93.2	Very high	44 Å²	44	51.1 Å²	51.1	27%	0.267	29%	0.286	S	S	.	.			trans	-120.1	136.6	172.2	175	0	0	0	0	109.5	L135 E136 D229	L135-V227 HydrophobicContact CD1-CG2 3.54Å; L135-V227 HydrophobicContact CD2-CG2 4.02Å; L135-V227 HydrophobicContact CG-CG2 3.59Å; E136-V227 HydrophobicContact CG-CB 3.8Å; E136-V227 HydrophobicContact CG-CG2 3.78Å; E136-V227 PolarHBondContact OE1-N 3.33Å; V227-D229 VanDerWaalsContact C-N 3.28Å; V227-D229 HydrophobicContact CG1-CB 4.49Å; V227-D229 PolarHBondContact O-N 3.42Å
228	N	94.8	Very high	93.6	Very high	31 Å²	31	48.7 Å²	48.7	17%	0.166	27%	0.269	C	S	.	.	S	Bend	trans	-72.1	76.8	179.7	-165.8	122.9	0	0	0	111.7	D260 H266 D312 L313	N228-D260 VanDerWaalsContact CA-OD2 3.29Å; N228-D260 WeakPolarHBondContact CA-OD2 3.27Å; N228-H266 HydrophobicContact CB-CB 4.22Å; N228-H266 PolarHBondContact N-ND1 3.26Å; N228-H266 WeakPolarHBondContact OD1-CA 3.35Å; N228-H266 VanDerWaalsContact OD1-CB 3.24Å; N228-H266 WeakPolarHBondContact OD1-CB 3.4Å; N228-D312 PolarHBondContact ND2-OD2 2.99Å; N228-L313 WeakPolarHBondContact OD1-CD2 3.31Å; N228-L313 WeakPolarHBondContact OD1-CG 3.19Å
229	D	94.1	Very high	94.1	Very high	76 Å²	76	52.5 Å²	52.5	41%	0.406	29%	0.286	S	S	.	.			trans	-113.9	-17.8	-177	97.5	-19.6	0	0	0	114.7	N137 V227	N137-D229 PolarHBondContact ND2-OD2 2.65Å; V227-D229 VanDerWaalsContact C-N 3.28Å; V227-D229 HydrophobicContact CG1-CB 4.49Å; V227-D229 PolarHBondContact O-N 3.42Å
230	N	95.3	Very high	94.5	Very high	27 Å²	27	49.2 Å²	49.2	14%	0.144	27%	0.267	C	S	.	.	S	Bend	trans	-85.2	140.6	169.5	-62.8	-94.3	0	0	0	110.9	K259 D260 L320	N230-K259 HydrophobicContact CB-CB 4.11Å; N230-D260 WeakPolarHBondContact CB-OD1 3.21Å; N230-D260 PolarHBondContact N-OD1 3.42Å; N230-D260 PolarHBondContact ND2-OD1 2.92Å; N230-L320 WeakPolarHBondContact O-CD1 3.45Å
231	A	95.7	Very high	94.8	Very high	36 Å²	36	52.2 Å²	52.2	30%	0.298	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-95.3	142.6	170.3	0	0	0	0	0	110.1	E233 L320	A231-E233 PolarHBondContact O-N 3.29Å; A231-L320 HydrophobicContact CB-CB 3.9Å; A231-L320 HydrophobicContact CB-CD1 4.49Å
232	P	97	Very high	95	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-64.1	131	-176.3	21.8	-33.1	0	0	0	112.6	T257 D258 I269 L310 S322	P232-T257 CarbonylContact C-O 3.58Å; P232-T257 WeakPolarHBondContact CA-O 3.49Å; P232-D258 WeakPolarHBondContact CA-OD2 3.3Å; P232-D258 WeakPolarHBondContact CB-OD2 3.32Å; P232-D258 WeakPolarHBondContact CD-OD2 3.47Å; P232-I269 HydrophobicContact CB-CD1 3.72Å; P232-I269 HydrophobicContact CB-CG1 3.73Å; P232-I269 HydrophobicContact CB-CG2 4.42Å; P232-I269 HydrophobicContact CG-CG1 4.5Å; P232-L310 HydrophobicContact CB-CB 4.15Å; P232-L310 HydrophobicContact CB-CD1 4.34Å; P232-L310 HydrophobicContact CG-CB 3.85Å; P232-S322 WeakPolarHBondContact O-CB 3.3Å; P232-S322 PolarHBondContact O-OG 2.95Å
233	E	96.6	Very high	95.1	Very high	92 Å²	92	53.8 Å²	53.8	43%	0.43	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.3	-176.7	-69.2	-179.9	-162.1	0	0	112	A231 A256 T257 K259	A231-E233 PolarHBondContact O-N 3.29Å; E233-A256 CarbonylContact O-C 3.57Å; E233-A256 WeakPolarHBondContact O-CA 3.21Å; E233-A256 VanDerWaalsContact O-CB 3.29Å; E233-A256 WeakPolarHBondContact O-CB 3.39Å; E233-T257 HydrophobicContact CB-CG2 4.17Å; E233-T257 PolarHBondContact N-O 2.87Å; E233-T257 PolarHBondContact O-N 2.96Å; E233-K259 IonicContact OE1-NZ 3.16Å; E233-K259 PolarHBondContact OE1-NZ 2.99Å
234	F	97.3	Very high	95.1	Very high	43 Å²	43	50.5 Å²	50.5	19%	0.189	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134.6	174.8	-71.4	-92.9	0	0	0	111.6	L238 V254 I308 L310 A324	F234-L238 HydrophobicContact CD1-CD1 3.8Å; F234-L238 HydrophobicContact CD1-CD2 4.1Å; F234-L238 HydrophobicContact CD1-CG 4.5Å; F234-L238 HydrophobicContact CE1-CD1 4.05Å; F234-L238 HydrophobicContact CG-CD1 4.35Å; F234-V254 HydrophobicContact CD1-CG1 3.81Å; F234-V254 HydrophobicContact CE1-CG1 3.92Å; F234-I308 HydrophobicContact CE1-CB 4Å; F234-I308 HydrophobicContact CE1-CG2 3.76Å; F234-I308 HydrophobicContact CZ-CB 4.14Å; F234-I308 HydrophobicContact CZ-CG2 4.04Å; F234-L310 HydrophobicContact CD1-CD1 3.86Å; F234-L310 HydrophobicContact CD1-CD2 4.45Å; F234-L310 HydrophobicContact CD1-CG 4.26Å; F234-L310 HydrophobicContact CD2-CD1 3.62Å; F234-L310 HydrophobicContact CD2-CG 4.31Å; F234-L310 HydrophobicContact CE1-CD1 3.88Å; F234-L310 HydrophobicContact CE1-CD2 3.97Å; F234-L310 HydrophobicContact CE1-CG 3.77Å; F234-L310 HydrophobicContact CE2-CD1 3.61Å; F234-L310 HydrophobicContact CE2-CG 3.79Å; F234-L310 HydrophobicContact CG-CD1 3.75Å; F234-L310 HydrophobicContact CZ-CD1 3.77Å; F234-L310 HydrophobicContact CZ-CD2 4.18Å; F234-L310 HydrophobicContact CZ-CG 3.52Å; F234-A324 HydrophobicContact CD1-CB 4.27Å; F234-A324 HydrophobicContact CD2-CB 3.62Å; F234-A324 HydrophobicContact CE1-CB 4.09Å; F234-A324 HydrophobicContact CE2-CB 3.42Å; F234-A324 VanDerWaalsContact CE2-CB 3.42Å; F234-A324 HydrophobicContact CG-CB 4.04Å; F234-A324 HydrophobicContact CZ-CB 3.66Å
235	L	95.3	Very high	95	Very high	88 Å²	88	52.1 Å²	52.1	46%	0.461	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.1	177.4	-71.3	-176.6	0	0	0	112.6	N255 T257	L235-N255 HydrophobicContact CB-CB 3.95Å; L235-N255 PolarHBondContact N-O 3.5Å; L235-T257 HydrophobicContact CD1-CG2 4.45Å; L235-T257 HydrophobicContact CD2-CG2 3.87Å; L235-T257 HydrophobicContact CG-CG2 4.13Å
236	G	91.8	Very high	94.8	Very high	71 Å²	71	49.7 Å²	49.7	73%	0.732	27%	0.273	S	S	*	.	S	Bend	trans	87.4	-162	173.6	0	0	0	0	0	114.2
237	K	93	Very high	94.7	Very high	148 Å²	148	53.4 Å²	53.4	64%	0.643	29%	0.292	S	S	*	.			trans	-85.1	139.5	177.2	-80.8	172.3	158.9	-104.3	0	110.8	E239	K237-E239 VanDerWaalsContact C-N 3.29Å; K237-E239 HydrophobicContact CB-CB 4.46Å; K237-E239 WeakPolarHBondContact CD-OE2 3.35Å; K237-E239 IonicContact NZ-OE1 2.99Å; K237-E239 PolarHBondContact NZ-OE1 2.91Å; K237-E239 IonicContact NZ-OE2 2.89Å; K237-E239 PolarHBondContact NZ-OE2 2.79Å; K237-E239 PolarHBondContact O-N 2.8Å
238	L	96.5	Very high	94.6	Very high	22 Å²	22	55.1 Å²	55.1	12%	0.115	31%	0.311	C	S	.	.			trans	-96	47.8	170.9	-56.1	-180	0	0	0	111	F234 F240 V254 I308 A324 A326 T327	F234-L238 HydrophobicContact CD1-CD1 3.8Å; F234-L238 HydrophobicContact CD1-CD2 4.1Å; F234-L238 HydrophobicContact CD1-CG 4.5Å; F234-L238 HydrophobicContact CE1-CD1 4.05Å; F234-L238 HydrophobicContact CG-CD1 4.35Å; L238-F240 HydrophobicContact CB-CE2 4.39Å; L238-F240 HydrophobicContact CD2-CZ 4.38Å; L238-V254 HydrophobicContact CD2-CG1 4.06Å; L238-I308 HydrophobicContact CD1-CD1 4.42Å; L238-A324 HydrophobicContact CD1-CB 3.58Å; L238-A326 HydrophobicContact CB-CB 3.83Å; L238-A326 CarbonylContact O-C 3.59Å; L238-A326 VanDerWaalsContact O-CA 3.25Å; L238-A326 WeakPolarHBondContact O-CA 3.15Å; L238-T327 PolarHBondContact O-N 2.83Å
239	E	97.3	Very high	94.6	Very high	118 Å²	118	57.1 Å²	57.1	55%	0.551	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	117.6	177.9	-72.6	164.1	-157.3	0	0	108.2	K237	K237-E239 VanDerWaalsContact C-N 3.29Å; K237-E239 HydrophobicContact CB-CB 4.46Å; K237-E239 WeakPolarHBondContact CD-OE2 3.35Å; K237-E239 IonicContact NZ-OE1 2.99Å; K237-E239 PolarHBondContact NZ-OE1 2.91Å; K237-E239 IonicContact NZ-OE2 2.89Å; K237-E239 PolarHBondContact NZ-OE2 2.79Å; K237-E239 PolarHBondContact O-N 2.8Å
240	F	96.9	Very high	94.7	Very high	25 Å²	25	57.7 Å²	57.7	11%	0.11	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158.1	-175.1	-55.5	-68.5	0	0	0	111.7	L238 V251 V254 I289 A326 T327 I328 T329	L238-F240 HydrophobicContact CB-CE2 4.39Å; L238-F240 HydrophobicContact CD2-CZ 4.38Å; F240-V251 HydrophobicContact CB-CG1 3.77Å; F240-V251 HydrophobicContact CG-CG1 4.43Å; F240-V254 HydrophobicContact CZ-CG2 4.36Å; F240-I289 HydrophobicContact CD2-CD1 4.23Å; F240-I289 HydrophobicContact CE2-CD1 3.87Å; F240-I289 HydrophobicContact CZ-CD1 4.48Å; F240-A326 HydrophobicContact CD2-CB 4.09Å; F240-A326 HydrophobicContact CE2-CB 3.92Å; F240-T327 PolarHBondContact N-O 3Å; F240-I328 HydrophobicContact CB-CG1 4.34Å; F240-I328 HydrophobicContact CD2-CG1 4.4Å; F240-I328 WeakPolarHBondContact O-CA 3.4Å; F240-T329 PolarHBondContact O-N 3.35Å
241	T	97	Very high	94.8	Very high	67 Å²	67	56.8 Å²	56.8	41%	0.411	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.4	175.5	67.4	0	0	0	0	110.9	T329 K331	T241-T329 VanDerWaalsContact CA-O 3.25Å; T241-T329 WeakPolarHBondContact CA-O 3.4Å; T241-K331 VanDerWaalsContact OG1-CE 3.31Å; T241-K331 WeakPolarHBondContact OG1-CE 3.42Å; T241-K331 PolarHBondContact OG1-NZ 2.92Å
242	V	96.6	Very high	94.7	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154.3	175.6	69.3	0	0	0	0	109.8	E249 V251 T291 L296 I328 T329 L330 K331	V242-E249 HydrophobicContact CG2-CB 4.18Å; V242-E249 HydrophobicContact CG2-CG 3.93Å; V242-E249 WeakPolarHBondContact CG2-OE1 3.41Å; V242-V251 HydrophobicContact CB-CB 4.41Å; V242-V251 HydrophobicContact CB-CG1 4.31Å; V242-V251 HydrophobicContact CB-CG2 4.02Å; V242-V251 HydrophobicContact CG1-CG1 4.49Å; V242-V251 HydrophobicContact CG1-CG2 4.12Å; V242-V251 HydrophobicContact CG2-CG2 4.08Å; V242-T291 HydrophobicContact CG1-CG2 4.06Å; V242-T291 HydrophobicContact CG2-CG2 3.92Å; V242-L296 HydrophobicContact CG1-CD1 4.48Å; V242-I328 HydrophobicContact CG1-CG2 4.1Å; V242-T329 PolarHBondContact N-O 2.85Å; V242-L330 HydrophobicContact CG1-CD2 3.83Å; V242-L330 CarbonylContact O-C 3.57Å; V242-L330 WeakPolarHBondContact O-CA 3.4Å; V242-K331 PolarHBondContact O-N 2.79Å
243	L	94.1	Very high	94.7	Very high	74 Å²	74	60.9 Å²	60.9	39%	0.387	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.1	169.1	-66.5	168	0	0	0	110.3	S246 K331 I333	L243-S246 VanDerWaalsContact O-CB 3.26Å; L243-S246 WeakPolarHBondContact O-CB 3.42Å; L243-S246 PolarHBondContact O-OG 2.76Å; L243-K331 HydrophobicContact CD2-CB 3.89Å; L243-I333 HydrophobicContact CD2-CG2 3.94Å
244	E	94.3	Very high	94.7	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.019	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	167.1	167.9	71.3	-169.8	115.5	0	0	112.3	S246 D297 R298 L330 K331 D332 I333	E244-S246 PolarHBondContact O-N 3Å; E244-D297 WeakPolarHBondContact OE2-CA 3.12Å; E244-R298 WeakPolarHBondContact OE1-CB 3.46Å; E244-R298 VanDerWaalsContact OE2-CB 3.29Å; E244-R298 WeakPolarHBondContact OE2-CB 3.41Å; E244-R298 PolarHBondContact OE2-N 2.76Å; E244-L330 HydrophobicContact CB-CB 4.4Å; E244-L330 HydrophobicContact CB-CD1 4.18Å; E244-K331 PolarHBondContact N-O 2.67Å; E244-D332 VanDerWaalsContact OE1-CA 3.22Å; E244-D332 WeakPolarHBondContact OE1-CA 3.38Å; E244-I333 HydrophobicContact CG-CB 4.43Å; E244-I333 HydrophobicContact CG-CD1 3.85Å; E244-I333 HydrophobicContact CG-CG1 3.65Å; E244-I333 HydrophobicContact CG-CG2 4.25Å; E244-I333 PolarHBondContact OE1-N 2.81Å; E244-I333 VanDerWaalsContact OE1-N 3.07Å
245	Q	90.5	Very high	94.7	Very high	46 Å²	46	58 Å²	58	22%	0.215	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	10.5	-173.7	-54.3	-172.2	15.9	0	0	115.7	K294 L296 I333 D335	Q245-K294 WeakPolarHBondContact O-CD 3.09Å; Q245-K294 WeakPolarHBondContact O-CE 3.31Å; Q245-K294 VanDerWaalsContact O-CG 3.29Å; Q245-K294 WeakPolarHBondContact O-CG 3.18Å; Q245-L296 PolarHBondContact N-O 2.79Å; Q245-I333 HydrophobicContact CB-CD1 4.13Å; Q245-I333 HydrophobicContact CG-CD1 4.18Å; Q245-D335 PolarHBondContact NE2-OD2 2.93Å
246	S	88.7	Confident	94.7	Very high	10 Å²	10	54.7 Å²	54.7	7%	0.07	31%	0.312	C	S	.	.			trans	-70.4	155.5	178.2	62.8	0	0	0	0	111.7	L243 E244 E249 T291	L243-S246 VanDerWaalsContact O-CB 3.26Å; L243-S246 WeakPolarHBondContact O-CB 3.42Å; L243-S246 PolarHBondContact O-OG 2.76Å; E244-S246 PolarHBondContact O-N 3Å; S246-E249 WeakPolarHBondContact CB-OE2 3.44Å; S246-T291 WeakPolarHBondContact OG-CG2 3.23Å; S246-T291 PolarHBondContact OG-OG1 2.74Å
247	L	91.8	Very high	94.9	Very high	99 Å²	99	53.9 Å²	53.9	52%	0.518	29%	0.293	S	S	.	.	S	Bend	trans	-147	128.3	179.6	-177.6	63.9	0	0	0	109.3	E249 I292 K294	L247-E249 PolarHBondContact O-N 3.02Å; L247-I292 VanDerWaalsContact CD1-C 3.41Å; L247-I292 WeakPolarHBondContact CD1-O 3.32Å; L247-K294 HydrophobicContact CB-CD 4.49Å; L247-K294 HydrophobicContact CB-CG 3.88Å; L247-K294 HydrophobicContact CD2-CG 4.34Å
248	A	91.9	Very high	95.1	Very high	80 Å²	80	47.8 Å²	47.8	66%	0.661	27%	0.267	S	S	*	.	S	Bend	trans	56.8	23.2	-171.4	0	0	0	0	0	114	T291	A248-T291 VanDerWaalsContact CA-O 3.27Å; A248-T291 WeakPolarHBondContact CA-O 3.49Å; A248-T291 PolarHBondContact N-O 2.76Å
249	E	94.3	Very high	95	Very high	72 Å²	72	51 Å²	51	34%	0.336	28%	0.28	S	S	.	.			trans	-83.4	142.8	174.8	-170.1	172.9	145.7	0	0	110.3	V242 S246 L247 V251 T290 T291	V242-E249 HydrophobicContact CG2-CB 4.18Å; V242-E249 HydrophobicContact CG2-CG 3.93Å; V242-E249 WeakPolarHBondContact CG2-OE1 3.41Å; S246-E249 WeakPolarHBondContact CB-OE2 3.44Å; L247-E249 PolarHBondContact O-N 3.02Å; E249-V251 PolarHBondContact O-N 3.21Å; E249-T290 CarbonylContact O-C 3.54Å; E249-T290 WeakPolarHBondContact O-CA 3.2Å; E249-T291 PolarHBondContact N-OG1 3.16Å; E249-T291 PolarHBondContact O-N 2.76Å
250	V	96.7	Very high	95	Very high	89 Å²	89	45.5 Å²	45.5	54%	0.539	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.4	177.6	175.6	0	0	0	0	109.4	V288 T290	V250-V288 HydrophobicContact CG1-CG1 3.76Å; V250-V288 HydrophobicContact CG2-CG1 4.2Å; V250-T290 HydrophobicContact CG2-CG2 4.24Å
251	V	96.8	Very high	94.8	Very high	8 Å²	8	46.2 Å²	46.2	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-35	177.2	-179.5	0	0	0	0	111.2	F240 V242 E249 F280 I289 T291 I328	F240-V251 HydrophobicContact CB-CG1 3.77Å; F240-V251 HydrophobicContact CG-CG1 4.43Å; V242-V251 HydrophobicContact CB-CB 4.41Å; V242-V251 HydrophobicContact CB-CG1 4.31Å; V242-V251 HydrophobicContact CB-CG2 4.02Å; V242-V251 HydrophobicContact CG1-CG1 4.49Å; V242-V251 HydrophobicContact CG1-CG2 4.12Å; V242-V251 HydrophobicContact CG2-CG2 4.08Å; E249-V251 PolarHBondContact O-N 3.21Å; V251-F280 HydrophobicContact CG2-CD1 4Å; V251-F280 HydrophobicContact CG2-CE1 4.08Å; V251-I289 HydrophobicContact CB-CB 4.1Å; V251-I289 HydrophobicContact CB-CG2 3.86Å; V251-I289 HydrophobicContact CG1-CG2 4.3Å; V251-I289 HydrophobicContact CG2-CG2 4.02Å; V251-I289 PolarHBondContact N-O 3.18Å; V251-T291 HydrophobicContact CG2-CG2 3.57Å; V251-I328 HydrophobicContact CG1-CB 4.5Å; V251-I328 HydrophobicContact CG1-CD1 4.09Å; V251-I328 HydrophobicContact CG1-CG1 4.03Å; V251-I328 HydrophobicContact CG1-CG2 3.69Å
252	G	95.5	Very high	94.5	Very high	17 Å²	17	47.4 Å²	47.4	18%	0.175	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	-171.7	-177.6	0	0	0	0	0	112.3	V288 I289	G252-V288 WeakPolarHBondContact O-CA 3.49Å; G252-I289 PolarHBondContact O-N 2.91Å
253	K	96.3	Very high	94.1	Very high	105 Å²	105	54.6 Å²	54.6	46%	0.457	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.4	174.7	-170.4	-159.8	171.2	-147.4	0	109.9	N255 T286 V288	K253-N255 WeakPolarHBondContact CE-OD1 3.31Å; K253-N255 PolarHBondContact NZ-OD1 2.84Å; K253-T286 WeakPolarHBondContact CE-O 3.32Å; K253-T286 WeakPolarHBondContact CG-O 3.3Å; K253-V288 HydrophobicContact CB-CG2 4.37Å; K253-V288 HydrophobicContact CG-CG2 3.94Å
254	V	97.3	Very high	93.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.288	C	S	.	.			trans	-73.6	128.2	165.2	-170.9	0	0	0	0	108.3	F234 L238 F240 Y271 I282 G287 I289 I308	F234-V254 HydrophobicContact CD1-CG1 3.81Å; F234-V254 HydrophobicContact CE1-CG1 3.92Å; L238-V254 HydrophobicContact CD2-CG1 4.06Å; F240-V254 HydrophobicContact CZ-CG2 4.36Å; V254-Y271 HydrophobicContact CB-CD1 3.97Å; V254-Y271 HydrophobicContact CB-CE1 3.91Å; V254-Y271 HydrophobicContact CG1-CD1 4Å; V254-Y271 HydrophobicContact CG1-CE1 3.8Å; V254-I282 HydrophobicContact CB-CD1 4.39Å; V254-I282 HydrophobicContact CG2-CD1 3.69Å; V254-G287 PolarHBondContact N-O 2.82Å; V254-I289 HydrophobicContact CG2-CD1 3.82Å; V254-I289 HydrophobicContact CG2-CG1 4.18Å; V254-I308 HydrophobicContact CG2-CD1 3.71Å
255	N	95.6	Very high	93.7	Very high	73 Å²	73	55.3 Å²	55.3	39%	0.39	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	146.9	166.4	-66.7	-45.2	0	0	0	108.8	L235 K253	L235-N255 HydrophobicContact CB-CB 3.95Å; L235-N255 PolarHBondContact N-O 3.5Å; K253-N255 WeakPolarHBondContact CE-OD1 3.31Å; K253-N255 PolarHBondContact NZ-OD1 2.84Å
256	A	96	Very high	93.7	Very high	19 Å²	19	54.9 Å²	54.9	16%	0.157	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	162.5	172.8	0	0	0	0	0	109.6	E233 I269 Y271 L310	E233-A256 CarbonylContact O-C 3.57Å; E233-A256 WeakPolarHBondContact O-CA 3.21Å; E233-A256 VanDerWaalsContact O-CB 3.29Å; E233-A256 WeakPolarHBondContact O-CB 3.39Å; A256-I269 HydrophobicContact CB-CD1 3.8Å; A256-I269 HydrophobicContact CB-CG2 4.36Å; A256-Y271 HydrophobicContact CB-CE1 4.11Å; A256-Y271 PolarHBondContact N-OH 2.89Å; A256-L310 HydrophobicContact CB-CD1 3.54Å; A256-L310 HydrophobicContact CB-CD2 3.96Å; A256-L310 HydrophobicContact CB-CG 4.38Å
257	T	95.9	Very high	94	Very high	55 Å²	55	55.7 Å²	55.7	34%	0.337	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154.2	171.4	-165.5	0	0	0	0	109.2	P232 E233 L235	P232-T257 CarbonylContact C-O 3.58Å; P232-T257 WeakPolarHBondContact CA-O 3.49Å; E233-T257 HydrophobicContact CB-CG2 4.17Å; E233-T257 PolarHBondContact N-O 2.87Å; E233-T257 PolarHBondContact O-N 2.96Å; L235-T257 HydrophobicContact CD1-CG2 4.45Å; L235-T257 HydrophobicContact CD2-CG2 3.87Å; L235-T257 HydrophobicContact CG-CG2 4.13Å
258	D	96.8	Very high	94.1	Very high	20 Å²	20	55.7 Å²	55.7	11%	0.107	30%	0.302	C	S	.	.			trans	-119.8	170.2	161.1	-136.9	-46.9	0	0	0	109.1	P232 V267 I269	P232-D258 WeakPolarHBondContact CA-OD2 3.3Å; P232-D258 WeakPolarHBondContact CB-OD2 3.32Å; P232-D258 WeakPolarHBondContact CD-OD2 3.47Å; D258-V267 HydrophobicContact CB-CB 4.2Å; D258-V267 HydrophobicContact CB-CG1 4.1Å; D258-I269 HydrophobicContact CB-CD1 4.24Å
259	K	95.8	Very high	94.3	Very high	90 Å²	90	53.1 Å²	53.1	39%	0.391	28%	0.277	S	S	.	.			trans	-112.2	-23	178.7	-53.6	-168	-157.2	74.5	0	114.1	R193 E194 N230 E233	R193-K259 PolarHBondContact NH2-O 3.46Å; E194-K259 HydrophobicContact CG-CB 3.79Å; N230-K259 HydrophobicContact CB-CB 4.11Å; E233-K259 IonicContact OE1-NZ 3.16Å; E233-K259 PolarHBondContact OE1-NZ 2.99Å
260	D	95.8	Very high	94.4	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	28%	0.282	C	S	.	.	S	Bend	trans	-54.9	177.8	172.3	-58.7	-4.4	0	0	0	112.4	R193 N228 N230 P262 H266 V267	R193-D260 PolarHBondContact NH2-O 2.9Å; N228-D260 VanDerWaalsContact CA-OD2 3.29Å; N228-D260 WeakPolarHBondContact CA-OD2 3.27Å; N230-D260 WeakPolarHBondContact CB-OD1 3.21Å; N230-D260 PolarHBondContact N-OD1 3.42Å; N230-D260 PolarHBondContact ND2-OD1 2.92Å; D260-P262 WeakPolarHBondContact O-CD 3.39Å; D260-H266 HydrophobicContact CB-CB 3.74Å; D260-H266 WeakPolarHBondContact OD2-CB 3.49Å; D260-V267 VanDerWaalsContact C-CG1 3.48Å; D260-V267 HydrophobicContact CB-CG1 4.18Å; D260-V267 WeakPolarHBondContact O-CG1 3.5Å
261	D	93.1	Very high	94.4	Very high	40 Å²	40	52.1 Å²	52.1	21%	0.214	26%	0.261	C	S	.	.			trans	-65.9	120.5	-169.2	-169.5	-17.2	0	0	0	114.2	R193 D226 E263 T264 V267	R193-D261 VanDerWaalsContact NH1-CA 3.27Å; R193-D261 VanDerWaalsContact NH1-CB 3.26Å; R193-D261 IonicContact NH1-OD2 2.64Å; D226-D261 HydrophobicContact CB-CB 3.75Å; D226-D261 VanDerWaalsContact CG-N 3.35Å; D226-D261 WeakPolarHBondContact OD1-CB 3.21Å; D226-D261 PolarHBondContact OD1-N 2.7Å; D226-D261 VanDerWaalsContact OD2-CB 3.25Å; D226-D261 WeakPolarHBondContact OD2-CB 3.11Å; D226-D261 PolarHBondContact OD2-N 2.87Å; D261-E263 PolarHBondContact O-N 2.98Å; D261-E263 WeakPolarHBondContact OD1-CB 3.48Å; D261-E263 PolarHBondContact OD1-N 2.89Å; D261-T264 HydrophobicContact CB-CG2 3.74Å; D261-T264 PolarHBondContact O-N 2.92Å; D261-T264 PolarHBondContact O-OG1 3.37Å; D261-T264 VanDerWaalsContact O-OG1 3.05Å; D261-V267 VanDerWaalsContact C-CG1 3.49Å; D261-V267 VanDerWaalsContact O-CG1 3.25Å; D261-V267 WeakPolarHBondContact O-CG1 3.05Å; D261-V267 WeakPolarHBondContact O-CG2 3.39Å
262	P	90.4	Very high	94.4	Very high	91 Å²	91	58 Å²	58	59%	0.591	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.9	175.5	24.4	-35.3	0	0	0	114.8	D260 R268	D260-P262 WeakPolarHBondContact O-CD 3.39Å; P262-R268 PolarHBondContact O-NH2 2.81Å
263	E	88.3	Confident	94.5	Very high	153 Å²	153	57.7 Å²	57.7	72%	0.715	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-15	176.3	-57.9	-164.2	177.1	0	0	114.3	D261	D261-E263 PolarHBondContact O-N 2.98Å; D261-E263 WeakPolarHBondContact OD1-CB 3.48Å; D261-E263 PolarHBondContact OD1-N 2.89Å
264	T	89.8	Confident	94.5	Very high	16 Å²	16	56 Å²	56	10%	0.098	27%	0.272	C	S	.	.	S	Bend	trans	-86.6	-173.3	178.1	66.7	0	0	0	0	112.2	D226 D261 H266 R268	D226-T264 HydrophobicContact CB-CG2 4.17Å; D226-T264 VanDerWaalsContact OD2-CG2 3.31Å; D226-T264 WeakPolarHBondContact OD2-CG2 3.31Å; D226-T264 PolarHBondContact OD2-OG1 2.97Å; D261-T264 HydrophobicContact CB-CG2 3.74Å; D261-T264 PolarHBondContact O-N 2.92Å; D261-T264 PolarHBondContact O-OG1 3.37Å; D261-T264 VanDerWaalsContact O-OG1 3.05Å; T264-H266 WeakPolarHBondContact OG1-CB 3.09Å; T264-H266 PolarHBondContact OG1-N 2.88Å; T264-R268 PolarHBondContact O-NE 2.91Å; T264-R268 VanDerWaalsContact O-NE 3.16Å; T264-R268 PolarHBondContact O-NH2 2.87Å
265	D	89.8	Confident	94.4	Very high	76 Å²	76	58.8 Å²	58.8	41%	0.406	29%	0.287	S	S	.	.	S	Bend	trans	-92.1	-4.4	171.9	-105.8	11.5	0	0	0	112.7	R268 L313 K314	D265-R268 HydrophobicContact CB-CG 4.39Å; D265-R268 VanDerWaalsContact O-CB 3.31Å; D265-R268 WeakPolarHBondContact O-CB 3.04Å; D265-R268 WeakPolarHBondContact O-CG 3.47Å; D265-R268 PolarHBondContact O-N 2.96Å; D265-L313 WeakPolarHBondContact O-CA 3.48Å; D265-L313 PolarHBondContact O-N 3.09Å; D265-K314 VanDerWaalsContact OD1-CE 3.24Å; D265-K314 WeakPolarHBondContact OD1-CE 3.49Å; D265-K314 IonicContact OD1-NZ 2.69Å; D265-K314 PolarHBondContact OD1-NZ 2.88Å; D265-K314 WeakPolarHBondContact OD2-CE 3.39Å; D265-K314 IonicContact OD2-NZ 2.72Å; D265-K314 PolarHBondContact OD2-NZ 2.83Å
266	H	92	Very high	94.2	Very high	37 Å²	37	56.3 Å²	56.3	17%	0.171	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-58.6	-177.9	-56.1	169.4	0	0	0	109.2	D226 N228 D260 T264 R268 D312 L313	D226-H266 IonicContact OD2-CE1 3.7Å; D226-H266 PolarHBondContact OD2-CE1 2.88Å; D226-H266 VanDerWaalsContact OD2-CE1 3.23Å; D226-H266 IonicContact OD2-CG 2.71Å; D226-H266 IonicContact OD2-ND1 3.41Å; D226-H266 PolarHBondContact OD2-ND1 2.89Å; N228-H266 HydrophobicContact CB-CB 4.22Å; N228-H266 PolarHBondContact N-ND1 3.26Å; N228-H266 WeakPolarHBondContact OD1-CA 3.35Å; N228-H266 VanDerWaalsContact OD1-CB 3.24Å; N228-H266 WeakPolarHBondContact OD1-CB 3.4Å; D260-H266 HydrophobicContact CB-CB 3.74Å; D260-H266 WeakPolarHBondContact OD2-CB 3.49Å; T264-H266 WeakPolarHBondContact OG1-CB 3.09Å; T264-H266 PolarHBondContact OG1-N 2.88Å; H266-R268 PolarHBondContact O-N 3.09Å; H266-D312 VanDerWaalsContact O-CB 3.24Å; H266-D312 WeakPolarHBondContact O-CB 3Å; H266-L313 PolarHBondContact O-N 2.88Å; H266-L313 VanDerWaalsContact O-N 3.15Å
267	V	93.9	Very high	94.1	Very high	28 Å²	28	60.2 Å²	60.2	17%	0.17	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	1.1	175.8	-54.9	0	0	0	0	116.9	D258 D260 D261 I269	D258-V267 HydrophobicContact CB-CB 4.2Å; D258-V267 HydrophobicContact CB-CG1 4.1Å; D260-V267 VanDerWaalsContact C-CG1 3.48Å; D260-V267 HydrophobicContact CB-CG1 4.18Å; D260-V267 WeakPolarHBondContact O-CG1 3.5Å; D261-V267 VanDerWaalsContact C-CG1 3.49Å; D261-V267 VanDerWaalsContact O-CG1 3.25Å; D261-V267 WeakPolarHBondContact O-CG1 3.05Å; D261-V267 WeakPolarHBondContact O-CG2 3.39Å; V267-I269 PolarHBondContact O-N 3.4Å
268	R	94.1	Very high	94	Very high	99 Å²	99	63.8 Å²	63.8	37%	0.374	31%	0.314	S	S	.	.			trans	-84.7	69.4	-173.6	-56.4	-65.6	176.2	-136.7	-20.3	110.9	P262 T264 D265 H266 R270 K314	P262-R268 PolarHBondContact O-NH2 2.81Å; T264-R268 PolarHBondContact O-NE 2.91Å; T264-R268 VanDerWaalsContact O-NE 3.16Å; T264-R268 PolarHBondContact O-NH2 2.87Å; D265-R268 HydrophobicContact CB-CG 4.39Å; D265-R268 VanDerWaalsContact O-CB 3.31Å; D265-R268 WeakPolarHBondContact O-CB 3.04Å; D265-R268 WeakPolarHBondContact O-CG 3.47Å; D265-R268 PolarHBondContact O-N 2.96Å; H266-R268 PolarHBondContact O-N 3.09Å; R268-R270 PolarHBondContact O-N 2.92Å; R268-K314 HydrophobicContact CB-CD 4.43Å; R268-K314 HydrophobicContact CB-CG 3.64Å; R268-K314 WeakPolarHBondContact O-CA 3.49Å; R268-K314 PolarHBondContact O-N 3.08Å
269	I	96.3	Very high	94	Very high	25 Å²	25	65.2 Å²	65.2	13%	0.128	32%	0.319	C	S	.	.			trans	-59.4	125.8	-176.8	-58.8	167.6	0	0	0	111.5	P232 A256 D258 V267 Y271 L310 R311	P232-I269 HydrophobicContact CB-CD1 3.72Å; P232-I269 HydrophobicContact CB-CG1 3.73Å; P232-I269 HydrophobicContact CB-CG2 4.42Å; P232-I269 HydrophobicContact CG-CG1 4.5Å; A256-I269 HydrophobicContact CB-CD1 3.8Å; A256-I269 HydrophobicContact CB-CG2 4.36Å; D258-I269 HydrophobicContact CB-CD1 4.24Å; V267-I269 PolarHBondContact O-N 3.4Å; I269-Y271 HydrophobicContact CB-CE2 4.47Å; I269-Y271 HydrophobicContact CG2-CD2 4.36Å; I269-Y271 HydrophobicContact CG2-CE2 3.98Å; I269-L310 HydrophobicContact CG2-CB 4.16Å; I269-L310 HydrophobicContact CG2-CD2 3.99Å; I269-R311 CarbonylContact C-O 3.58Å; I269-R311 VanDerWaalsContact CA-O 3.28Å; I269-R311 WeakPolarHBondContact CA-O 3.43Å
270	R	96.1	Very high	94	Very high	117 Å²	117	61 Å²	61	44%	0.442	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.9	167.6	-158.7	-176	-147.6	152.6	-0.7	110.2	R268 A284 R311 K314	R268-R270 PolarHBondContact O-N 2.92Å; R270-A284 CarbonylContact C-O 3.53Å; R270-A284 WeakPolarHBondContact CA-O 3.32Å; R270-A284 HydrophobicContact CG-CB 4.01Å; R270-A284 WeakPolarHBondContact CG-O 3.35Å; R270-R311 PolarHBondContact N-O 3.33Å; R270-R311 PolarHBondContact O-N 3.24Å; R270-K314 WeakPolarHBondContact CD-O 3.44Å; R270-K314 PolarHBondContact NH1-O 3.03Å
271	Y	97.6	Very high	94.1	Very high	23 Å²	23	65.4 Å²	65.4	9%	0.09	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	140.9	179.7	-59.7	-101.2	0	0	0	110.4	V254 A256 I269 I282 A284 G287 L310	V254-Y271 HydrophobicContact CB-CD1 3.97Å; V254-Y271 HydrophobicContact CB-CE1 3.91Å; V254-Y271 HydrophobicContact CG1-CD1 4Å; V254-Y271 HydrophobicContact CG1-CE1 3.8Å; A256-Y271 HydrophobicContact CB-CE1 4.11Å; A256-Y271 PolarHBondContact N-OH 2.89Å; I269-Y271 HydrophobicContact CB-CE2 4.47Å; I269-Y271 HydrophobicContact CG2-CD2 4.36Å; I269-Y271 HydrophobicContact CG2-CE2 3.98Å; Y271-I282 HydrophobicContact CD1-CD1 4.39Å; Y271-A284 WeakPolarHBondContact CD2-O 3.48Å; Y271-A284 PolarHBondContact N-O 2.88Å; Y271-A284 WeakPolarHBondContact O-CA 3.4Å; Y271-G287 VanDerWaalsContact CG-CA 3.5Å; Y271-L310 HydrophobicContact CD1-CD2 3.38Å; Y271-L310 HydrophobicContact CE1-CD2 3.49Å; Y271-L310 VanDerWaalsContact CE1-CD2 3.49Å; Y271-L310 HydrophobicContact CG-CD2 4.2Å
272	R	96.3	Very high	94.3	Very high	133 Å²	133	64 Å²	64	50%	0.502	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.5	176.5	-175.2	-169.7	-178.9	-168.1	1	111	L274 I308 E309	R272-L274 HydrophobicContact CG-CD2 4.48Å; R272-I308 CarbonylContact O-C 3.59Å; R272-I308 WeakPolarHBondContact O-CA 3.36Å; R272-E309 HydrophobicContact CB-CB 4.31Å; R272-E309 WeakPolarHBondContact CD-OE2 3.15Å; R272-E309 IonicContact CZ-OE2 2.64Å; R272-E309 PolarHBondContact N-O 3.1Å; R272-E309 IonicContact NE-OE2 2.79Å; R272-E309 IonicContact NH1-OE2 2.74Å; R272-E309 PolarHBondContact NH1-OE2 2.95Å; R272-E309 VanDerWaalsContact NH1-OE2 3.08Å; R272-E309 PolarHBondContact O-N 3.11Å
273	L	97.3	Very high	94.6	Very high	10 Å²	10	63.7 Å²	63.7	5%	0.052	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.9	170.1	-150.6	70.1	0	0	0	109.2	D275 L277 F280 I282 V306 I308	L273-D275 WeakPolarHBondContact CD2-O 3.42Å; L273-D275 VanDerWaalsContact CG-O 3.28Å; L273-D275 WeakPolarHBondContact CG-O 3.43Å; L273-L277 HydrophobicContact CB-CD2 4.01Å; L273-L277 HydrophobicContact CD2-CD2 4.37Å; L273-F280 HydrophobicContact CD2-CB 3.9Å; L273-I282 HydrophobicContact CB-CG2 3.89Å; L273-V306 HydrophobicContact CD1-CB 4.14Å; L273-V306 HydrophobicContact CD1-CG2 3.97Å; L273-I308 HydrophobicContact CD1-CG1 3.66Å
274	L	96.5	Very high	95	Very high	70 Å²	70	57.9 Å²	57.9	37%	0.366	28%	0.282	S	S	.	.	S	Bend	trans	-98.4	-24.2	-177	-60.7	-175.2	0	0	0	113.3	R272 T307 E309 T323	R272-L274 HydrophobicContact CG-CD2 4.48Å; L274-T307 HydrophobicContact CD1-CG2 4.13Å; L274-T307 PolarHBondContact N-O 2.94Å; L274-E309 HydrophobicContact CD1-CB 4.09Å; L274-E309 HydrophobicContact CD2-CB 3.93Å; L274-E309 HydrophobicContact CG-CB 3.97Å; L274-T323 HydrophobicContact CD1-CG2 4.12Å
275	D	95.4	Very high	95.2	Very high	57 Å²	57	62.3 Å²	62.3	31%	0.305	31%	0.305	S	S	.	.	S	Bend	trans	-138.4	-170.7	179.2	56.2	36	0	0	0	109.4	L273 L277 V306 T307	L273-D275 WeakPolarHBondContact CD2-O 3.42Å; L273-D275 VanDerWaalsContact CG-O 3.28Å; L273-D275 WeakPolarHBondContact CG-O 3.43Å; D275-L277 PolarHBondContact O-N 2.03Å; D275-V306 WeakPolarHBondContact OD1-CA 3.39Å; D275-V306 WeakPolarHBondContact OD1-CB 3.24Å; D275-T307 VanDerWaalsContact CG-N 3.28Å; D275-T307 PolarHBondContact OD1-N 3.22Å; D275-T307 WeakPolarHBondContact OD2-CB 3.47Å; D275-T307 PolarHBondContact OD2-N 3.41Å; D275-T307 VanDerWaalsContact OD2-N 3.09Å; D275-T307 PolarHBondContact OD2-OG1 2.86Å
276	G	91.6	Very high	95.5	Very high	22 Å²	22	61.4 Å²	61.4	23%	0.227	30%	0.302	C	S	.	.			trans	65.8	3.7	176.2	0	0	0	0	0	116.3	D278 F279 F280	G276-D278 PolarHBondContact O-N 3.15Å; G276-F279 PolarHBondContact O-N 3.31Å; G276-F280 PolarHBondContact O-N 3.33Å
277	L	94.2	Very high	95.7	Very high	101 Å²	101	59.7 Å²	59.7	53%	0.529	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.6	-170.9	-62.7	174.1	0	0	0	115	L273 D275 F279 I292	L273-L277 HydrophobicContact CB-CD2 4.01Å; L273-L277 HydrophobicContact CD2-CD2 4.37Å; D275-L277 PolarHBondContact O-N 2.03Å; L277-F279 VanDerWaalsContact C-N 3.26Å; L277-F279 PolarHBondContact O-N 3Å; L277-I292 WeakPolarHBondContact O-CD1 3.29Å
278	D	93.8	Very high	95.9	Very high	130 Å²	130	60.1 Å²	60.1	70%	0.695	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.6	174	-60.4	-61.6	0	0	0	113.5	G276 S293	G276-D278 PolarHBondContact O-N 3.15Å; D278-S293 WeakPolarHBondContact O-CB 3.19Å
279	F	95.4	Very high	96	Very high	50 Å²	50	55.4 Å²	55.4	22%	0.219	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-33.7	-172.8	-57.1	-82.8	0	0	0	113.8	G276 L277 I292 K295 L296 H304	G276-F279 PolarHBondContact O-N 3.31Å; L277-F279 VanDerWaalsContact C-N 3.26Å; L277-F279 PolarHBondContact O-N 3Å; F279-I292 PolarHBondContact O-N 2.84Å; F279-K295 HydrophobicContact CD1-CB 4.47Å; F279-K295 HydrophobicContact CE1-CB 3.9Å; F279-K295 WeakPolarHBondContact CE1-O 3.41Å; F279-L296 HydrophobicContact CB-CD2 3.79Å; F279-L296 HydrophobicContact CB-CG 4.27Å; F279-L296 HydrophobicContact CD1-CD2 3.56Å; F279-L296 HydrophobicContact CD1-CG 3.94Å; F279-L296 HydrophobicContact CE1-CD2 4.34Å; F279-L296 HydrophobicContact CG-CD2 3.83Å; F279-L296 HydrophobicContact CG-CG 4.47Å; F279-H304 AromaticContact CD2-CE1 3.94Å
280	F	97.4	Very high	96.1	Very high	1 Å²	1	55.8 Å²	55.8	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149.8	-172.6	-53.1	-72.6	0	0	0	112.7	V251 L273 G276 I289 T290 T291 L296 H304 V306 I328	V251-F280 HydrophobicContact CG2-CD1 4Å; V251-F280 HydrophobicContact CG2-CE1 4.08Å; L273-F280 HydrophobicContact CD2-CB 3.9Å; G276-F280 PolarHBondContact O-N 3.33Å; F280-I289 HydrophobicContact CB-CG2 4.29Å; F280-I289 HydrophobicContact CD1-CG2 4.45Å; F280-T290 WeakPolarHBondContact CA-O 3.36Å; F280-T291 HydrophobicContact CD1-CG2 4.11Å; F280-T291 HydrophobicContact CE1-CG2 3.97Å; F280-L296 HydrophobicContact CE1-CD1 3.71Å; F280-L296 HydrophobicContact CE1-CD2 4.37Å; F280-L296 HydrophobicContact CE2-CD2 4.27Å; F280-L296 HydrophobicContact CZ-CD1 3.94Å; F280-L296 HydrophobicContact CZ-CD2 3.75Å; F280-H304 HydrophobicContact CE2-CB 3.76Å; F280-H304 AromaticContact CE2-CG 3.93Å; F280-H304 AromaticContact CE2-ND1 3.72Å; F280-H304 HydrophobicContact CZ-CB 4.14Å; F280-V306 HydrophobicContact CD2-CG1 3.97Å; F280-V306 HydrophobicContact CE2-CG1 4.28Å; F280-I328 HydrophobicContact CD1-CD1 3.92Å; F280-I328 HydrophobicContact CD2-CD1 3.94Å; F280-I328 HydrophobicContact CE1-CD1 3.81Å; F280-I328 HydrophobicContact CE1-CG2 3.95Å; F280-I328 HydrophobicContact CE2-CD1 3.83Å; F280-I328 HydrophobicContact CG-CD1 3.98Å; F280-I328 HydrophobicContact CZ-CB 4.21Å; F280-I328 HydrophobicContact CZ-CD1 3.76Å; F280-I328 HydrophobicContact CZ-CG2 3.82Å
281	H	96.9	Very high	96.1	Very high	95 Å²	95	50.2 Å²	50.2	44%	0.44	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.5	171.6	167.7	-91	0	0	0	109	I289 T290 I292	H281-I289 CarbonylContact O-C 3.54Å; H281-I289 WeakPolarHBondContact O-CA 3.4Å; H281-T290 PolarHBondContact N-O 2.68Å; H281-T290 PolarHBondContact O-N 2.67Å; H281-T290 PolarHBondContact O-OG1 2.88Å; H281-I292 HydrophobicContact CB-CG2 3.6Å
282	I	97.8	Very high	96	Very high	11 Å²	11	53.2 Å²	53.2	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.3	173.8	-167.3	168.9	0	0	0	110.2	V254 Y271 L273 A284 V288 I289 I308	V254-I282 HydrophobicContact CB-CD1 4.39Å; V254-I282 HydrophobicContact CG2-CD1 3.69Å; Y271-I282 HydrophobicContact CD1-CD1 4.39Å; L273-I282 HydrophobicContact CB-CG2 3.89Å; I282-A284 PolarHBondContact O-N 3.24Å; I282-V288 CarbonylContact C-O 3.37Å; I282-V288 WeakPolarHBondContact CA-O 3.5Å; I282-I289 HydrophobicContact CB-CG1 4.26Å; I282-I289 HydrophobicContact CD1-CD1 4.41Å; I282-I289 HydrophobicContact CD1-CG1 3.84Å; I282-I289 HydrophobicContact CG1-CG1 3.89Å; I282-I308 HydrophobicContact CD1-CG2 4.14Å
283	H	97.2	Very high	95.7	Very high	84 Å²	84	47.9 Å²	47.9	39%	0.389	26%	0.261	S	S	.	.			trans	-73.7	118.6	-179.9	-175.9	-65.5	0	0	0	111	D285 T286 G287 V288	H283-D285 VanDerWaalsContact C-N 3.29Å; H283-D285 IonicContact CE1-OD2 2.68Å; H283-D285 PolarHBondContact CE1-OD2 2.77Å; H283-D285 PolarHBondContact ND1-N 2.87Å; H283-D285 IonicContact ND1-OD2 2.76Å; H283-D285 PolarHBondContact O-N 2.88Å; H283-D285 VanDerWaalsContact O-N 3.1Å; H283-T286 VanDerWaalsContact CB-OG1 3.32Å; H283-T286 WeakPolarHBondContact CB-OG1 3.36Å; H283-T286 VanDerWaalsContact CG-OG1 3.26Å; H283-T286 PolarHBondContact ND1-OG1 2.83Å; H283-T286 VanDerWaalsContact ND1-OG1 3.12Å; H283-T286 PolarHBondContact O-N 2.92Å; H283-T286 VanDerWaalsContact O-N 3.13Å; H283-G287 PolarHBondContact O-N 3.32Å; H283-V288 HydrophobicContact CB-CB 4.45Å; H283-V288 PolarHBondContact N-O 3.44Å
284	A	96	Very high	95.3	Very high	30 Å²	30	53.8 Å²	53.8	25%	0.248	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-37.6	-166.5	0	0	0	0	0	115.1	R270 Y271 I282	R270-A284 CarbonylContact C-O 3.53Å; R270-A284 WeakPolarHBondContact CA-O 3.32Å; R270-A284 HydrophobicContact CG-CB 4.01Å; R270-A284 WeakPolarHBondContact CG-O 3.35Å; Y271-A284 WeakPolarHBondContact CD2-O 3.48Å; Y271-A284 PolarHBondContact N-O 2.88Å; Y271-A284 WeakPolarHBondContact O-CA 3.4Å; I282-A284 PolarHBondContact O-N 3.24Å
285	D	94	Very high	95.1	Very high	110 Å²	110	58.5 Å²	58.5	59%	0.588	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	1	-174.2	-34.5	-74.7	0	0	0	113.9	H283	H283-D285 VanDerWaalsContact C-N 3.29Å; H283-D285 IonicContact CE1-OD2 2.68Å; H283-D285 PolarHBondContact CE1-OD2 2.77Å; H283-D285 PolarHBondContact ND1-N 2.87Å; H283-D285 IonicContact ND1-OD2 2.76Å; H283-D285 PolarHBondContact O-N 2.88Å; H283-D285 VanDerWaalsContact O-N 3.1Å
286	T	95.4	Very high	95	Very high	57 Å²	57	55.8 Å²	55.8	35%	0.35	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-10.3	-172.5	65.9	0	0	0	0	114.8	K253 H283 V288	K253-T286 WeakPolarHBondContact CE-O 3.32Å; K253-T286 WeakPolarHBondContact CG-O 3.3Å; H283-T286 VanDerWaalsContact CB-OG1 3.32Å; H283-T286 WeakPolarHBondContact CB-OG1 3.36Å; H283-T286 VanDerWaalsContact CG-OG1 3.26Å; H283-T286 PolarHBondContact ND1-OG1 2.83Å; H283-T286 VanDerWaalsContact ND1-OG1 3.12Å; H283-T286 PolarHBondContact O-N 2.92Å; H283-T286 VanDerWaalsContact O-N 3.13Å; T286-V288 PolarHBondContact O-N 2.69Å; T286-V288 VanDerWaalsContact O-N 3.17Å
287	G	95.9	Very high	95.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.292	C	S	.	.			trans	69.1	6.1	179.9	0	0	0	0	0	114.8	V254 Y271 H283 I289	V254-G287 PolarHBondContact N-O 2.82Å; Y271-G287 VanDerWaalsContact CG-CA 3.5Å; H283-G287 PolarHBondContact O-N 3.32Å; G287-I289 PolarHBondContact O-N 3.02Å
288	V	97.8	Very high	95.1	Very high	38 Å²	38	53.7 Å²	53.7	23%	0.23	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	123.2	179.4	-179.8	0	0	0	0	109.9	V250 G252 K253 I282 H283 T286 T290	V250-V288 HydrophobicContact CG1-CG1 3.76Å; V250-V288 HydrophobicContact CG2-CG1 4.2Å; G252-V288 WeakPolarHBondContact O-CA 3.49Å; K253-V288 HydrophobicContact CB-CG2 4.37Å; K253-V288 HydrophobicContact CG-CG2 3.94Å; I282-V288 CarbonylContact C-O 3.37Å; I282-V288 WeakPolarHBondContact CA-O 3.5Å; H283-V288 HydrophobicContact CB-CB 4.45Å; H283-V288 PolarHBondContact N-O 3.44Å; T286-V288 PolarHBondContact O-N 2.69Å; T286-V288 VanDerWaalsContact O-N 3.17Å; V288-T290 HydrophobicContact CG1-CG2 4.3Å
289	I	97.8	Very high	95.2	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	132.9	176.3	-57.1	174.1	0	0	0	109.1	F240 V251 G252 V254 F280 H281 I282 G287 I308 I328	F240-I289 HydrophobicContact CD2-CD1 4.23Å; F240-I289 HydrophobicContact CE2-CD1 3.87Å; F240-I289 HydrophobicContact CZ-CD1 4.48Å; V251-I289 HydrophobicContact CB-CB 4.1Å; V251-I289 HydrophobicContact CB-CG2 3.86Å; V251-I289 HydrophobicContact CG1-CG2 4.3Å; V251-I289 HydrophobicContact CG2-CG2 4.02Å; V251-I289 PolarHBondContact N-O 3.18Å; G252-I289 PolarHBondContact O-N 2.91Å; V254-I289 HydrophobicContact CG2-CD1 3.82Å; V254-I289 HydrophobicContact CG2-CG1 4.18Å; F280-I289 HydrophobicContact CB-CG2 4.29Å; F280-I289 HydrophobicContact CD1-CG2 4.45Å; H281-I289 CarbonylContact O-C 3.54Å; H281-I289 WeakPolarHBondContact O-CA 3.4Å; I282-I289 HydrophobicContact CB-CG1 4.26Å; I282-I289 HydrophobicContact CD1-CD1 4.41Å; I282-I289 HydrophobicContact CD1-CG1 3.84Å; I282-I289 HydrophobicContact CG1-CG1 3.89Å; G287-I289 PolarHBondContact O-N 3.02Å; I289-I308 HydrophobicContact CD1-CD1 4.28Å; I289-I328 HydrophobicContact CG2-CD1 4.47Å
290	T	97.4	Very high	95.2	Very high	32 Å²	32	53 Å²	53	20%	0.196	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.3	-179.3	53.6	0	0	0	0	112.2	E249 V250 F280 H281 V288	E249-T290 CarbonylContact O-C 3.54Å; E249-T290 WeakPolarHBondContact O-CA 3.2Å; V250-T290 HydrophobicContact CG2-CG2 4.24Å; F280-T290 WeakPolarHBondContact CA-O 3.36Å; H281-T290 PolarHBondContact N-O 2.68Å; H281-T290 PolarHBondContact O-N 2.67Å; H281-T290 PolarHBondContact O-OG1 2.88Å; V288-T290 HydrophobicContact CG1-CG2 4.3Å
291	T	97.2	Very high	95	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	139	171.8	59	0	0	0	0	111.5	V242 S246 A248 E249 V251 F280 L296	V242-T291 HydrophobicContact CG1-CG2 4.06Å; V242-T291 HydrophobicContact CG2-CG2 3.92Å; S246-T291 WeakPolarHBondContact OG-CG2 3.23Å; S246-T291 PolarHBondContact OG-OG1 2.74Å; A248-T291 VanDerWaalsContact CA-O 3.27Å; A248-T291 WeakPolarHBondContact CA-O 3.49Å; A248-T291 PolarHBondContact N-O 2.76Å; E249-T291 PolarHBondContact N-OG1 3.16Å; E249-T291 PolarHBondContact O-N 2.76Å; V251-T291 HydrophobicContact CG2-CG2 3.57Å; F280-T291 HydrophobicContact CD1-CG2 4.11Å; F280-T291 HydrophobicContact CE1-CG2 3.97Å; T291-L296 HydrophobicContact CG2-CD1 3.57Å
292	I	94.9	Very high	94.9	Very high	86 Å²	86	58 Å²	58	44%	0.441	30%	0.295	S	S	.	.			trans	-120.8	0.2	179.7	68.3	166.1	0	0	0	113.7	L247 L277 F279 H281	L247-I292 VanDerWaalsContact CD1-C 3.41Å; L247-I292 WeakPolarHBondContact CD1-O 3.32Å; L277-I292 WeakPolarHBondContact O-CD1 3.29Å; F279-I292 PolarHBondContact O-N 2.84Å; H281-I292 HydrophobicContact CB-CG2 3.6Å
293	S	90.3	Very high	94.9	Very high	21 Å²	21	60.1 Å²	60.1	15%	0.147	31%	0.308	C	S	.	.			trans	-147.6	124.1	-170.8	-176	0	0	0	0	111.7	D278 K295	D278-S293 WeakPolarHBondContact O-CB 3.19Å; S293-K295 PolarHBondContact O-N 2.86Å; S293-K295 PolarHBondContact OG-N 3.38Å
294	K	88.4	Confident	94.8	Very high	134 Å²	134	56.8 Å²	56.8	58%	0.583	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	8.5	173.1	-64.8	-154.6	163.6	-152.4	0	114.6	Q245 L247 L296	Q245-K294 WeakPolarHBondContact O-CD 3.09Å; Q245-K294 WeakPolarHBondContact O-CE 3.31Å; Q245-K294 VanDerWaalsContact O-CG 3.29Å; Q245-K294 WeakPolarHBondContact O-CG 3.18Å; L247-K294 HydrophobicContact CB-CD 4.49Å; L247-K294 HydrophobicContact CB-CG 3.88Å; L247-K294 HydrophobicContact CD2-CG 4.34Å; K294-L296 VanDerWaalsContact C-N 3.31Å
295	K	91.2	Very high	94.8	Very high	168 Å²	168	61.4 Å²	61.4	73%	0.73	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	6.6	176.8	-60.3	-179.2	179.7	177.5	0	113.2	F279 S293 D297	F279-K295 HydrophobicContact CD1-CB 4.47Å; F279-K295 HydrophobicContact CE1-CB 3.9Å; F279-K295 WeakPolarHBondContact CE1-O 3.41Å; S293-K295 PolarHBondContact O-N 2.86Å; S293-K295 PolarHBondContact OG-N 3.38Å; K295-D297 PolarHBondContact O-N 3.11Å
296	L	93.5	Very high	95	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.283	C	S	.	.			trans	-68.6	122.3	162.1	-68.6	174.8	0	0	0	107.6	V242 Q245 F279 F280 T291 K294 L330	V242-L296 HydrophobicContact CG1-CD1 4.48Å; Q245-L296 PolarHBondContact N-O 2.79Å; F279-L296 HydrophobicContact CB-CD2 3.79Å; F279-L296 HydrophobicContact CB-CG 4.27Å; F279-L296 HydrophobicContact CD1-CD2 3.56Å; F279-L296 HydrophobicContact CD1-CG 3.94Å; F279-L296 HydrophobicContact CE1-CD2 4.34Å; F279-L296 HydrophobicContact CG-CD2 3.83Å; F279-L296 HydrophobicContact CG-CG 4.47Å; F280-L296 HydrophobicContact CE1-CD1 3.71Å; F280-L296 HydrophobicContact CE1-CD2 4.37Å; F280-L296 HydrophobicContact CE2-CD2 4.27Å; F280-L296 HydrophobicContact CZ-CD1 3.94Å; F280-L296 HydrophobicContact CZ-CD2 3.75Å; T291-L296 HydrophobicContact CG2-CD1 3.57Å; K294-L296 VanDerWaalsContact C-N 3.31Å; L296-L330 HydrophobicContact CB-CD1 3.98Å; L296-L330 HydrophobicContact CB-CD2 4.07Å; L296-L330 HydrophobicContact CD1-CD2 4.12Å; L296-L330 HydrophobicContact CD2-CD1 4.34Å; L296-L330 HydrophobicContact CD2-CD2 4.16Å; L296-L330 HydrophobicContact CG-CD2 4.34Å
297	D	93.9	Very high	95.1	Very high	53 Å²	53	55.1 Å²	55.1	28%	0.283	28%	0.276	S	S	.	.			trans	-151.2	117.8	-165.9	158.2	-11.8	0	0	0	105.4	E244 K295 E299 T300 K301	E244-D297 WeakPolarHBondContact OE2-CA 3.12Å; K295-D297 PolarHBondContact O-N 3.11Å; D297-E299 PolarHBondContact OD1-N 2.79Å; D297-T300 VanDerWaalsContact OD1-CB 3.24Å; D297-T300 WeakPolarHBondContact OD1-CB 3.18Å; D297-T300 PolarHBondContact OD1-N 2.95Å; D297-T300 PolarHBondContact OD1-OG1 3.01Å; D297-T300 WeakPolarHBondContact OD2-CB 3.37Å; D297-T300 PolarHBondContact OD2-OG1 2.78Å; D297-K301 CarbonylContact O-C 3.51Å; D297-K301 PolarHBondContact O-N 3.01Å
298	R	95.7	Very high	95.2	Very high	27 Å²	27	55.1 Å²	55.1	10%	0.102	28%	0.276	C	S	.	.	H	α-helix	trans	-79.7	-35.7	-170.3	-170.3	-152.5	65.6	74.3	-3.2	111.5	E244 T300 K301 E302 L330 D332 K366	E244-R298 WeakPolarHBondContact OE1-CB 3.46Å; E244-R298 VanDerWaalsContact OE2-CB 3.29Å; E244-R298 WeakPolarHBondContact OE2-CB 3.41Å; E244-R298 PolarHBondContact OE2-N 2.76Å; R298-T300 VanDerWaalsContact C-N 3.25Å; R298-T300 PolarHBondContact O-N 3.23Å; R298-K301 CarbonylContact O-C 3.58Å; R298-K301 PolarHBondContact O-N 3.38Å; R298-E302 HydrophobicContact CG-CB 3.95Å; R298-E302 HydrophobicContact CG-CG 3.97Å; R298-E302 PolarHBondContact O-N 3.46Å; R298-L330 HydrophobicContact CB-CB 4.23Å; R298-L330 HydrophobicContact CG-CB 4.25Å; R298-D332 WeakPolarHBondContact CD-OD1 3.42Å; R298-D332 IonicContact CZ-OD1 3.74Å; R298-D332 IonicContact NE-OD1 2.81Å; R298-D332 PolarHBondContact NE-OD1 2.85Å; R298-D332 IonicContact NH2-OD1 3.26Å; R298-D332 PolarHBondContact NH2-OD1 2.74Å; R298-K366 PolarHBondContact NH2-O 2.95Å; R298-K366 VanDerWaalsContact NH2-O 3.12Å
299	E	94.9	Very high	95.2	Very high	52 Å²	52	54 Å²	54	24%	0.243	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-35.8	175	-71.5	56.7	-120.6	0	0	111.2	D297 K366	D297-E299 PolarHBondContact OD1-N 2.79Å; E299-K366 HydrophobicContact CG-CB 3.66Å; E299-K366 HydrophobicContact CG-CD 4.18Å
300	T	94.4	Very high	95.2	Very high	112 Å²	112	54 Å²	54	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-80.1	-46.4	172.3	-66.6	0	0	0	0	111.5	D297 R298	D297-T300 VanDerWaalsContact OD1-CB 3.24Å; D297-T300 WeakPolarHBondContact OD1-CB 3.18Å; D297-T300 PolarHBondContact OD1-N 2.95Å; D297-T300 PolarHBondContact OD1-OG1 3.01Å; D297-T300 WeakPolarHBondContact OD2-CB 3.37Å; D297-T300 PolarHBondContact OD2-OG1 2.78Å; R298-T300 VanDerWaalsContact C-N 3.25Å; R298-T300 PolarHBondContact O-N 3.23Å
301	K	94.5	Very high	95.2	Very high	109 Å²	109	55.9 Å²	55.9	47%	0.474	27%	0.272	S	S	.	.	H	α-helix	trans	-159.8	91.4	-178.5	-168.7	177.2	173.2	-178.9	0	114.7	D297 R298 T303 L330	D297-K301 CarbonylContact O-C 3.51Å; D297-K301 PolarHBondContact O-N 3.01Å; R298-K301 CarbonylContact O-C 3.58Å; R298-K301 PolarHBondContact O-N 3.38Å; K301-T303 WeakPolarHBondContact CE-O 3.47Å; K301-T303 PolarHBondContact O-N 3.33Å; K301-L330 WeakPolarHBondContact O-CD1 3.41Å
302	E	95.1	Very high	95.1	Very high	94 Å²	94	55.9 Å²	55.9	44%	0.439	27%	0.272	S	S	.	.	S	Bend	trans	-52.4	-39.9	175.4	-174	-175.6	155.1	0	0	115.6	R298 T329 L330	R298-E302 HydrophobicContact CG-CB 3.95Å; R298-E302 HydrophobicContact CG-CG 3.97Å; R298-E302 PolarHBondContact O-N 3.46Å; E302-T329 HydrophobicContact CG-CG2 4.16Å; E302-L330 PolarHBondContact O-N 2.8Å
303	T	96.4	Very high	95	Very high	55 Å²	55	53.8 Å²	53.8	34%	0.337	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.8	-171.6	-61	0	0	0	0	113.3	K301 T327	K301-T303 WeakPolarHBondContact CE-O 3.47Å; K301-T303 PolarHBondContact O-N 3.33Å; T303-T327 HydrophobicContact CG2-CG2 3.53Å
304	H	96	Very high	95	Very high	13 Å²	13	57.3 Å²	57.3	6%	0.06	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	112.5	175.4	-74.7	-122.9	0	0	0	110.4	F279 F280 I328	F279-H304 AromaticContact CD2-CE1 3.94Å; F280-H304 HydrophobicContact CE2-CB 3.76Å; F280-H304 AromaticContact CE2-CG 3.93Å; F280-H304 AromaticContact CE2-ND1 3.72Å; F280-H304 HydrophobicContact CZ-CB 4.14Å; H304-I328 HydrophobicContact CB-CB 4.44Å; H304-I328 PolarHBondContact N-O 2.9Å; H304-I328 PolarHBondContact O-N 3.18Å
305	M	96.8	Very high	94.9	Very high	128 Å²	128	52.4 Å²	52.4	63%	0.631	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.6	166.6	-63.3	176	74	0	0	109	T325 A326	M305-T325 HydrophobicContact CB-CG2 3.93Å; M305-T325 HydrophobicContact CE-CG2 3.98Å; M305-A326 CarbonylContact C-O 3.52Å; M305-A326 WeakPolarHBondContact CA-O 3.37Å
306	V	96.8	Very high	94.8	Very high	1 Å²	1	46 Å²	46	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.3	179.7	-61.1	0	0	0	0	112.4	L273 D275 F280 T325 A326 I328	L273-V306 HydrophobicContact CD1-CB 4.14Å; L273-V306 HydrophobicContact CD1-CG2 3.97Å; D275-V306 WeakPolarHBondContact OD1-CA 3.39Å; D275-V306 WeakPolarHBondContact OD1-CB 3.24Å; F280-V306 HydrophobicContact CD2-CG1 3.97Å; F280-V306 HydrophobicContact CE2-CG1 4.28Å; V306-T325 CarbonylContact O-C 3.48Å; V306-T325 WeakPolarHBondContact O-CA 3.37Å; V306-A326 HydrophobicContact CG2-CB 4.04Å; V306-A326 PolarHBondContact N-O 3.03Å; V306-A326 PolarHBondContact O-N 3.16Å; V306-I328 HydrophobicContact CG1-CD1 4.49Å; V306-I328 HydrophobicContact CG2-CD1 3.7Å; V306-I328 HydrophobicContact CG2-CG1 4.36Å
307	T	97.9	Very high	94.6	Very high	34 Å²	34	55.3 Å²	55.3	21%	0.209	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.4	-176.7	-46.9	0	0	0	0	111	L274 D275	L274-T307 HydrophobicContact CD1-CG2 4.13Å; L274-T307 PolarHBondContact N-O 2.94Å; D275-T307 VanDerWaalsContact CG-N 3.28Å; D275-T307 PolarHBondContact OD1-N 3.22Å; D275-T307 WeakPolarHBondContact OD2-CB 3.47Å; D275-T307 PolarHBondContact OD2-N 3.41Å; D275-T307 VanDerWaalsContact OD2-N 3.09Å; D275-T307 PolarHBondContact OD2-OG1 2.86Å
308	I	98.1	Very high	94.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	141.7	177.2	-59.5	147.9	0	0	0	108.8	F234 L238 V254 R272 L273 I282 I289 T323 A324 A326	F234-I308 HydrophobicContact CE1-CB 4Å; F234-I308 HydrophobicContact CE1-CG2 3.76Å; F234-I308 HydrophobicContact CZ-CB 4.14Å; F234-I308 HydrophobicContact CZ-CG2 4.04Å; L238-I308 HydrophobicContact CD1-CD1 4.42Å; V254-I308 HydrophobicContact CG2-CD1 3.71Å; R272-I308 CarbonylContact O-C 3.59Å; R272-I308 WeakPolarHBondContact O-CA 3.36Å; L273-I308 HydrophobicContact CD1-CG1 3.66Å; I282-I308 HydrophobicContact CD1-CG2 4.14Å; I289-I308 HydrophobicContact CD1-CD1 4.28Å; I308-T323 VanDerWaalsContact O-CA 3.25Å; I308-T323 WeakPolarHBondContact O-CA 3.48Å; I308-A324 PolarHBondContact N-O 3.14Å; I308-A324 PolarHBondContact O-N 2.79Å; I308-A326 HydrophobicContact CD1-CB 3.59Å
309	E	97.6	Very high	94.1	Very high	15 Å²	15	55.3 Å²	55.3	7%	0.07	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.7	172	178.6	-176.8	-110.4	0	0	108.9	R272 L274 R311 S322 T323	R272-E309 HydrophobicContact CB-CB 4.31Å; R272-E309 WeakPolarHBondContact CD-OE2 3.15Å; R272-E309 IonicContact CZ-OE2 2.64Å; R272-E309 PolarHBondContact N-O 3.1Å; R272-E309 IonicContact NE-OE2 2.79Å; R272-E309 IonicContact NH1-OE2 2.74Å; R272-E309 PolarHBondContact NH1-OE2 2.95Å; R272-E309 VanDerWaalsContact NH1-OE2 3.08Å; R272-E309 PolarHBondContact O-N 3.11Å; L274-E309 HydrophobicContact CD1-CB 4.09Å; L274-E309 HydrophobicContact CD2-CB 3.93Å; L274-E309 HydrophobicContact CG-CB 3.97Å; E309-R311 VanDerWaalsContact CD-NH2 3.27Å; E309-R311 HydrophobicContact CG-CG 4.17Å; E309-R311 IonicContact OE1-CZ 2.73Å; E309-R311 IonicContact OE1-NE 3.26Å; E309-R311 IonicContact OE1-NH2 3.42Å; E309-R311 PolarHBondContact OE1-NH2 3.41Å; E309-R311 IonicContact OE2-CZ 3.02Å; E309-R311 IonicContact OE2-NE 2.69Å; E309-R311 PolarHBondContact OE2-NE 3.48Å; E309-R311 IonicContact OE2-NH2 3.28Å; E309-R311 PolarHBondContact OE2-NH2 2.92Å; E309-S322 WeakPolarHBondContact CA-O 3.45Å; E309-T323 HydrophobicContact CB-CG2 4.11Å; E309-T323 HydrophobicContact CG-CG2 4.25Å
310	L	97.9	Very high	94.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.9	166.3	-55.3	175	0	0	0	108.2	P232 F234 A256 I269 Y271 S321 S322	P232-L310 HydrophobicContact CB-CB 4.15Å; P232-L310 HydrophobicContact CB-CD1 4.34Å; P232-L310 HydrophobicContact CG-CB 3.85Å; F234-L310 HydrophobicContact CD1-CD1 3.86Å; F234-L310 HydrophobicContact CD1-CD2 4.45Å; F234-L310 HydrophobicContact CD1-CG 4.26Å; F234-L310 HydrophobicContact CD2-CD1 3.62Å; F234-L310 HydrophobicContact CD2-CG 4.31Å; F234-L310 HydrophobicContact CE1-CD1 3.88Å; F234-L310 HydrophobicContact CE1-CD2 3.97Å; F234-L310 HydrophobicContact CE1-CG 3.77Å; F234-L310 HydrophobicContact CE2-CD1 3.61Å; F234-L310 HydrophobicContact CE2-CG 3.79Å; F234-L310 HydrophobicContact CG-CD1 3.75Å; F234-L310 HydrophobicContact CZ-CD1 3.77Å; F234-L310 HydrophobicContact CZ-CD2 4.18Å; F234-L310 HydrophobicContact CZ-CG 3.52Å; A256-L310 HydrophobicContact CB-CD1 3.54Å; A256-L310 HydrophobicContact CB-CD2 3.96Å; A256-L310 HydrophobicContact CB-CG 4.38Å; I269-L310 HydrophobicContact CG2-CB 4.16Å; I269-L310 HydrophobicContact CG2-CD2 3.99Å; Y271-L310 HydrophobicContact CD1-CD2 3.38Å; Y271-L310 HydrophobicContact CE1-CD2 3.49Å; Y271-L310 VanDerWaalsContact CE1-CD2 3.49Å; Y271-L310 HydrophobicContact CG-CD2 4.2Å; L310-S321 WeakPolarHBondContact O-CA 3.41Å; L310-S321 VanDerWaalsContact O-CB 3.22Å; L310-S321 WeakPolarHBondContact O-CB 3.4Å; L310-S322 PolarHBondContact N-O 3.1Å; L310-S322 PolarHBondContact O-N 3.42Å
311	R	96.6	Very high	94.2	Very high	71 Å²	71	53.1 Å²	53.1	27%	0.268	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.3	170.4	-64.1	178.9	175.3	-95.2	-12.4	109.9	I269 R270 E309 C319 L320	I269-R311 CarbonylContact C-O 3.58Å; I269-R311 VanDerWaalsContact CA-O 3.28Å; I269-R311 WeakPolarHBondContact CA-O 3.43Å; R270-R311 PolarHBondContact N-O 3.33Å; R270-R311 PolarHBondContact O-N 3.24Å; E309-R311 VanDerWaalsContact CD-NH2 3.27Å; E309-R311 HydrophobicContact CG-CG 4.17Å; E309-R311 IonicContact OE1-CZ 2.73Å; E309-R311 IonicContact OE1-NE 3.26Å; E309-R311 IonicContact OE1-NH2 3.42Å; E309-R311 PolarHBondContact OE1-NH2 3.41Å; E309-R311 IonicContact OE2-CZ 3.02Å; E309-R311 IonicContact OE2-NE 2.69Å; E309-R311 PolarHBondContact OE2-NE 3.48Å; E309-R311 IonicContact OE2-NH2 3.28Å; E309-R311 PolarHBondContact OE2-NH2 2.92Å; R311-C319 HydrophobicContact CB-CB 4.46Å; R311-C319 PolarHBondContact NH1-SG 2.03Å; R311-L320 WeakPolarHBondContact CA-O 3.3Å
312	D	95.6	Very high	94.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-66.2	-171.7	166.6	62.4	28.6	0	0	0	111.1	N228 H266 K314 G315 C319 L320	N228-D312 PolarHBondContact ND2-OD2 2.99Å; H266-D312 VanDerWaalsContact O-CB 3.24Å; H266-D312 WeakPolarHBondContact O-CB 3Å; D312-K314 PolarHBondContact O-N 3.21Å; D312-G315 PolarHBondContact O-N 2.78Å; D312-C319 WeakPolarHBondContact OD1-CA 3.42Å; D312-C319 WeakPolarHBondContact OD1-CB 2.95Å; D312-L320 VanDerWaalsContact CG-N 3.31Å; D312-L320 PolarHBondContact N-O 2.64Å; D312-L320 PolarHBondContact OD1-N 2.77Å; D312-L320 VanDerWaalsContact OD1-N 3.15Å; D312-L320 VanDerWaalsContact OD2-CA 3.3Å; D312-L320 WeakPolarHBondContact OD2-CA 3.15Å; D312-L320 WeakPolarHBondContact OD2-CB 3.43Å; D312-L320 PolarHBondContact OD2-N 2.77Å
313	L	93.2	Very high	94.4	Very high	42 Å²	42	49.1 Å²	49.1	22%	0.22	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	52.2	25.5	169.9	-63.2	176.5	0	0	0	115.1	N228 D265 H266 G315 G316 C319	N228-L313 WeakPolarHBondContact OD1-CD2 3.31Å; N228-L313 WeakPolarHBondContact OD1-CG 3.19Å; D265-L313 WeakPolarHBondContact O-CA 3.48Å; D265-L313 PolarHBondContact O-N 3.09Å; H266-L313 PolarHBondContact O-N 2.88Å; H266-L313 VanDerWaalsContact O-N 3.15Å; L313-G315 PolarHBondContact O-N 3.42Å; L313-G316 WeakPolarHBondContact O-CA 3.07Å; L313-G316 PolarHBondContact O-N 3.07Å; L313-C319 HydrophobicContact CB-CB 4.32Å; L313-C319 HydrophobicContact CD1-CB 4.47Å
314	K	90.2	Very high	94.5	Very high	96 Å²	96	47.8 Å²	47.8	42%	0.417	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	55.5	26.5	-170.7	-54.1	163.5	-173	157.4	0	113	D265 R268 R270 D312	D265-K314 VanDerWaalsContact OD1-CE 3.24Å; D265-K314 WeakPolarHBondContact OD1-CE 3.49Å; D265-K314 IonicContact OD1-NZ 2.69Å; D265-K314 PolarHBondContact OD1-NZ 2.88Å; D265-K314 WeakPolarHBondContact OD2-CE 3.39Å; D265-K314 IonicContact OD2-NZ 2.72Å; D265-K314 PolarHBondContact OD2-NZ 2.83Å; R268-K314 HydrophobicContact CB-CD 4.43Å; R268-K314 HydrophobicContact CB-CG 3.64Å; R268-K314 WeakPolarHBondContact O-CA 3.49Å; R268-K314 PolarHBondContact O-N 3.08Å; R270-K314 WeakPolarHBondContact CD-O 3.44Å; R270-K314 PolarHBondContact NH1-O 3.03Å; D312-K314 PolarHBondContact O-N 3.21Å
315	G	87.1	Confident	94.5	Very high	30 Å²	30	50.5 Å²	50.5	31%	0.309	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	72	31.1	-171.6	0	0	0	0	0	114.1	D312 L313	D312-G315 PolarHBondContact O-N 2.78Å; L313-G315 PolarHBondContact O-N 3.42Å
316	G	89.4	Confident	94.6	Very high	34 Å²	34	44.4 Å²	44.4	35%	0.351	27%	0.267	S	S	.	.			trans	-74.2	-173.5	-178.6	0	0	0	0	0	115	L313 C319	L313-G316 WeakPolarHBondContact O-CA 3.07Å; L313-G316 PolarHBondContact O-N 3.07Å; G316-C319 PolarHBondContact O-SG 3.49Å
317	H	87.9	Confident	94.6	Very high	195 Å²	195	46.6 Å²	46.6	90%	0.903	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	131.7	171.4	176.8	-76.1	0	0	0	110.1
318	G	86.6	Confident	94.6	Very high	53 Å²	53	45 Å²	45	55%	0.546	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	0.7	-176.1	0	0	0	0	0	114.1
319	C	93.5	Very high	94.6	Very high	27 Å²	27	47 Å²	47	18%	0.182	28%	0.283	C	S	.	.			trans	-63.9	135.5	-174.7	57.7	0	0	0	0	114.9	R311 D312 L313 G316	R311-C319 HydrophobicContact CB-CB 4.46Å; R311-C319 PolarHBondContact NH1-SG 2.03Å; D312-C319 WeakPolarHBondContact OD1-CA 3.42Å; D312-C319 WeakPolarHBondContact OD1-CB 2.95Å; L313-C319 HydrophobicContact CB-CB 4.32Å; L313-C319 HydrophobicContact CD1-CB 4.47Å; G316-C319 PolarHBondContact O-SG 3.49Å
320	L	95.8	Very high	94.5	Very high	61 Å²	61	46.6 Å²	46.6	32%	0.319	28%	0.282	S	S	.	.			trans	-82.3	158.5	162.2	-49.3	176.3	0	0	0	109.2	N230 A231 R311 D312	N230-L320 WeakPolarHBondContact O-CD1 3.45Å; A231-L320 HydrophobicContact CB-CB 3.9Å; A231-L320 HydrophobicContact CB-CD1 4.49Å; R311-L320 WeakPolarHBondContact CA-O 3.3Å; D312-L320 VanDerWaalsContact CG-N 3.31Å; D312-L320 PolarHBondContact N-O 2.64Å; D312-L320 PolarHBondContact OD1-N 2.77Å; D312-L320 VanDerWaalsContact OD1-N 3.15Å; D312-L320 VanDerWaalsContact OD2-CA 3.3Å; D312-L320 WeakPolarHBondContact OD2-CA 3.15Å; D312-L320 WeakPolarHBondContact OD2-CB 3.43Å; D312-L320 PolarHBondContact OD2-N 2.77Å
321	S	95.6	Very high	94.4	Very high	58 Å²	58	51.7 Å²	51.7	41%	0.406	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	138.1	-170.5	65.7	0	0	0	0	113.5	L310	L310-S321 WeakPolarHBondContact O-CA 3.41Å; L310-S321 VanDerWaalsContact O-CB 3.22Å; L310-S321 WeakPolarHBondContact O-CB 3.4Å
322	S	96.9	Very high	94.3	Very high	31 Å²	31	49.4 Å²	49.4	22%	0.217	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.1	174.6	-63.1	0	0	0	0	110.7	P232 E309 L310	P232-S322 WeakPolarHBondContact O-CB 3.3Å; P232-S322 PolarHBondContact O-OG 2.95Å; E309-S322 WeakPolarHBondContact CA-O 3.45Å; L310-S322 PolarHBondContact N-O 3.1Å; L310-S322 PolarHBondContact O-N 3.42Å
323	T	97.3	Very high	94.2	Very high	87 Å²	87	50.5 Å²	50.5	53%	0.534	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142	176.6	54.2	0	0	0	0	111.9	L274 I308 E309	L274-T323 HydrophobicContact CD1-CG2 4.12Å; I308-T323 VanDerWaalsContact O-CA 3.25Å; I308-T323 WeakPolarHBondContact O-CA 3.48Å; E309-T323 HydrophobicContact CB-CG2 4.11Å; E309-T323 HydrophobicContact CG-CG2 4.25Å
324	A	96.9	Very high	94.2	Very high	28 Å²	28	48.7 Å²	48.7	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	152.4	175.4	0	0	0	0	0	111	F234 L238 I308	F234-A324 HydrophobicContact CD1-CB 4.27Å; F234-A324 HydrophobicContact CD2-CB 3.62Å; F234-A324 HydrophobicContact CE1-CB 4.09Å; F234-A324 HydrophobicContact CE2-CB 3.42Å; F234-A324 VanDerWaalsContact CE2-CB 3.42Å; F234-A324 HydrophobicContact CG-CB 4.04Å; F234-A324 HydrophobicContact CZ-CB 3.66Å; L238-A324 HydrophobicContact CD1-CB 3.58Å; I308-A324 PolarHBondContact N-O 3.14Å; I308-A324 PolarHBondContact O-N 2.79Å
325	T	97.6	Very high	94.3	Very high	69 Å²	69	45.6 Å²	45.6	42%	0.423	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.5	179.7	-51	0	0	0	0	110.7	M305 V306	M305-T325 HydrophobicContact CB-CG2 3.93Å; M305-T325 HydrophobicContact CE-CG2 3.98Å; V306-T325 CarbonylContact O-C 3.48Å; V306-T325 WeakPolarHBondContact O-CA 3.37Å
326	A	97.3	Very high	94.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	148.2	166.1	0	0	0	0	0	111.4	L238 F240 M305 V306 I308	L238-A326 HydrophobicContact CB-CB 3.83Å; L238-A326 CarbonylContact O-C 3.59Å; L238-A326 VanDerWaalsContact O-CA 3.25Å; L238-A326 WeakPolarHBondContact O-CA 3.15Å; F240-A326 HydrophobicContact CD2-CB 4.09Å; F240-A326 HydrophobicContact CE2-CB 3.92Å; M305-A326 CarbonylContact C-O 3.52Å; M305-A326 WeakPolarHBondContact CA-O 3.37Å; V306-A326 HydrophobicContact CG2-CB 4.04Å; V306-A326 PolarHBondContact N-O 3.03Å; V306-A326 PolarHBondContact O-N 3.16Å; I308-A326 HydrophobicContact CD1-CB 3.59Å
327	T	98	Very high	94.8	Very high	47 Å²	47	44.3 Å²	44.3	29%	0.288	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.5	171.4	-56.5	0	0	0	0	108.5	L238 F240 T303	L238-T327 PolarHBondContact O-N 2.83Å; F240-T327 PolarHBondContact N-O 3Å; T303-T327 HydrophobicContact CG2-CG2 3.53Å
328	I	97.4	Very high	95.1	Very high	0 Å²	0	35 Å²	35	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113.8	176.3	-56.5	168	0	0	0	107.6	F240 V242 V251 F280 I289 H304 V306	F240-I328 HydrophobicContact CB-CG1 4.34Å; F240-I328 HydrophobicContact CD2-CG1 4.4Å; F240-I328 WeakPolarHBondContact O-CA 3.4Å; V242-I328 HydrophobicContact CG1-CG2 4.1Å; V251-I328 HydrophobicContact CG1-CB 4.5Å; V251-I328 HydrophobicContact CG1-CD1 4.09Å; V251-I328 HydrophobicContact CG1-CG1 4.03Å; V251-I328 HydrophobicContact CG1-CG2 3.69Å; F280-I328 HydrophobicContact CD1-CD1 3.92Å; F280-I328 HydrophobicContact CD2-CD1 3.94Å; F280-I328 HydrophobicContact CE1-CD1 3.81Å; F280-I328 HydrophobicContact CE1-CG2 3.95Å; F280-I328 HydrophobicContact CE2-CD1 3.83Å; F280-I328 HydrophobicContact CG-CD1 3.98Å; F280-I328 HydrophobicContact CZ-CB 4.21Å; F280-I328 HydrophobicContact CZ-CD1 3.76Å; F280-I328 HydrophobicContact CZ-CG2 3.82Å; I289-I328 HydrophobicContact CG2-CD1 4.47Å; H304-I328 HydrophobicContact CB-CB 4.44Å; H304-I328 PolarHBondContact N-O 2.9Å; H304-I328 PolarHBondContact O-N 3.18Å; V306-I328 HydrophobicContact CG1-CD1 4.49Å; V306-I328 HydrophobicContact CG2-CD1 3.7Å; V306-I328 HydrophobicContact CG2-CG1 4.36Å
329	T	97.5	Very high	95.4	Very high	43 Å²	43	35.7 Å²	35.7	26%	0.264	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.4	176.5	-54.8	0	0	0	0	110	F240 T241 V242 E302	F240-T329 PolarHBondContact O-N 3.35Å; T241-T329 VanDerWaalsContact CA-O 3.25Å; T241-T329 WeakPolarHBondContact CA-O 3.4Å; V242-T329 PolarHBondContact N-O 2.85Å; E302-T329 HydrophobicContact CG-CG2 4.16Å
330	L	96.6	Very high	95.5	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	139.8	176.8	-61.6	-174.4	0	0	0	110.9	V242 E244 L296 R298 K301 E302	V242-L330 HydrophobicContact CG1-CD2 3.83Å; V242-L330 CarbonylContact O-C 3.57Å; V242-L330 WeakPolarHBondContact O-CA 3.4Å; E244-L330 HydrophobicContact CB-CB 4.4Å; E244-L330 HydrophobicContact CB-CD1 4.18Å; L296-L330 HydrophobicContact CB-CD1 3.98Å; L296-L330 HydrophobicContact CB-CD2 4.07Å; L296-L330 HydrophobicContact CD1-CD2 4.12Å; L296-L330 HydrophobicContact CD2-CD1 4.34Å; L296-L330 HydrophobicContact CD2-CD2 4.16Å; L296-L330 HydrophobicContact CG-CD2 4.34Å; R298-L330 HydrophobicContact CB-CB 4.23Å; R298-L330 HydrophobicContact CG-CB 4.25Å; K301-L330 WeakPolarHBondContact O-CD1 3.41Å; E302-L330 PolarHBondContact O-N 2.8Å
331	K	95.5	Very high	95.5	Very high	107 Å²	107	36.8 Å²	36.8	47%	0.465	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.8	171.6	-80.4	170.7	167.9	161	0	109.7	T241 V242 L243 E244	T241-K331 VanDerWaalsContact OG1-CE 3.31Å; T241-K331 WeakPolarHBondContact OG1-CE 3.42Å; T241-K331 PolarHBondContact OG1-NZ 2.92Å; V242-K331 PolarHBondContact O-N 2.79Å; L243-K331 HydrophobicContact CD2-CB 3.89Å; E244-K331 PolarHBondContact N-O 2.67Å
332	D	94.8	Very high	95.5	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.118	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-53	131.3	178.8	-165.2	78	0	0	0	113	E244 R298 L368 N373	E244-D332 VanDerWaalsContact OE1-CA 3.22Å; E244-D332 WeakPolarHBondContact OE1-CA 3.38Å; R298-D332 WeakPolarHBondContact CD-OD1 3.42Å; R298-D332 IonicContact CZ-OD1 3.74Å; R298-D332 IonicContact NE-OD1 2.81Å; R298-D332 PolarHBondContact NE-OD1 2.85Å; R298-D332 IonicContact NH2-OD1 3.26Å; R298-D332 PolarHBondContact NH2-OD1 2.74Å; D332-L368 HydrophobicContact CB-CB 3.77Å; D332-L368 HydrophobicContact CB-CD2 4.29Å; D332-L368 VanDerWaalsContact CG-N 3.31Å; D332-L368 WeakPolarHBondContact OD1-CB 3.49Å; D332-L368 PolarHBondContact OD1-N 2.98Å; D332-L368 WeakPolarHBondContact OD2-CB 3.5Å; D332-L368 PolarHBondContact OD2-N 2.73Å; D332-N373 WeakPolarHBondContact OD2-CB 3.25Å; D332-N373 PolarHBondContact OD2-ND2 2.72Å
333	I	93.3	Very high	95.4	Very high	24 Å²	24	43 Å²	43	12%	0.123	25%	0.248	C	C	.	.			trans	-118.2	155.8	164.8	69.3	-179.5	0	0	0	109.8	L243 E244 Q245 D335	L243-I333 HydrophobicContact CD2-CG2 3.94Å; E244-I333 HydrophobicContact CG-CB 4.43Å; E244-I333 HydrophobicContact CG-CD1 3.85Å; E244-I333 HydrophobicContact CG-CG1 3.65Å; E244-I333 HydrophobicContact CG-CG2 4.25Å; E244-I333 PolarHBondContact OE1-N 2.81Å; E244-I333 VanDerWaalsContact OE1-N 3.07Å; Q245-I333 HydrophobicContact CB-CD1 4.13Å; Q245-I333 HydrophobicContact CG-CD1 4.18Å; I333-D335 HydrophobicContact CG1-CB 4.32Å; I333-D335 PolarHBondContact O-N 2.79Å; I333-D335 VanDerWaalsContact O-N 3.1Å
334	N	93.9	Very high	95.4	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	24%	0.241	C	C	.	.	S	Bend	trans	-75.8	97.6	173.4	-179.3	-33.3	0	0	0	110.4	D367 N373 N424 L428 V429	N334-D367 VanDerWaalsContact CA-OD2 3.29Å; N334-D367 WeakPolarHBondContact CA-OD2 3.5Å; N334-N373 HydrophobicContact CB-CB 3.97Å; N334-N373 PolarHBondContact N-ND2 2.76Å; N334-N424 WeakPolarHBondContact ND2-CB 3.4Å; N334-N424 PolarHBondContact ND2-OD1 2.85Å; N334-N424 PolarHBondContact OD1-OD1 2.94Å; N334-L428 CarbonylContact O-C 3.56Å; N334-L428 WeakPolarHBondContact O-CA 3.47Å; N334-L428 WeakPolarHBondContact OD1-CD2 3.4Å; N334-V429 PolarHBondContact O-N 2.89Å; N334-V429 VanDerWaalsContact O-O 3.1Å
335	D	92.3	Very high	95.5	Very high	31 Å²	31	40.6 Å²	40.6	17%	0.166	23%	0.232	C	C	.	.			trans	-129.1	-11.1	172.9	106.7	-49.5	0	0	0	115.2	Q245 I333 P337 V429 A431	Q245-D335 PolarHBondContact NE2-OD2 2.93Å; I333-D335 HydrophobicContact CG1-CB 4.32Å; I333-D335 PolarHBondContact O-N 2.79Å; I333-D335 VanDerWaalsContact O-N 3.1Å; D335-P337 VanDerWaalsContact O-CD 3.28Å; D335-P337 WeakPolarHBondContact O-CD 3.4Å; D335-V429 VanDerWaalsContact CB-O 3.3Å; D335-V429 WeakPolarHBondContact CB-O 3.46Å; D335-A431 HydrophobicContact CB-CB 4.3Å; D335-A431 WeakPolarHBondContact O-CB 3.3Å
336	N	92.2	Very high	95.5	Very high	22 Å²	22	43.8 Å²	43.8	12%	0.118	24%	0.24	C	C	.	.	S	Bend	trans	-107.3	91.3	175.6	-56.4	-94.5	0	0	0	112	K366 D367	N336-K366 HydrophobicContact CB-CB 3.88Å; N336-K366 HydrophobicContact CB-CG 4.14Å; N336-K366 WeakPolarHBondContact OD1-CE 3.3Å; N336-K366 PolarHBondContact OD1-NZ 3.11Å; N336-D367 WeakPolarHBondContact CB-OD1 3.05Å; N336-D367 PolarHBondContact N-OD1 3.13Å; N336-D367 VanDerWaalsContact N-OD1 3.08Å; N336-D367 PolarHBondContact ND2-OD1 3.21Å
337	P	92.9	Very high	95.4	Very high	15 Å²	15	45 Å²	45	10%	0.097	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.3	154.5	-178.2	24.6	-32.5	0	0	0	112.8	D335 T339 L428 A433 W435	D335-P337 VanDerWaalsContact O-CD 3.28Å; D335-P337 WeakPolarHBondContact O-CD 3.4Å; P337-T339 WeakPolarHBondContact O-CG2 3.44Å; P337-T339 PolarHBondContact O-N 3.35Å; P337-T339 VanDerWaalsContact O-N 3.11Å; P337-L428 HydrophobicContact CB-CD1 4.15Å; P337-L428 HydrophobicContact CB-CD2 3.88Å; P337-L428 HydrophobicContact CG-CD2 4.05Å; P337-A433 HydrophobicContact CG-CB 3.73Å; P337-W435 HydrophobicContact CB-CE3 4.37Å; P337-W435 HydrophobicContact CB-CZ3 4.32Å
338	P	94.6	Very high	95.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-58.6	116.8	-179	-24.8	33.2	0	0	0	112.5	V363 D365 S376 A422 N424	P338-V363 HydrophobicContact CB-CB 4.18Å; P338-V363 HydrophobicContact CB-CG1 4.41Å; P338-V363 HydrophobicContact CB-CG2 4.37Å; P338-D365 WeakPolarHBondContact CG-OD2 3.19Å; P338-S376 WeakPolarHBondContact CB-OG 3.14Å; P338-S376 WeakPolarHBondContact CG-OG 3.19Å; P338-A422 HydrophobicContact CB-CB 3.86Å; P338-A422 HydrophobicContact CG-CB 4.45Å; P338-N424 WeakPolarHBondContact CD-ND2 3.14Å; P338-N424 WeakPolarHBondContact CD-OD1 3.3Å; P338-N424 VanDerWaalsContact CG-ND2 3.31Å; P338-N424 WeakPolarHBondContact CG-ND2 3.49Å
339	T	93.9	Very high	95.3	Very high	67 Å²	67	47.3 Å²	47.3	41%	0.411	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.2	179.5	61	0	0	0	0	111.3	P337 V363 N364	P337-T339 WeakPolarHBondContact O-CG2 3.44Å; P337-T339 PolarHBondContact O-N 3.35Å; P337-T339 VanDerWaalsContact O-N 3.11Å; T339-V363 CarbonylContact O-C 3.5Å; T339-V363 VanDerWaalsContact O-CA 3.25Å; T339-V363 WeakPolarHBondContact O-CA 3.42Å; T339-N364 PolarHBondContact N-O 3.13Å; T339-N364 PolarHBondContact O-N 3.21Å; T339-N364 PolarHBondContact OG1-O 2.77Å
340	F	96	Very high	95.2	Very high	27 Å²	27	47.2 Å²	47.2	12%	0.118	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	137.4	174.1	-61.6	-80.4	0	0	0	111	Q342 Y345 I361 V363 F378 I420 A422 M436 V438	F340-Q342 PolarHBondContact O-N 2.99Å; F340-Y345 HydrophobicContact CB-CE2 4.24Å; F340-Y345 HydrophobicContact CD1-CE2 4.09Å; F340-I361 HydrophobicContact CD1-CG2 3.65Å; F340-I361 HydrophobicContact CE1-CG2 3.7Å; F340-V363 HydrophobicContact CD1-CG1 3.66Å; F340-V363 HydrophobicContact CE1-CG1 3.89Å; F340-V363 HydrophobicContact CG-CG1 4.33Å; F340-F378 HydrophobicContact CE1-CD1 4.44Å; F340-F378 AromaticContact CE1-CE1 3.96Å; F340-F378 HydrophobicContact CE1-CE1 3.96Å; F340-I420 WeakPolarHBondContact CZ-O 3.4Å; F340-A422 HydrophobicContact CE1-CB 4.02Å; F340-A422 HydrophobicContact CE2-CB 4.11Å; F340-A422 HydrophobicContact CZ-CB 3.53Å; F340-M436 HydrophobicContact CD2-CB 4.13Å; F340-M436 HydrophobicContact CE2-CB 3.98Å; F340-V438 HydrophobicContact CD1-CB 4.14Å; F340-V438 HydrophobicContact CD1-CG1 3.65Å; F340-V438 HydrophobicContact CD2-CB 3.76Å; F340-V438 HydrophobicContact CD2-CG1 4.09Å; F340-V438 HydrophobicContact CE1-CB 4.23Å; F340-V438 HydrophobicContact CE1-CG1 3.46Å; F340-V438 VanDerWaalsContact CE1-CG1 3.46Å; F340-V438 HydrophobicContact CE2-CB 3.87Å; F340-V438 HydrophobicContact CE2-CG1 3.93Å; F340-V438 HydrophobicContact CG-CB 3.89Å; F340-V438 HydrophobicContact CG-CG1 3.95Å; F340-V438 HydrophobicContact CG-CG2 4.45Å; F340-V438 HydrophobicContact CZ-CB 4.09Å; F340-V438 HydrophobicContact CZ-CG1 3.6Å
341	T	95.1	Very high	95.1	Very high	84 Å²	84	47.1 Å²	47.1	52%	0.515	26%	0.261	S	S	.	.	S	Bend	trans	-69.1	-14.9	178.7	69.7	0	0	0	0	114.5	Y345 P362	T341-Y345 PolarHBondContact N-OH 2.84Å; T341-Y345 PolarHBondContact OG1-OH 2.84Å; T341-Y345 VanDerWaalsContact OG1-OH 3.09Å; T341-P362 HydrophobicContact CG2-CB 4.01Å; T341-P362 HydrophobicContact CG2-CG 4.09Å; T341-P362 PolarHBondContact N-O 2.98Å; T341-P362 WeakPolarHBondContact OG1-CG 3.47Å
342	Q	95.6	Very high	94.9	Very high	108 Å²	108	46 Å²	46	51%	0.505	26%	0.26	S	S	.	.	S	Bend	trans	-135	147.1	-179.6	-58.2	-176.9	2.5	0	0	109.8	F340 S344 Y345	F340-Q342 PolarHBondContact O-N 2.99Å; Q342-S344 VanDerWaalsContact C-N 3.26Å; Q342-S344 PolarHBondContact O-N 3.11Å; Q342-Y345 HydrophobicContact CB-CD1 4.26Å; Q342-Y345 HydrophobicContact CB-CE1 3.76Å; Q342-Y345 HydrophobicContact CB-CE2 4.28Å; Q342-Y345 HydrophobicContact CG-CD1 4.44Å; Q342-Y345 HydrophobicContact CG-CE1 3.8Å; Q342-Y345 PolarHBondContact N-OH 3.44Å
343	S	95.6	Very high	94.8	Very high	112 Å²	112	47.6 Å²	47.6	78%	0.783	27%	0.267	S	S	*	.	S	Bend	trans	-75.5	-12	178.8	55.4	0	0	0	0	114.3	P439	S343-P439 WeakPolarHBondContact O-CD 3.44Å
344	S	97.1	Very high	94.7	Very high	54 Å²	54	49.9 Å²	49.9	38%	0.378	29%	0.285	S	S	.	.	S	Bend	trans	-162.5	148.6	173.2	62.8	0	0	0	0	108.6	Q342 P439	Q342-S344 VanDerWaalsContact C-N 3.26Å; Q342-S344 PolarHBondContact O-N 3.11Å; S344-P439 WeakPolarHBondContact CA-O 3.41Å
345	Y	97.8	Very high	94.7	Very high	10 Å²	10	54.5 Å²	54.5	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	155.4	173	-63.5	-86.8	0	0	0	111.1	F340 T341 Q342 L359 I361 P362 V438 P439 V440 E441	F340-Y345 HydrophobicContact CB-CE2 4.24Å; F340-Y345 HydrophobicContact CD1-CE2 4.09Å; T341-Y345 PolarHBondContact N-OH 2.84Å; T341-Y345 PolarHBondContact OG1-OH 2.84Å; T341-Y345 VanDerWaalsContact OG1-OH 3.09Å; Q342-Y345 HydrophobicContact CB-CD1 4.26Å; Q342-Y345 HydrophobicContact CB-CE1 3.76Å; Q342-Y345 HydrophobicContact CB-CE2 4.28Å; Q342-Y345 HydrophobicContact CG-CD1 4.44Å; Q342-Y345 HydrophobicContact CG-CE1 3.8Å; Q342-Y345 PolarHBondContact N-OH 3.44Å; Y345-L359 HydrophobicContact CG-CD2 4.32Å; Y345-I361 HydrophobicContact CD2-CG2 4.14Å; Y345-I361 HydrophobicContact CE2-CG2 3.67Å; Y345-P362 PolarHBondContact OH-O 2.77Å; Y345-V438 HydrophobicContact CD2-CG1 4.03Å; Y345-V438 HydrophobicContact CD2-CG2 3.8Å; Y345-V438 HydrophobicContact CE2-CG1 4.14Å; Y345-V438 HydrophobicContact CE2-CG2 3.96Å; Y345-P439 PolarHBondContact N-O 2.85Å; Y345-P439 VanDerWaalsContact N-O 3.08Å; Y345-V440 HydrophobicContact CD2-CG2 4.41Å; Y345-V440 WeakPolarHBondContact O-CA 3.18Å; Y345-E441 PolarHBondContact O-N 3.15Å
346	K	97.4	Very high	94.8	Very high	136 Å²	136	57.2 Å²	57.2	59%	0.591	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	143	173.8	-53	-152.3	178	-152.6	0	110.7	E441	K346-E441 CarbonylContact C-O 3.52Å; K346-E441 WeakPolarHBondContact CA-O 3.46Å; K346-E441 HydrophobicContact CD-CB 4.32Å; K346-E441 HydrophobicContact CD-CG 4.32Å; K346-E441 WeakPolarHBondContact CE-OE2 3.41Å; K346-E441 HydrophobicContact CG-CB 4.12Å; K346-E441 VanDerWaalsContact NZ-CD 3.31Å; K346-E441 IonicContact NZ-OE1 2.95Å; K346-E441 PolarHBondContact NZ-OE1 2.7Å; K346-E441 IonicContact NZ-OE2 3.03Å; K346-E441 PolarHBondContact NZ-OE2 2.64Å
347	T	97.2	Very high	95	Very high	27 Å²	27	59.4 Å²	59.4	17%	0.166	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	165.9	168.6	-168.4	0	0	0	0	111	I358 L359 E441 V442 A443	T347-I358 WeakPolarHBondContact CB-O 3.45Å; T347-I358 HydrophobicContact CG2-CB 4.3Å; T347-I358 HydrophobicContact CG2-CD1 3.93Å; T347-I358 HydrophobicContact CG2-CG1 4.27Å; T347-I358 PolarHBondContact OG1-O 3.12Å; T347-L359 HydrophobicContact CG2-CB 4.22Å; T347-E441 PolarHBondContact N-O 2.71Å; T347-V442 HydrophobicContact CG2-CG1 4.35Å; T347-V442 HydrophobicContact CG2-CG2 4.04Å; T347-V442 WeakPolarHBondContact O-CA 3.18Å; T347-A443 PolarHBondContact O-N 3.21Å
348	T	96.3	Very high	95.2	Very high	92 Å²	92	59.7 Å²	59.7	56%	0.564	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.7	177.5	48.9	0	0	0	0	108.9	A443 T445	T348-A443 CarbonylContact C-O 3.52Å; T348-A443 VanDerWaalsContact CA-O 3.32Å; T348-A443 WeakPolarHBondContact CA-O 3.5Å; T348-A443 HydrophobicContact CG2-CB 4.33Å; T348-T445 HydrophobicContact CG2-CG2 4.4Å
349	V	96.1	Very high	95.3	Very high	2 Å²	2	61 Å²	61	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.4	169	71.6	0	0	0	0	110.4	E353 I358 V404 L408 V442 A443 V444 T445	V349-E353 HydrophobicContact CG2-CB 4.08Å; V349-E353 HydrophobicContact CG2-CG 4.36Å; V349-I358 HydrophobicContact CB-CG2 3.96Å; V349-I358 HydrophobicContact CG2-CG2 3.58Å; V349-V404 HydrophobicContact CG1-CG2 4.32Å; V349-V404 HydrophobicContact CG2-CG2 3.99Å; V349-L408 HydrophobicContact CG1-CD1 3.82Å; V349-V442 HydrophobicContact CG1-CG1 3.86Å; V349-A443 PolarHBondContact N-O 2.97Å; V349-V444 CarbonylContact O-C 3.51Å; V349-V444 WeakPolarHBondContact O-CA 3.45Å; V349-T445 PolarHBondContact O-N 3.44Å; V349-T445 PolarHBondContact O-OG1 3.17Å
350	P	95.1	Very high	95.5	Very high	41 Å²	41	62.5 Å²	62.5	27%	0.266	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	148.9	164.4	-18.6	30.2	0	0	0	110.6	E353 T445 V447	P350-E353 HydrophobicContact CB-CG 3.83Å; P350-E353 HydrophobicContact CG-CG 4.16Å; P350-E353 WeakPolarHBondContact O-CG 3.44Å; P350-T445 WeakPolarHBondContact CA-OG1 3.22Å; P350-V447 HydrophobicContact CB-CG2 3.79Å
351	E	94.1	Very high	95.6	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.023	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	170.3	168.9	70	-166.5	114.6	0	0	112.5	E353 L408 N409 Y410 V444 T445 D446 V447	E351-E353 PolarHBondContact O-N 3.48Å; E351-L408 WeakPolarHBondContact CB-O 3.2Å; E351-N409 WeakPolarHBondContact OE2-CA 3.39Å; E351-N409 PolarHBondContact OE2-ND2 2.87Å; E351-Y410 VanDerWaalsContact CD-CB 3.45Å; E351-Y410 WeakPolarHBondContact OE1-CB 3.49Å; E351-Y410 VanDerWaalsContact OE2-CB 3.27Å; E351-Y410 WeakPolarHBondContact OE2-CB 3.27Å; E351-Y410 PolarHBondContact OE2-N 3.34Å; E351-V444 HydrophobicContact CB-CG1 3.9Å; E351-T445 PolarHBondContact N-O 3.12Å; E351-D446 VanDerWaalsContact OE1-CA 3.28Å; E351-D446 WeakPolarHBondContact OE1-CA 2.87Å; E351-V447 HydrophobicContact CG-CB 4.06Å; E351-V447 HydrophobicContact CG-CG2 4.22Å; E351-V447 PolarHBondContact OE1-N 2.88Å
352	N	91.7	Very high	95.6	Very high	84 Å²	84	59 Å²	59	45%	0.449	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	-4.9	-175.9	-70.2	-50.9	0	0	0	117.1	L408 E449	N352-L408 PolarHBondContact N-O 2.82Å; N352-E449 VanDerWaalsContact ND2-CD 3.28Å; N352-E449 PolarHBondContact ND2-OE1 3.27Å
353	E	92.2	Very high	95.6	Very high	56 Å²	56	54.9 Å²	54.9	26%	0.262	30%	0.3	S	S	.	.			trans	-66.3	143	174.5	-72.4	-83.5	-157.3	0	0	113.2	V349 P350 E351 K356 V404 P407	V349-E353 HydrophobicContact CG2-CB 4.08Å; V349-E353 HydrophobicContact CG2-CG 4.36Å; P350-E353 HydrophobicContact CB-CG 3.83Å; P350-E353 HydrophobicContact CG-CG 4.16Å; P350-E353 WeakPolarHBondContact O-CG 3.44Å; E351-E353 PolarHBondContact O-N 3.48Å; E353-K356 HydrophobicContact CB-CD 4.49Å; E353-K356 VanDerWaalsContact CD-CD 3.46Å; E353-K356 HydrophobicContact CG-CD 4.28Å; E353-K356 IonicContact OE1-NZ 2.56Å; E353-K356 PolarHBondContact OE1-NZ 3.26Å; E353-K356 WeakPolarHBondContact OE2-CD 3.39Å; E353-K356 IonicContact OE2-NZ 3.68Å; E353-V404 WeakPolarHBondContact O-CG1 3.41Å; E353-P407 WeakPolarHBondContact O-CA 3.37Å
354	S	92.7	Very high	95.5	Very high	72 Å²	72	54 Å²	54	50%	0.503	29%	0.286	S	S	.	.			trans	-144.7	150.7	179.4	54.6	0	0	0	0	113	K356	S354-K356 PolarHBondContact O-N 2.92Å
355	D	92.9	Very high	95.4	Very high	100 Å²	100	51.8 Å²	51.8	54%	0.535	27%	0.271	S	S	.	.	S	Bend	trans	50.2	13	-173.1	-88.1	-54.5	0	0	0	117.4	R390 Y403 V404	D355-R390 IonicContact OD1-CZ 2.64Å; D355-R390 VanDerWaalsContact OD1-CZ 3.28Å; D355-R390 IonicContact OD1-NE 3.57Å; D355-R390 PolarHBondContact OD1-NE 2.86Å; D355-R390 IonicContact OD1-NH2 2.66Å; D355-R390 PolarHBondContact OD1-NH2 3.2Å; D355-Y403 WeakPolarHBondContact O-CD1 3.44Å; D355-V404 WeakPolarHBondContact CA-O 3.38Å; D355-V404 PolarHBondContact N-O 2.69Å
356	K	94.1	Very high	95.2	Very high	87 Å²	87	57.1 Å²	57.1	38%	0.378	29%	0.294	S	S	.	.			trans	-83	133.9	-177.4	-172.3	166.2	178.7	171.8	0	112.4	E353 S354 Y403 V404	E353-K356 HydrophobicContact CB-CD 4.49Å; E353-K356 VanDerWaalsContact CD-CD 3.46Å; E353-K356 HydrophobicContact CG-CD 4.28Å; E353-K356 IonicContact OE1-NZ 2.56Å; E353-K356 PolarHBondContact OE1-NZ 3.26Å; E353-K356 WeakPolarHBondContact OE2-CD 3.39Å; E353-K356 IonicContact OE2-NZ 3.68Å; S354-K356 PolarHBondContact O-N 2.92Å; K356-Y403 CarbonylContact O-C 3.59Å; K356-Y403 WeakPolarHBondContact O-CA 3.48Å; K356-V404 PolarHBondContact O-N 3.15Å
357	L	96.6	Very high	95.1	Very high	68 Å²	68	50.7 Å²	50.7	36%	0.356	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	124.9	169.2	-177.9	73.2	0	0	0	109.1	R360 L401 L402 Y403	L357-R360 HydrophobicContact CD2-CG 4.38Å; L357-L401 HydrophobicContact CD1-CB 3.82Å; L357-L401 HydrophobicContact CD1-CD2 4.28Å; L357-L402 WeakPolarHBondContact CD1-O 3.31Å; L357-Y403 HydrophobicContact CB-CD1 3.89Å; L357-Y403 HydrophobicContact CB-CE1 3.75Å; L357-Y403 HydrophobicContact CD1-CD1 4.26Å; L357-Y403 HydrophobicContact CD1-CD2 4.11Å; L357-Y403 HydrophobicContact CD1-CE1 4Å; L357-Y403 HydrophobicContact CD1-CE2 3.86Å; L357-Y403 HydrophobicContact CD1-CG 4.29Å; L357-Y403 HydrophobicContact CG-CE1 4.46Å
358	I	96.9	Very high	95	Very high	21 Å²	21	53 Å²	53	11%	0.108	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-17.9	-177.2	58.9	164.4	0	0	0	114.1	T347 V349 F389 L402 V404 V442	T347-I358 WeakPolarHBondContact CB-O 3.45Å; T347-I358 HydrophobicContact CG2-CB 4.3Å; T347-I358 HydrophobicContact CG2-CD1 3.93Å; T347-I358 HydrophobicContact CG2-CG1 4.27Å; T347-I358 PolarHBondContact OG1-O 3.12Å; V349-I358 HydrophobicContact CB-CG2 3.96Å; V349-I358 HydrophobicContact CG2-CG2 3.58Å; I358-F389 HydrophobicContact CD1-CD1 4.02Å; I358-F389 HydrophobicContact CD1-CE1 3.77Å; I358-L402 HydrophobicContact CD1-CD2 4.04Å; I358-L402 HydrophobicContact CD1-CG 4.16Å; I358-L402 HydrophobicContact CG1-CD2 4.23Å; I358-L402 HydrophobicContact CG1-CG 4.05Å; I358-L402 VanDerWaalsContact CG1-O 3.31Å; I358-L402 WeakPolarHBondContact CG1-O 3.39Å; I358-L402 PolarHBondContact N-O 2.87Å; I358-V404 HydrophobicContact CD1-CG2 3.98Å; I358-V404 HydrophobicContact CG1-CG2 4.5Å; I358-V404 HydrophobicContact CG2-CG2 3.94Å; I358-V442 HydrophobicContact CD1-CG1 4.14Å; I358-V442 HydrophobicContact CD1-CG2 4.16Å
359	L	97.5	Very high	94.9	Very high	27 Å²	27	55.5 Å²	55.5	14%	0.141	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	139.9	177.7	-177.4	64.3	0	0	0	111.2	Y345 T347 I361 L402 V440	Y345-L359 HydrophobicContact CG-CD2 4.32Å; T347-L359 HydrophobicContact CG2-CB 4.22Å; L359-I361 HydrophobicContact CD2-CD1 4Å; L359-I361 HydrophobicContact CD2-CG1 3.64Å; L359-I361 HydrophobicContact CG-CG1 3.81Å; L359-L402 HydrophobicContact CB-CB 4.2Å; L359-L402 HydrophobicContact CB-CD2 4.32Å; L359-L402 HydrophobicContact CD2-CD2 4.44Å; L359-L402 PolarHBondContact N-O 3.39Å; L359-L402 PolarHBondContact O-N 3.2Å; L359-V440 HydrophobicContact CD2-CG1 3.65Å
360	R	97.6	Very high	94.7	Very high	100 Å²	100	61.3 Å²	61.3	38%	0.377	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.4	159.2	-70.8	-169.4	164.5	-109.1	-10.6	108.6	L357 P362 D394 E399 G400 L401	L357-R360 HydrophobicContact CD2-CG 4.38Å; R360-P362 WeakPolarHBondContact O-CD 3.47Å; R360-D394 IonicContact CZ-OD2 2.71Å; R360-D394 VanDerWaalsContact CZ-OD2 3.26Å; R360-D394 IonicContact NH1-OD2 2.68Å; R360-D394 PolarHBondContact NH1-OD2 2.69Å; R360-D394 IonicContact NH2-OD2 3.48Å; R360-D394 PolarHBondContact NH2-OD2 2.68Å; R360-E399 IonicContact CZ-OE2 3.71Å; R360-E399 IonicContact NH1-OE2 2.74Å; R360-E399 PolarHBondContact NH1-OE2 3.48Å; R360-G400 CarbonylContact C-O 3.54Å; R360-G400 WeakPolarHBondContact CA-O 3.45Å; R360-L401 HydrophobicContact CG-CD2 3.79Å
361	I	97.5	Very high	94.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	94.9	-176.9	-59.6	178	0	0	0	107.7	F340 Y345 L359 F378 I391 G400 L402 I420 V440	F340-I361 HydrophobicContact CD1-CG2 3.65Å; F340-I361 HydrophobicContact CE1-CG2 3.7Å; Y345-I361 HydrophobicContact CD2-CG2 4.14Å; Y345-I361 HydrophobicContact CE2-CG2 3.67Å; L359-I361 HydrophobicContact CD2-CD1 4Å; L359-I361 HydrophobicContact CD2-CG1 3.64Å; L359-I361 HydrophobicContact CG-CG1 3.81Å; I361-F378 HydrophobicContact CG2-CE1 4.38Å; I361-I391 HydrophobicContact CD1-CD1 4.03Å; I361-G400 WeakPolarHBondContact CB-O 3.19Å; I361-G400 PolarHBondContact N-O 3.13Å; I361-G400 PolarHBondContact O-N 3.07Å; I361-L402 HydrophobicContact CD1-CB 4.48Å; I361-I420 HydrophobicContact CD1-CD1 3.69Å; I361-V440 HydrophobicContact CD1-CG2 4.18Å
362	P	96.3	Very high	94.6	Very high	37 Å²	37	63.4 Å²	63.4	24%	0.24	32%	0.324	C	S	.	.			trans	-71.3	137.9	177.8	28	-34.5	0	0	0	111.9	T341 Y345 R360 E399	T341-P362 HydrophobicContact CG2-CB 4.01Å; T341-P362 HydrophobicContact CG2-CG 4.09Å; T341-P362 PolarHBondContact N-O 2.98Å; T341-P362 WeakPolarHBondContact OG1-CG 3.47Å; Y345-P362 PolarHBondContact OH-O 2.77Å; R360-P362 WeakPolarHBondContact O-CD 3.47Å; P362-E399 HydrophobicContact CB-CG 4.42Å
363	V	95.3	Very high	94.7	Very high	21 Å²	21	60.6 Å²	60.6	13%	0.127	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.4	171	-66.7	0	0	0	0	109.2	P338 T339 F340 F378 N398 A422	P338-V363 HydrophobicContact CB-CB 4.18Å; P338-V363 HydrophobicContact CB-CG1 4.41Å; P338-V363 HydrophobicContact CB-CG2 4.37Å; T339-V363 CarbonylContact O-C 3.5Å; T339-V363 VanDerWaalsContact O-CA 3.25Å; T339-V363 WeakPolarHBondContact O-CA 3.42Å; F340-V363 HydrophobicContact CD1-CG1 3.66Å; F340-V363 HydrophobicContact CE1-CG1 3.89Å; F340-V363 HydrophobicContact CG-CG1 4.33Å; V363-F378 HydrophobicContact CB-CZ 4.43Å; V363-F378 HydrophobicContact CG1-CE1 3.7Å; V363-F378 HydrophobicContact CG1-CZ 3.7Å; V363-F378 HydrophobicContact CG2-CZ 3.82Å; V363-N398 WeakPolarHBondContact CG2-O 3.07Å; V363-A422 HydrophobicContact CG1-CB 4.21Å
364	N	93.9	Very high	94.8	Very high	93 Å²	93	59.4 Å²	59.4	50%	0.497	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.2	168.1	-177.3	93.6	0	0	0	108.8	T339	T339-N364 PolarHBondContact N-O 3.13Å; T339-N364 PolarHBondContact O-N 3.21Å; T339-N364 PolarHBondContact OG1-O 2.77Å
365	D	94.1	Very high	94.9	Very high	9 Å²	9	58.1 Å²	58.1	5%	0.048	29%	0.289	C	S	.	.			trans	-121.4	141.5	174.2	-173.3	-51.5	0	0	0	106.5	P338 D367 W374 N424	P338-D365 WeakPolarHBondContact CG-OD2 3.19Å; D365-D367 WeakPolarHBondContact OD1-CB 3.41Å; D365-D367 PolarHBondContact OD1-N 3.18Å; D365-W374 HydrophobicContact CB-CG 4.43Å; D365-W374 PolarHBondContact O-NE1 2.66Å; D365-N424 PolarHBondContact OD2-ND2 3.4Å
366	K	93.8	Very high	95	Very high	122 Å²	122	53.4 Å²	53.4	53%	0.53	27%	0.265	S	S	.	.			trans	-100.5	-17.8	-173.7	-53	-166.5	-147.4	130.1	0	113.8	R298 E299 N336	R298-K366 PolarHBondContact NH2-O 2.95Å; R298-K366 VanDerWaalsContact NH2-O 3.12Å; E299-K366 HydrophobicContact CG-CB 3.66Å; E299-K366 HydrophobicContact CG-CD 4.18Å; N336-K366 HydrophobicContact CB-CB 3.88Å; N336-K366 HydrophobicContact CB-CG 4.14Å; N336-K366 WeakPolarHBondContact OD1-CE 3.3Å; N336-K366 PolarHBondContact OD1-NZ 3.11Å
367	D	94.9	Very high	95	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.272	C	S	.	.	S	Bend	trans	-62	166.6	-177.2	-59.6	-7.9	0	0	0	109.7	N334 N336 D365 K369 N373 W374	N334-D367 VanDerWaalsContact CA-OD2 3.29Å; N334-D367 WeakPolarHBondContact CA-OD2 3.5Å; N336-D367 WeakPolarHBondContact CB-OD1 3.05Å; N336-D367 PolarHBondContact N-OD1 3.13Å; N336-D367 VanDerWaalsContact N-OD1 3.08Å; N336-D367 PolarHBondContact ND2-OD1 3.21Å; D365-D367 WeakPolarHBondContact OD1-CB 3.41Å; D365-D367 PolarHBondContact OD1-N 3.18Å; D367-K369 PolarHBondContact O-N 3.2Å; D367-K369 VanDerWaalsContact O-N 3.12Å; D367-N373 HydrophobicContact CB-CB 3.89Å; D367-W374 HydrophobicContact CB-CB 4.41Å; D367-W374 VanDerWaalsContact O-CD1 3.28Å
368	L	94.8	Very high	95	Very high	75 Å²	75	52.5 Å²	52.5	39%	0.393	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-59.3	121.2	-171.8	-179.1	62.3	0	0	0	111	D332 T371 W374	D332-L368 HydrophobicContact CB-CB 3.77Å; D332-L368 HydrophobicContact CB-CD2 4.29Å; D332-L368 VanDerWaalsContact CG-N 3.31Å; D332-L368 WeakPolarHBondContact OD1-CB 3.49Å; D332-L368 PolarHBondContact OD1-N 2.98Å; D332-L368 WeakPolarHBondContact OD2-CB 3.5Å; D332-L368 PolarHBondContact OD2-N 2.73Å; L368-T371 HydrophobicContact CB-CG2 3.96Å; L368-T371 HydrophobicContact CD2-CG2 4.01Å; L368-T371 HydrophobicContact CG-CG2 3.88Å; L368-T371 VanDerWaalsContact O-CB 3.3Å; L368-T371 WeakPolarHBondContact O-CB 3.2Å; L368-T371 WeakPolarHBondContact O-CG2 3.46Å; L368-T371 PolarHBondContact O-N 2.9Å; L368-T371 PolarHBondContact O-OG1 3.41Å; L368-W374 WeakPolarHBondContact O-CB 3.29Å
369	K	94	Very high	94.9	Very high	144 Å²	144	54.1 Å²	54.1	63%	0.626	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	150.5	-173.9	-65.3	-173.1	177.7	-178.2	0	113.2	D367 T371 W374	D367-K369 PolarHBondContact O-N 3.2Å; D367-K369 VanDerWaalsContact O-N 3.12Å; K369-T371 PolarHBondContact O-N 3.19Å; K369-T371 VanDerWaalsContact O-N 3.15Å; K369-W374 HydrophobicContact CB-CD2 4.28Å; K369-W374 HydrophobicContact CB-CE3 4.46Å; K369-W374 HydrophobicContact CD-CZ2 4.47Å; K369-W374 HydrophobicContact CG-CD2 4.21Å; K369-W374 HydrophobicContact CG-CG 4.44Å; K369-W374 HydrophobicContact CG-CZ2 4.27Å
370	D	92	Very high	94.9	Very high	125 Å²	125	54.3 Å²	54.3	67%	0.668	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	12.6	-178.4	-53.2	-44.1	0	0	0	115.1	W374	D370-W374 VanDerWaalsContact N-CE3 3.26Å
371	T	94	Very high	94.9	Very high	30 Å²	30	52.6 Å²	52.6	18%	0.184	27%	0.27	C	S	.	.	S	Bend	trans	-95.2	163.5	172.8	71.3	0	0	0	0	113	L368 K369 N373 W374 I375	L368-T371 HydrophobicContact CB-CG2 3.96Å; L368-T371 HydrophobicContact CD2-CG2 4.01Å; L368-T371 HydrophobicContact CG-CG2 3.88Å; L368-T371 VanDerWaalsContact O-CB 3.3Å; L368-T371 WeakPolarHBondContact O-CB 3.2Å; L368-T371 WeakPolarHBondContact O-CG2 3.46Å; L368-T371 PolarHBondContact O-N 2.9Å; L368-T371 PolarHBondContact O-OG1 3.41Å; K369-T371 PolarHBondContact O-N 3.19Å; K369-T371 VanDerWaalsContact O-N 3.15Å; T371-N373 PolarHBondContact O-N 3.36Å; T371-N373 WeakPolarHBondContact OG1-CB 3.15Å; T371-N373 PolarHBondContact OG1-N 2.72Å; T371-W374 PolarHBondContact O-N 3.24Å; T371-W374 PolarHBondContact OG1-N 2.63Å; T371-I375 WeakPolarHBondContact O-CB 3.41Å; T371-I375 WeakPolarHBondContact O-CD1 3.37Å; T371-I375 WeakPolarHBondContact O-CG1 3.12Å; T371-I375 PolarHBondContact O-N 3.12Å
372	P	94.1	Very high	94.8	Very high	59 Å²	59	58.4 Å²	58.4	38%	0.383	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.2	170.2	-25.4	36.8	0	0	0	115.1	Q425 E426	P372-Q425 HydrophobicContact CB-CB 4.1Å; P372-Q425 PolarHBondContact O-N 3.25Å; P372-E426 HydrophobicContact CB-CG 3.84Å; P372-E426 PolarHBondContact O-N 3.29Å; P372-E426 VanDerWaalsContact O-N 3.13Å
373	N	93.5	Very high	94.7	Very high	25 Å²	25	58.7 Å²	58.7	13%	0.134	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-60	170.6	-59	-13.2	0	0	0	107.9	D332 N334 D367 T371 I375 N424	D332-N373 WeakPolarHBondContact OD2-CB 3.25Å; D332-N373 PolarHBondContact OD2-ND2 2.72Å; N334-N373 HydrophobicContact CB-CB 3.97Å; N334-N373 PolarHBondContact N-ND2 2.76Å; D367-N373 HydrophobicContact CB-CB 3.89Å; T371-N373 PolarHBondContact O-N 3.36Å; T371-N373 WeakPolarHBondContact OG1-CB 3.15Å; T371-N373 PolarHBondContact OG1-N 2.72Å; N373-I375 PolarHBondContact O-N 3.13Å; N373-N424 WeakPolarHBondContact O-CB 3.49Å; N373-N424 PolarHBondContact O-ND2 3.28Å
374	W	94.6	Very high	94.7	Very high	32 Å²	32	59.6 Å²	59.6	12%	0.121	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.6	-178.1	-176	79.8	0	0	0	116	D365 D367 L368 K369 D370 T371 S376 N398	D365-W374 HydrophobicContact CB-CG 4.43Å; D365-W374 PolarHBondContact O-NE1 2.66Å; D367-W374 HydrophobicContact CB-CB 4.41Å; D367-W374 VanDerWaalsContact O-CD1 3.28Å; L368-W374 WeakPolarHBondContact O-CB 3.29Å; K369-W374 HydrophobicContact CB-CD2 4.28Å; K369-W374 HydrophobicContact CB-CE3 4.46Å; K369-W374 HydrophobicContact CD-CZ2 4.47Å; K369-W374 HydrophobicContact CG-CD2 4.21Å; K369-W374 HydrophobicContact CG-CG 4.44Å; K369-W374 HydrophobicContact CG-CZ2 4.27Å; D370-W374 VanDerWaalsContact N-CE3 3.26Å; T371-W374 PolarHBondContact O-N 3.24Å; T371-W374 PolarHBondContact OG1-N 2.63Å; W374-S376 PolarHBondContact O-N 2.72Å; W374-N398 HydrophobicContact CH2-CB 3.67Å; W374-N398 HydrophobicContact CZ2-CB 3.92Å; W374-N398 HydrophobicContact CZ3-CB 4.05Å; W374-N398 PolarHBondContact O-ND2 2.81Å
375	I	94.9	Very high	94.6	Very high	44 Å²	44	59.1 Å²	59.1	23%	0.226	33%	0.326	C	S	.	.			trans	-70.8	118.1	-172.1	-64.7	160.4	0	0	0	111.5	T371 N373 N424 Q425	T371-I375 WeakPolarHBondContact O-CB 3.41Å; T371-I375 WeakPolarHBondContact O-CD1 3.37Å; T371-I375 WeakPolarHBondContact O-CG1 3.12Å; T371-I375 PolarHBondContact O-N 3.12Å; N373-I375 PolarHBondContact O-N 3.13Å; I375-N424 CarbonylContact O-C 3.45Å; I375-N424 WeakPolarHBondContact O-CA 3.19Å; I375-Q425 HydrophobicContact CB-CG 4.19Å; I375-Q425 HydrophobicContact CG2-CG 4.09Å; I375-Q425 PolarHBondContact O-N 3.24Å; I375-Q425 VanDerWaalsContact O-N 3.13Å
376	S	94.9	Very high	94.5	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.014	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	149.5	178.9	-72.6	0	0	0	0	113.3	P338 W374 T393 N398 Q423	P338-S376 WeakPolarHBondContact CB-OG 3.14Å; P338-S376 WeakPolarHBondContact CG-OG 3.19Å; W374-S376 PolarHBondContact O-N 2.72Å; S376-T393 WeakPolarHBondContact O-CB 3.25Å; S376-T393 VanDerWaalsContact O-CG2 3.3Å; S376-T393 WeakPolarHBondContact O-CG2 3.31Å; S376-T393 PolarHBondContact O-OG1 3.41Å; S376-N398 WeakPolarHBondContact CB-OD1 3.26Å; S376-N398 PolarHBondContact N-OD1 3.27Å; S376-Q423 CarbonylContact C-O 3.59Å; S376-Q423 WeakPolarHBondContact CA-O 3.29Å
377	K	94.8	Very high	94.5	Very high	120 Å²	120	60 Å²	60	52%	0.522	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	106.4	178.5	177.1	-174	175.7	-173.9	0	107.6	Q423	K377-Q423 WeakPolarHBondContact CA-O 3.34Å; K377-Q423 WeakPolarHBondContact CB-O 3.24Å; K377-Q423 PolarHBondContact N-O 3.06Å; K377-Q423 PolarHBondContact O-N 2.82Å
378	F	95.9	Very high	94.6	Very high	15 Å²	15	61 Å²	61	7%	0.066	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140.4	-177.8	-64.7	-90	0	0	0	111.9	F340 I361 V363 I391 T393 N398 G400 I420 S421 A422	F340-F378 HydrophobicContact CE1-CD1 4.44Å; F340-F378 AromaticContact CE1-CE1 3.96Å; F340-F378 HydrophobicContact CE1-CE1 3.96Å; I361-F378 HydrophobicContact CG2-CE1 4.38Å; V363-F378 HydrophobicContact CB-CZ 4.43Å; V363-F378 HydrophobicContact CG1-CE1 3.7Å; V363-F378 HydrophobicContact CG1-CZ 3.7Å; V363-F378 HydrophobicContact CG2-CZ 3.82Å; F378-I391 HydrophobicContact CB-CB 4.43Å; F378-I391 HydrophobicContact CB-CD1 3.63Å; F378-I391 HydrophobicContact CB-CG1 3.72Å; F378-I391 HydrophobicContact CB-CG2 3.84Å; F378-I391 HydrophobicContact CD1-CD1 4.21Å; F378-I391 HydrophobicContact CG-CD1 4.02Å; F378-I391 HydrophobicContact CG-CG1 4.33Å; F378-T393 HydrophobicContact CE2-CG2 4.2Å; F378-N398 WeakPolarHBondContact CE2-O 3.44Å; F378-G400 VanDerWaalsContact CD2-CA 3.48Å; F378-G400 VanDerWaalsContact CZ-N 3.26Å; F378-I420 HydrophobicContact CB-CG2 4.49Å; F378-I420 HydrophobicContact CD1-CG2 4.17Å; F378-S421 WeakPolarHBondContact CA-O 3.33Å; F378-A422 HydrophobicContact CD1-CB 4.01Å; F378-A422 HydrophobicContact CE1-CB 3.76Å; F378-A422 HydrophobicContact CZ-CB 4.44Å
379	V	95.2	Very high	94.7	Very high	56 Å²	56	57.8 Å²	57.8	34%	0.339	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	127.6	178.1	-177.3	0	0	0	0	109.3	T381 I420 S421	V379-T381 HydrophobicContact CG1-CG2 4.45Å; V379-T381 PolarHBondContact O-N 3.31Å; V379-I420 CarbonylContact O-C 3.59Å; V379-I420 WeakPolarHBondContact O-CA 3.28Å; V379-S421 PolarHBondContact N-O 2.86Å; V379-S421 PolarHBondContact O-N 2.87Å
380	I	97.4	Very high	94.8	Very high	31 Å²	31	55.2 Å²	55.2	16%	0.159	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	108.5	171.7	-51.4	174.7	0	0	0	107.9	K382 N384 F389 I391 L402 L418 E419 I420	I380-K382 WeakPolarHBondContact CG2-O 3.33Å; I380-N384 HydrophobicContact CG2-CB 3.79Å; I380-F389 HydrophobicContact CD1-CB 3.85Å; I380-I391 HydrophobicContact CD1-CB 4.28Å; I380-I391 HydrophobicContact CD1-CG2 4.26Å; I380-I391 HydrophobicContact CG1-CB 4.19Å; I380-I391 HydrophobicContact CG1-CG2 3.76Å; I380-L402 HydrophobicContact CD1-CD1 3.98Å; I380-L418 HydrophobicContact CG2-CB 4.48Å; I380-L418 HydrophobicContact CG2-CD2 4.22Å; I380-E419 CarbonylContact C-O 3.25Å; I380-E419 WeakPolarHBondContact CA-O 3.3Å; I380-I420 HydrophobicContact CG1-CD1 4.45Å; I380-I420 HydrophobicContact CG1-CG1 4.31Å
381	T	95.9	Very high	95.1	Very high	63 Å²	63	50.8 Å²	50.8	39%	0.387	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-30.3	-173	51.7	0	0	0	0	113.1	V379 E419	V379-T381 HydrophobicContact CG1-CG2 4.45Å; V379-T381 PolarHBondContact O-N 3.31Å; T381-E419 PolarHBondContact N-O 3Å; T381-E419 WeakPolarHBondContact OG1-CB 3.13Å; T381-E419 WeakPolarHBondContact OG1-CG 3.44Å; T381-E419 PolarHBondContact OG1-O 2.89Å; T381-E419 PolarHBondContact OG1-OE2 3.42Å
382	K	96.1	Very high	95.2	Very high	123 Å²	123	51.4 Å²	51.4	54%	0.535	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	160.5	176.1	-56.3	-175.5	-175.3	87.7	0	111.8	I380 L418 E419	I380-K382 WeakPolarHBondContact CG2-O 3.33Å; K382-L418 WeakPolarHBondContact O-CA 3.12Å; K382-E419 HydrophobicContact CB-CB 3.82Å; K382-E419 HydrophobicContact CD-CB 4.49Å; K382-E419 HydrophobicContact CG-CB 4.19Å; K382-E419 WeakPolarHBondContact CG-OE2 3.45Å; K382-E419 PolarHBondContact N-O 3.49Å; K382-E419 IonicContact NZ-OE1 2.72Å; K382-E419 PolarHBondContact NZ-OE1 3.02Å; K382-E419 IonicContact NZ-OE2 3.71Å; K382-E419 PolarHBondContact NZ-OE2 3.06Å; K382-E419 PolarHBondContact O-N 3.06Å; K382-E419 VanDerWaalsContact O-N 3.11Å
383	G	93.8	Very high	95.2	Very high	43 Å²	43	50.5 Å²	50.5	44%	0.443	30%	0.295	S	S	.	.	S	Bend	trans	89.8	-6.7	170.6	0	0	0	0	0	116.9	M417	G383-M417 WeakPolarHBondContact CA-O 3.29Å
384	N	95.9	Very high	95.3	Very high	40 Å²	40	50.2 Å²	50.2	21%	0.214	29%	0.293	C	S	.	.			trans	-113.8	35	-173	-168	29.2	0	0	0	114.1	I380 N386 G387 N388 F389 L418	I380-N384 HydrophobicContact CG2-CB 3.79Å; N384-N386 PolarHBondContact O-N 2.75Å; N384-G387 PolarHBondContact O-N 3.23Å; N384-G387 WeakPolarHBondContact OD1-CA 3.22Å; N384-N388 PolarHBondContact OD1-N 2.74Å; N384-F389 PolarHBondContact ND2-O 3.1Å; N384-F389 PolarHBondContact OD1-N 3.08Å; N384-L418 HydrophobicContact CB-CD2 4.24Å
385	G	92.3	Very high	95.1	Very high	83 Å²	83	54.5 Å²	54.5	86%	0.856	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.1	-174.3	0	0	0	0	0	114.7
386	N	91.8	Very high	94.8	Very high	122 Å²	122	61.3 Å²	61.3	65%	0.652	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10	178.5	-66.2	-5.1	0	0	0	113.3	N384 N388 K406	N384-N386 PolarHBondContact O-N 2.75Å; N386-N388 WeakPolarHBondContact CB-OD1 3.44Å; N386-K406 PolarHBondContact O-NZ 2.89Å
387	G	93.9	Very high	94.7	Very high	26 Å²	26	64.3 Å²	64.3	27%	0.268	37%	0.372	S	S	.	.			trans	67.9	36	-172.8	0	0	0	0	0	113.7	N384 F389 K406	N384-G387 PolarHBondContact O-N 3.23Å; N384-G387 WeakPolarHBondContact OD1-CA 3.22Å; G387-F389 VanDerWaalsContact C-N 3.29Å; G387-K406 WeakPolarHBondContact O-CD 3.44Å; G387-K406 WeakPolarHBondContact O-CE 3.48Å; G387-K406 WeakPolarHBondContact O-CG 3.28Å
388	N	96	Very high	94.7	Very high	22 Å²	22	58.9 Å²	58.9	12%	0.118	35%	0.348	C	S	.	.			trans	-72	-21.4	174.5	-78.1	97.5	0	0	0	113.2	N384 N386 V404 A405 K406 P407 L408	N384-N388 PolarHBondContact OD1-N 2.74Å; N386-N388 WeakPolarHBondContact CB-OD1 3.44Å; N388-V404 CarbonylContact O-C 3.54Å; N388-V404 WeakPolarHBondContact O-CA 3.49Å; N388-A405 PolarHBondContact O-N 2.64Å; N388-K406 PolarHBondContact ND2-O 2.83Å; N388-K406 PolarHBondContact O-N 2.87Å; N388-P407 PolarHBondContact ND2-O 3.39Å; N388-L408 HydrophobicContact CB-CD2 3.87Å; N388-L408 HydrophobicContact CB-CG 4.45Å
389	F	97.6	Very high	94.7	Very high	8 Å²	8	60 Å²	60	4%	0.035	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150.4	-175.9	-57.5	-86.7	0	0	0	111.9	I358 I380 N384 G387 L402 Y403 V404 L408 V416 L418 V442	I358-F389 HydrophobicContact CD1-CD1 4.02Å; I358-F389 HydrophobicContact CD1-CE1 3.77Å; I380-F389 HydrophobicContact CD1-CB 3.85Å; N384-F389 PolarHBondContact ND2-O 3.1Å; N384-F389 PolarHBondContact OD1-N 3.08Å; G387-F389 VanDerWaalsContact C-N 3.29Å; F389-L402 HydrophobicContact CB-CD1 4.23Å; F389-Y403 WeakPolarHBondContact CA-O 3.29Å; F389-V404 HydrophobicContact CD1-CG2 4.18Å; F389-V404 HydrophobicContact CE1-CG2 3.96Å; F389-L408 HydrophobicContact CE1-CD1 4.21Å; F389-L408 HydrophobicContact CE2-CD1 4.44Å; F389-L408 HydrophobicContact CE2-CD2 4.44Å; F389-L408 HydrophobicContact CZ-CD1 3.67Å; F389-L408 HydrophobicContact CZ-CD2 4.42Å; F389-V416 HydrophobicContact CE2-CB 4.2Å; F389-V416 HydrophobicContact CE2-CG1 3.89Å; F389-V416 HydrophobicContact CE2-CG2 4.15Å; F389-V416 HydrophobicContact CZ-CB 4.28Å; F389-V416 HydrophobicContact CZ-CG1 4.42Å; F389-V416 HydrophobicContact CZ-CG2 4.25Å; F389-L418 HydrophobicContact CB-CD1 4.33Å; F389-L418 HydrophobicContact CD1-CD1 4.08Å; F389-L418 HydrophobicContact CD2-CD1 4.07Å; F389-L418 HydrophobicContact CD2-CD2 3.85Å; F389-L418 HydrophobicContact CD2-CG 4.49Å; F389-L418 HydrophobicContact CE1-CD1 4.42Å; F389-L418 HydrophobicContact CE2-CD1 4.43Å; F389-L418 HydrophobicContact CE2-CD2 4.13Å; F389-L418 HydrophobicContact CG-CD1 3.88Å; F389-L418 HydrophobicContact CG-CD2 4.43Å; F389-V442 HydrophobicContact CE1-CB 4.36Å; F389-V442 HydrophobicContact CE1-CG1 4.02Å; F389-V442 HydrophobicContact CE1-CG2 3.99Å; F389-V442 HydrophobicContact CZ-CB 4.23Å; F389-V442 HydrophobicContact CZ-CG1 4.08Å; F389-V442 HydrophobicContact CZ-CG2 4.18Å
390	R	96.9	Very high	94.8	Very high	91 Å²	91	57.4 Å²	57.4	34%	0.343	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.3	166.4	65.4	-177.3	174.4	68.3	2.8	109.6	D355 Y403 A405	D355-R390 IonicContact OD1-CZ 2.64Å; D355-R390 VanDerWaalsContact OD1-CZ 3.28Å; D355-R390 IonicContact OD1-NE 3.57Å; D355-R390 PolarHBondContact OD1-NE 2.86Å; D355-R390 IonicContact OD1-NH2 2.66Å; D355-R390 PolarHBondContact OD1-NH2 3.2Å; R390-Y403 HydrophobicContact CG-CD2 4.49Å; R390-Y403 HydrophobicContact CG-CG 4.47Å; R390-Y403 PolarHBondContact N-O 3.46Å; R390-Y403 PolarHBondContact O-N 2.81Å; R390-A405 HydrophobicContact CB-CB 4.15Å; R390-A405 HydrophobicContact CG-CB 3.97Å
391	I	97.6	Very high	94.8	Very high	32 Å²	32	56.5 Å²	56.5	16%	0.164	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.7	173.3	-165	157.6	0	0	0	110.2	I361 F378 I380 L401 L402 I420	I361-I391 HydrophobicContact CD1-CD1 4.03Å; F378-I391 HydrophobicContact CB-CB 4.43Å; F378-I391 HydrophobicContact CB-CD1 3.63Å; F378-I391 HydrophobicContact CB-CG1 3.72Å; F378-I391 HydrophobicContact CB-CG2 3.84Å; F378-I391 HydrophobicContact CD1-CD1 4.21Å; F378-I391 HydrophobicContact CG-CD1 4.02Å; F378-I391 HydrophobicContact CG-CG1 4.33Å; I380-I391 HydrophobicContact CD1-CB 4.28Å; I380-I391 HydrophobicContact CD1-CG2 4.26Å; I380-I391 HydrophobicContact CG1-CB 4.19Å; I380-I391 HydrophobicContact CG1-CG2 3.76Å; I391-L401 WeakPolarHBondContact CA-O 3.46Å; I391-L402 HydrophobicContact CB-CD1 4.38Å; I391-L402 HydrophobicContact CD1-CB 4.44Å; I391-I420 HydrophobicContact CD1-CD1 3.95Å; I391-I420 HydrophobicContact CD1-CG2 3.76Å
392	A	95.4	Very high	94.9	Very high	42 Å²	42	53.5 Å²	53.5	35%	0.347	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	164.7	173.7	0	0	0	0	0	109.6	L401	A392-L401 PolarHBondContact N-O 3.46Å; A392-L401 VanDerWaalsContact N-O 3.11Å; A392-L401 PolarHBondContact O-N 2.77Å
393	T	95.9	Very high	94.9	Very high	40 Å²	40	50 Å²	50	25%	0.245	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.5	170.3	-49.8	0	0	0	0	109.7	S376 F378 P395 E399	S376-T393 WeakPolarHBondContact O-CB 3.25Å; S376-T393 VanDerWaalsContact O-CG2 3.3Å; S376-T393 WeakPolarHBondContact O-CG2 3.31Å; S376-T393 PolarHBondContact O-OG1 3.41Å; F378-T393 HydrophobicContact CE2-CG2 4.2Å; T393-P395 WeakPolarHBondContact O-CD 3.45Å; T393-E399 CarbonylContact C-O 3.58Å; T393-E399 WeakPolarHBondContact CA-O 3.47Å
394	D	95	Very high	95.1	Very high	19 Å²	19	48 Å²	48	10%	0.102	28%	0.278	C	S	.	.			trans	-74.8	114.9	165.7	-166.9	-46.5	0	0	0	109.5	R360 K396 T397 N398 E399 L401	R360-D394 IonicContact CZ-OD2 2.71Å; R360-D394 VanDerWaalsContact CZ-OD2 3.26Å; R360-D394 IonicContact NH1-OD2 2.68Å; R360-D394 PolarHBondContact NH1-OD2 2.69Å; R360-D394 IonicContact NH2-OD2 3.48Å; R360-D394 PolarHBondContact NH2-OD2 2.68Å; D394-K396 PolarHBondContact O-N 3.18Å; D394-K396 PolarHBondContact OD1-N 2.73Å; D394-T397 WeakPolarHBondContact CB-OG1 3.17Å; D394-T397 PolarHBondContact O-N 3.45Å; D394-N398 WeakPolarHBondContact O-CA 3.38Å; D394-N398 PolarHBondContact O-N 2.83Å; D394-E399 HydrophobicContact CB-CB 4.45Å; D394-E399 PolarHBondContact N-O 3Å; D394-L401 HydrophobicContact CB-CD1 3.84Å; D394-L401 HydrophobicContact CB-CD2 4.06Å; D394-L401 HydrophobicContact CB-CG 3.94Å
395	P	90.1	Very high	95	Very high	122 Å²	122	47.8 Å²	47.8	79%	0.792	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	0.9	-174.6	31.7	-37.3	0	0	0	113.9	T393	T393-P395 WeakPolarHBondContact O-CD 3.45Å
396	K	88.9	Confident	95.2	Very high	188 Å²	188	49 Å²	49	82%	0.817	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-26.2	175.8	-63.1	-178.4	179.7	-180	0	114	D394	D394-K396 PolarHBondContact O-N 3.18Å; D394-K396 PolarHBondContact OD1-N 2.73Å
397	T	92.2	Very high	95.3	Very high	65 Å²	65	46.2 Å²	46.2	40%	0.399	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-5.4	-175.2	60.6	0	0	0	0	113.6	D394 E399	D394-T397 WeakPolarHBondContact CB-OG1 3.17Å; D394-T397 PolarHBondContact O-N 3.45Å; T397-E399 WeakPolarHBondContact CB-OE2 3.25Å; T397-E399 PolarHBondContact O-N 2.96Å; T397-E399 VanDerWaalsContact O-N 3.16Å; T397-E399 VanDerWaalsContact OG1-CG 3.3Å; T397-E399 WeakPolarHBondContact OG1-CG 3.33Å; T397-E399 PolarHBondContact OG1-OE2 2.82Å
398	N	94.4	Very high	95.3	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.027	24%	0.242	C	C	.	.			trans	62.6	8.9	-174.8	-145.1	17.4	0	0	0	114.2	V363 W374 S376 F378 D394	V363-N398 WeakPolarHBondContact CG2-O 3.07Å; W374-N398 HydrophobicContact CH2-CB 3.67Å; W374-N398 HydrophobicContact CZ2-CB 3.92Å; W374-N398 HydrophobicContact CZ3-CB 4.05Å; W374-N398 PolarHBondContact O-ND2 2.81Å; S376-N398 WeakPolarHBondContact CB-OD1 3.26Å; S376-N398 PolarHBondContact N-OD1 3.27Å; F378-N398 WeakPolarHBondContact CE2-O 3.44Å; D394-N398 WeakPolarHBondContact O-CA 3.38Å; D394-N398 PolarHBondContact O-N 2.83Å
399	E	96.3	Very high	95.1	Very high	40 Å²	40	46.3 Å²	46.3	19%	0.187	25%	0.246	C	C	.	.			trans	-76.6	146.5	-176.2	-64.5	175	111.9	0	0	112.6	R360 P362 T393 D394 T397 L401	R360-E399 IonicContact CZ-OE2 3.71Å; R360-E399 IonicContact NH1-OE2 2.74Å; R360-E399 PolarHBondContact NH1-OE2 3.48Å; P362-E399 HydrophobicContact CB-CG 4.42Å; T393-E399 CarbonylContact C-O 3.58Å; T393-E399 WeakPolarHBondContact CA-O 3.47Å; D394-E399 HydrophobicContact CB-CB 4.45Å; D394-E399 PolarHBondContact N-O 3Å; T397-E399 WeakPolarHBondContact CB-OE2 3.25Å; T397-E399 PolarHBondContact O-N 2.96Å; T397-E399 VanDerWaalsContact O-N 3.16Å; T397-E399 VanDerWaalsContact OG1-CG 3.3Å; T397-E399 WeakPolarHBondContact OG1-CG 3.33Å; T397-E399 PolarHBondContact OG1-OE2 2.82Å; E399-L401 PolarHBondContact O-N 2.82Å
400	G	96.8	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.9	171.7	0	0	0	0	0	111.3	R360 I361 F378	R360-G400 CarbonylContact C-O 3.54Å; R360-G400 WeakPolarHBondContact CA-O 3.45Å; I361-G400 WeakPolarHBondContact CB-O 3.19Å; I361-G400 PolarHBondContact N-O 3.13Å; I361-G400 PolarHBondContact O-N 3.07Å; F378-G400 VanDerWaalsContact CD2-CA 3.48Å; F378-G400 VanDerWaalsContact CZ-N 3.26Å
401	L	97.6	Very high	94.6	Very high	13 Å²	13	46.9 Å²	46.9	7%	0.068	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	99	178.7	-57.4	-174.4	0	0	0	109.9	L357 R360 I391 A392 D394 E399 Y403	L357-L401 HydrophobicContact CD1-CB 3.82Å; L357-L401 HydrophobicContact CD1-CD2 4.28Å; R360-L401 HydrophobicContact CG-CD2 3.79Å; I391-L401 WeakPolarHBondContact CA-O 3.46Å; A392-L401 PolarHBondContact N-O 3.46Å; A392-L401 VanDerWaalsContact N-O 3.11Å; A392-L401 PolarHBondContact O-N 2.77Å; D394-L401 HydrophobicContact CB-CD1 3.84Å; D394-L401 HydrophobicContact CB-CD2 4.06Å; D394-L401 HydrophobicContact CB-CG 3.94Å; E399-L401 PolarHBondContact O-N 2.82Å; L401-Y403 HydrophobicContact CB-CD2 4.33Å; L401-Y403 HydrophobicContact CB-CE2 3.54Å; L401-Y403 HydrophobicContact CD1-CE2 4.5Å; L401-Y403 WeakPolarHBondContact O-CD2 3.2Å; L401-Y403 WeakPolarHBondContact O-CE2 3.25Å
402	L	98.1	Very high	94.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122	179.8	-178.6	67.4	0	0	0	110.7	L357 I358 L359 I361 I380 F389 I391 L418 I420 V440	L357-L402 WeakPolarHBondContact CD1-O 3.31Å; I358-L402 HydrophobicContact CD1-CD2 4.04Å; I358-L402 HydrophobicContact CD1-CG 4.16Å; I358-L402 HydrophobicContact CG1-CD2 4.23Å; I358-L402 HydrophobicContact CG1-CG 4.05Å; I358-L402 VanDerWaalsContact CG1-O 3.31Å; I358-L402 WeakPolarHBondContact CG1-O 3.39Å; I358-L402 PolarHBondContact N-O 2.87Å; L359-L402 HydrophobicContact CB-CB 4.2Å; L359-L402 HydrophobicContact CB-CD2 4.32Å; L359-L402 HydrophobicContact CD2-CD2 4.44Å; L359-L402 PolarHBondContact N-O 3.39Å; L359-L402 PolarHBondContact O-N 3.2Å; I361-L402 HydrophobicContact CD1-CB 4.48Å; I380-L402 HydrophobicContact CD1-CD1 3.98Å; F389-L402 HydrophobicContact CB-CD1 4.23Å; I391-L402 HydrophobicContact CB-CD1 4.38Å; I391-L402 HydrophobicContact CD1-CB 4.44Å; L402-L418 HydrophobicContact CD1-CD1 4.11Å; L402-L418 HydrophobicContact CD2-CD1 4.02Å; L402-I420 HydrophobicContact CD1-CD1 4.15Å; L402-I420 HydrophobicContact CD2-CD1 4.28Å; L402-V440 HydrophobicContact CD2-CG1 4.18Å
403	Y	97.4	Very high	94	Very high	49 Å²	49	51 Å²	51	19%	0.192	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	152.5	178.9	-59	-106.7	0	0	0	111.4	D355 K356 L357 F389 R390 L401	D355-Y403 WeakPolarHBondContact O-CD1 3.44Å; K356-Y403 CarbonylContact O-C 3.59Å; K356-Y403 WeakPolarHBondContact O-CA 3.48Å; L357-Y403 HydrophobicContact CB-CD1 3.89Å; L357-Y403 HydrophobicContact CB-CE1 3.75Å; L357-Y403 HydrophobicContact CD1-CD1 4.26Å; L357-Y403 HydrophobicContact CD1-CD2 4.11Å; L357-Y403 HydrophobicContact CD1-CE1 4Å; L357-Y403 HydrophobicContact CD1-CE2 3.86Å; L357-Y403 HydrophobicContact CD1-CG 4.29Å; L357-Y403 HydrophobicContact CG-CE1 4.46Å; F389-Y403 WeakPolarHBondContact CA-O 3.29Å; R390-Y403 HydrophobicContact CG-CD2 4.49Å; R390-Y403 HydrophobicContact CG-CG 4.47Å; R390-Y403 PolarHBondContact N-O 3.46Å; R390-Y403 PolarHBondContact O-N 2.81Å; L401-Y403 HydrophobicContact CB-CD2 4.33Å; L401-Y403 HydrophobicContact CB-CE2 3.54Å; L401-Y403 HydrophobicContact CD1-CE2 4.5Å; L401-Y403 WeakPolarHBondContact O-CD2 3.2Å; L401-Y403 WeakPolarHBondContact O-CE2 3.25Å
404	V	96.9	Very high	93.9	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.2	159.3	178.1	0	0	0	0	108.6	V349 E353 D355 K356 I358 N388 F389 K406	V349-V404 HydrophobicContact CG1-CG2 4.32Å; V349-V404 HydrophobicContact CG2-CG2 3.99Å; E353-V404 WeakPolarHBondContact O-CG1 3.41Å; D355-V404 WeakPolarHBondContact CA-O 3.38Å; D355-V404 PolarHBondContact N-O 2.69Å; K356-V404 PolarHBondContact O-N 3.15Å; I358-V404 HydrophobicContact CD1-CG2 3.98Å; I358-V404 HydrophobicContact CG1-CG2 4.5Å; I358-V404 HydrophobicContact CG2-CG2 3.94Å; N388-V404 CarbonylContact O-C 3.54Å; N388-V404 WeakPolarHBondContact O-CA 3.49Å; F389-V404 HydrophobicContact CD1-CG2 4.18Å; F389-V404 HydrophobicContact CE1-CG2 3.96Å; V404-K406 WeakPolarHBondContact CG1-O 3.21Å
405	A	94.9	Very high	93.8	Very high	35 Å²	35	57.9 Å²	57.9	29%	0.289	30%	0.299	S	S	.	.	S	Bend	trans	-103.9	-19.9	178.8	0	0	0	0	0	113.1	N388 R390	N388-A405 PolarHBondContact O-N 2.64Å; R390-A405 HydrophobicContact CB-CB 4.15Å; R390-A405 HydrophobicContact CG-CB 3.97Å
406	K	94.7	Very high	94.1	Very high	109 Å²	109	52.9 Å²	52.9	47%	0.474	27%	0.266	S	S	.	.	S	Bend	trans	-142.7	142.2	171.6	-55.5	176.1	-172.1	174.8	0	109.2	N386 G387 N388 V404	N386-K406 PolarHBondContact O-NZ 2.89Å; G387-K406 WeakPolarHBondContact O-CD 3.44Å; G387-K406 WeakPolarHBondContact O-CE 3.48Å; G387-K406 WeakPolarHBondContact O-CG 3.28Å; N388-K406 PolarHBondContact ND2-O 2.83Å; N388-K406 PolarHBondContact O-N 2.87Å; V404-K406 WeakPolarHBondContact CG1-O 3.21Å
407	P	94	Very high	94.5	Very high	64 Å²	64	48.4 Å²	48.4	42%	0.416	25%	0.249	S	C	.	.			trans	-53.9	143.7	178.5	24.1	-35	0	0	0	112.2	E353 N388	E353-P407 WeakPolarHBondContact O-CA 3.37Å; N388-P407 PolarHBondContact ND2-O 3.39Å
408	L	94.1	Very high	94.8	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.058	23%	0.231	C	C	.	.			trans	-97.1	158.9	166.2	-64.2	156.3	0	0	0	107.5	V349 E351 N352 N388 F389 V416 V444	V349-L408 HydrophobicContact CG1-CD1 3.82Å; E351-L408 WeakPolarHBondContact CB-O 3.2Å; N352-L408 PolarHBondContact N-O 2.82Å; N388-L408 HydrophobicContact CB-CD2 3.87Å; N388-L408 HydrophobicContact CB-CG 4.45Å; F389-L408 HydrophobicContact CE1-CD1 4.21Å; F389-L408 HydrophobicContact CE2-CD1 4.44Å; F389-L408 HydrophobicContact CE2-CD2 4.44Å; F389-L408 HydrophobicContact CZ-CD1 3.67Å; F389-L408 HydrophobicContact CZ-CD2 4.42Å; L408-V416 HydrophobicContact CD2-CG2 4.31Å; L408-V444 HydrophobicContact CB-CG1 4.44Å; L408-V444 HydrophobicContact CB-CG2 4.1Å; L408-V444 HydrophobicContact CD1-CG2 3.8Å; L408-V444 HydrophobicContact CG-CG2 4.44Å
409	N	92.3	Very high	94.9	Very high	39 Å²	39	47.9 Å²	47.9	21%	0.209	24%	0.242	C	C	.	.			trans	-121.9	141.9	165.7	154.1	-88.9	0	0	0	108.1	E351 E411 T412 T413	E351-N409 WeakPolarHBondContact OE2-CA 3.39Å; E351-N409 PolarHBondContact OE2-ND2 2.87Å; N409-E411 PolarHBondContact ND2-OE2 2.67Å; N409-E411 PolarHBondContact OD1-N 2.77Å; N409-T412 PolarHBondContact O-OG1 2.76Å; N409-T412 WeakPolarHBondContact OD1-CB 3.21Å; N409-T412 WeakPolarHBondContact OD1-CG2 3.46Å; N409-T412 PolarHBondContact OD1-N 2.88Å; N409-T412 PolarHBondContact OD1-OG1 2.72Å; N409-T413 PolarHBondContact O-N 2.87Å; N409-T413 VanDerWaalsContact O-N 3.09Å
410	Y	93.7	Very high	95	Very high	55 Å²	55	46 Å²	46	22%	0.216	23%	0.233	C	C	.	.	H	α-helix	trans	-77.1	-40.3	-173	-179.6	-118.3	0	0	0	111.6	E351 T412 T413 K414 V444 D446	E351-Y410 VanDerWaalsContact CD-CB 3.45Å; E351-Y410 WeakPolarHBondContact OE1-CB 3.49Å; E351-Y410 VanDerWaalsContact OE2-CB 3.27Å; E351-Y410 WeakPolarHBondContact OE2-CB 3.27Å; E351-Y410 PolarHBondContact OE2-N 3.34Å; Y410-T412 PolarHBondContact O-N 3.09Å; Y410-T413 PolarHBondContact O-N 3.18Å; Y410-T413 VanDerWaalsContact O-N 3.16Å; Y410-K414 HydrophobicContact CD1-CG 4.5Å; Y410-K414 HydrophobicContact CD2-CB 3.94Å; Y410-K414 HydrophobicContact CD2-CD 4.29Å; Y410-K414 HydrophobicContact CD2-CG 3.62Å; Y410-K414 HydrophobicContact CE1-CD 4.06Å; Y410-K414 HydrophobicContact CE1-CG 4.4Å; Y410-K414 HydrophobicContact CE2-CB 3.71Å; Y410-K414 HydrophobicContact CE2-CD 3.82Å; Y410-K414 HydrophobicContact CE2-CG 3.52Å; Y410-K414 HydrophobicContact CG-CG 4.1Å; Y410-K414 WeakPolarHBondContact O-CG 3.34Å; Y410-K414 PolarHBondContact O-N 2.8Å; Y410-K414 PolarHBondContact O-NZ 2.92Å; Y410-V444 HydrophobicContact CD2-CB 4.19Å; Y410-V444 HydrophobicContact CD2-CG1 4.14Å; Y410-V444 VanDerWaalsContact CD2-O 3.31Å; Y410-V444 WeakPolarHBondContact CD2-O 3.41Å; Y410-V444 VanDerWaalsContact CE2-O 3.25Å; Y410-V444 WeakPolarHBondContact CE2-O 3.38Å; Y410-D446 HydrophobicContact CD1-CB 3.6Å; Y410-D446 HydrophobicContact CE1-CB 3.45Å; Y410-D446 VanDerWaalsContact CE1-CB 3.45Å; Y410-D446 WeakPolarHBondContact CE1-OD2 2.92Å; Y410-D446 HydrophobicContact CE2-CB 4.46Å; Y410-D446 HydrophobicContact CG-CB 4.22Å
411	E	90.4	Very high	94.9	Very high	55 Å²	55	46.1 Å²	46.1	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-41.4	-175.5	-76.3	45.1	-94.3	0	0	110.4	N409 K414 P480	N409-E411 PolarHBondContact ND2-OE2 2.67Å; N409-E411 PolarHBondContact OD1-N 2.77Å; E411-K414 IonicContact OE1-NZ 3.93Å; E411-K414 PolarHBondContact OE1-NZ 3.3Å; E411-P480 HydrophobicContact CG-CB 4.32Å; E411-P480 WeakPolarHBondContact CG-O 3.4Å
412	T	89.4	Confident	94.8	Very high	109 Å²	109	45.5 Å²	45.5	67%	0.669	23%	0.231	S	C	*	.	H	α-helix	trans	-80.1	-42.5	174.5	59.4	0	0	0	0	113.2	N409 Y410	N409-T412 PolarHBondContact O-OG1 2.76Å; N409-T412 WeakPolarHBondContact OD1-CB 3.21Å; N409-T412 WeakPolarHBondContact OD1-CG2 3.46Å; N409-T412 PolarHBondContact OD1-N 2.88Å; N409-T412 PolarHBondContact OD1-OG1 2.72Å; Y410-T412 PolarHBondContact O-N 3.09Å
413	T	90.4	Very high	94.6	Very high	52 Å²	52	48 Å²	48	32%	0.319	24%	0.243	S	C	.	.	H	α-helix	trans	-140.8	67.4	-163.7	-42.4	0	0	0	0	114.1	N409 Y410 K415 V416 V444	N409-T413 PolarHBondContact O-N 2.87Å; N409-T413 VanDerWaalsContact O-N 3.09Å; Y410-T413 PolarHBondContact O-N 3.18Å; Y410-T413 VanDerWaalsContact O-N 3.16Å; T413-K415 PolarHBondContact O-N 3.06Å; T413-V416 HydrophobicContact CG2-CG2 3.78Å; T413-V444 WeakPolarHBondContact O-CG2 3.11Å
414	K	93.7	Very high	94.4	Very high	99 Å²	99	46 Å²	46	43%	0.43	24%	0.235	S	C	.	.	S	Bend	trans	-57.9	-18.7	179.9	-55.8	-171.2	-175.1	-76	0	115.4	Y410 E411 V444	Y410-K414 HydrophobicContact CD1-CG 4.5Å; Y410-K414 HydrophobicContact CD2-CB 3.94Å; Y410-K414 HydrophobicContact CD2-CD 4.29Å; Y410-K414 HydrophobicContact CD2-CG 3.62Å; Y410-K414 HydrophobicContact CE1-CD 4.06Å; Y410-K414 HydrophobicContact CE1-CG 4.4Å; Y410-K414 HydrophobicContact CE2-CB 3.71Å; Y410-K414 HydrophobicContact CE2-CD 3.82Å; Y410-K414 HydrophobicContact CE2-CG 3.52Å; Y410-K414 HydrophobicContact CG-CG 4.1Å; Y410-K414 WeakPolarHBondContact O-CG 3.34Å; Y410-K414 PolarHBondContact O-N 2.8Å; Y410-K414 PolarHBondContact O-NZ 2.92Å; E411-K414 IonicContact OE1-NZ 3.93Å; E411-K414 PolarHBondContact OE1-NZ 3.3Å; K414-V444 PolarHBondContact O-N 2.84Å
415	K	94.2	Very high	94.2	Very high	104 Å²	104	51.5 Å²	51.5	45%	0.452	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	134.9	-179.5	174.2	168.1	167.6	162.1	0	112.4	T413 M417 E441 V442	T413-K415 PolarHBondContact O-N 3.06Å; K415-M417 WeakPolarHBondContact CE-SD 3.05Å; K415-E441 HydrophobicContact CD-CG 4.36Å; K415-E441 VanDerWaalsContact CE-CD 3.43Å; K415-E441 WeakPolarHBondContact CE-OE1 3.45Å; K415-E441 IonicContact NZ-OE1 3.23Å; K415-E441 PolarHBondContact NZ-OE1 2.81Å; K415-E441 IonicContact NZ-OE2 2.67Å; K415-E441 PolarHBondContact NZ-OE2 2.89Å; K415-V442 WeakPolarHBondContact CA-O 3.34Å
416	V	95.9	Very high	94	Very high	17 Å²	17	55 Å²	55	10%	0.103	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136	172.1	-174.4	0	0	0	0	110.1	F389 L408 T413 L418 V442	F389-V416 HydrophobicContact CE2-CB 4.2Å; F389-V416 HydrophobicContact CE2-CG1 3.89Å; F389-V416 HydrophobicContact CE2-CG2 4.15Å; F389-V416 HydrophobicContact CZ-CB 4.28Å; F389-V416 HydrophobicContact CZ-CG1 4.42Å; F389-V416 HydrophobicContact CZ-CG2 4.25Å; L408-V416 HydrophobicContact CD2-CG2 4.31Å; T413-V416 HydrophobicContact CG2-CG2 3.78Å; V416-L418 HydrophobicContact CG1-CD2 3.73Å; V416-L418 HydrophobicContact CG1-CG 4.2Å; V416-V442 HydrophobicContact CB-CB 4.43Å; V416-V442 PolarHBondContact N-O 3.18Å; V416-V442 PolarHBondContact O-N 3.33Å
417	M	97.1	Very high	93.8	Very high	95 Å²	95	57.6 Å²	57.6	47%	0.468	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.4	170.5	-65.1	-58.3	-55.9	0	0	109	G383 K415 E441	G383-M417 WeakPolarHBondContact CA-O 3.29Å; K415-M417 WeakPolarHBondContact CE-SD 3.05Å; M417-E441 HydrophobicContact CE-CB 4.15Å; M417-E441 HydrophobicContact SD-CB 3.87Å; M417-E441 HydrophobicContact SD-CG 4.07Å
418	L	97.8	Very high	93.6	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	154.4	173	-57.1	179.5	0	0	0	110.1	I380 K382 N384 F389 L402 V416 I420 P439 V440 V442	I380-L418 HydrophobicContact CG2-CB 4.48Å; I380-L418 HydrophobicContact CG2-CD2 4.22Å; K382-L418 WeakPolarHBondContact O-CA 3.12Å; N384-L418 HydrophobicContact CB-CD2 4.24Å; F389-L418 HydrophobicContact CB-CD1 4.33Å; F389-L418 HydrophobicContact CD1-CD1 4.08Å; F389-L418 HydrophobicContact CD2-CD1 4.07Å; F389-L418 HydrophobicContact CD2-CD2 3.85Å; F389-L418 HydrophobicContact CD2-CG 4.49Å; F389-L418 HydrophobicContact CE1-CD1 4.42Å; F389-L418 HydrophobicContact CE2-CD1 4.43Å; F389-L418 HydrophobicContact CE2-CD2 4.13Å; F389-L418 HydrophobicContact CG-CD1 3.88Å; F389-L418 HydrophobicContact CG-CD2 4.43Å; L402-L418 HydrophobicContact CD1-CD1 4.11Å; L402-L418 HydrophobicContact CD2-CD1 4.02Å; V416-L418 HydrophobicContact CG1-CD2 3.73Å; V416-L418 HydrophobicContact CG1-CG 4.2Å; L418-I420 HydrophobicContact CB-CG1 4.41Å; L418-P439 WeakPolarHBondContact O-CA 3.22Å; L418-V440 HydrophobicContact CB-CB 4.31Å; L418-V440 PolarHBondContact N-O 2.69Å; L418-V440 PolarHBondContact O-N 3.39Å; L418-V442 HydrophobicContact CD1-CG2 4.08Å; L418-V442 HydrophobicContact CG-CG2 4.48Å
419	E	97.7	Very high	93.2	Very high	55 Å²	55	60 Å²	60	26%	0.257	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.3	162.9	-170.1	-170.4	-104.7	0	0	107.5	I380 T381 K382	I380-E419 CarbonylContact C-O 3.25Å; I380-E419 WeakPolarHBondContact CA-O 3.3Å; T381-E419 PolarHBondContact N-O 3Å; T381-E419 WeakPolarHBondContact OG1-CB 3.13Å; T381-E419 WeakPolarHBondContact OG1-CG 3.44Å; T381-E419 PolarHBondContact OG1-O 2.89Å; T381-E419 PolarHBondContact OG1-OE2 3.42Å; K382-E419 HydrophobicContact CB-CB 3.82Å; K382-E419 HydrophobicContact CD-CB 4.49Å; K382-E419 HydrophobicContact CG-CB 4.19Å; K382-E419 WeakPolarHBondContact CG-OE2 3.45Å; K382-E419 PolarHBondContact N-O 3.49Å; K382-E419 IonicContact NZ-OE1 2.72Å; K382-E419 PolarHBondContact NZ-OE1 3.02Å; K382-E419 IonicContact NZ-OE2 3.71Å; K382-E419 PolarHBondContact NZ-OE2 3.06Å; K382-E419 PolarHBondContact O-N 3.06Å; K382-E419 VanDerWaalsContact O-N 3.11Å
420	I	97.6	Very high	92	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	120	-172	-58.5	-173.6	0	0	0	108.7	F340 I361 F378 V379 I380 I391 L402 L418 S437 V438 V440	F340-I420 WeakPolarHBondContact CZ-O 3.4Å; I361-I420 HydrophobicContact CD1-CD1 3.69Å; F378-I420 HydrophobicContact CB-CG2 4.49Å; F378-I420 HydrophobicContact CD1-CG2 4.17Å; V379-I420 CarbonylContact O-C 3.59Å; V379-I420 WeakPolarHBondContact O-CA 3.28Å; I380-I420 HydrophobicContact CG1-CD1 4.45Å; I380-I420 HydrophobicContact CG1-CG1 4.31Å; I391-I420 HydrophobicContact CD1-CD1 3.95Å; I391-I420 HydrophobicContact CD1-CG2 3.76Å; L402-I420 HydrophobicContact CD1-CD1 4.15Å; L402-I420 HydrophobicContact CD2-CD1 4.28Å; L418-I420 HydrophobicContact CB-CG1 4.41Å; I420-S437 CarbonylContact O-C 3.39Å; I420-S437 VanDerWaalsContact O-CA 3.3Å; I420-S437 WeakPolarHBondContact O-CA 3.36Å; I420-V438 HydrophobicContact CB-CG1 4.37Å; I420-V438 PolarHBondContact N-O 2.9Å; I420-V438 PolarHBondContact O-N 2.68Å; I420-V440 HydrophobicContact CD1-CB 4.35Å; I420-V440 HydrophobicContact CD1-CG2 3.81Å; I420-V440 HydrophobicContact CG1-CG2 4.19Å
421	S	95.8	Very high	90.5	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.014	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	142.7	172.5	-177.2	0	0	0	0	110.5	F378 V379 Q423 M436 S437	F378-S421 WeakPolarHBondContact CA-O 3.33Å; V379-S421 PolarHBondContact N-O 2.86Å; V379-S421 PolarHBondContact O-N 2.87Å; S421-Q423 PolarHBondContact OG-NE2 2.9Å; S421-Q423 VanDerWaalsContact OG-NE2 3.13Å; S421-M436 VanDerWaalsContact CA-O 3.3Å; S421-M436 WeakPolarHBondContact CA-O 3.3Å; S421-M436 PolarHBondContact OG-O 3.25Å; S421-S437 WeakPolarHBondContact CB-OG 3.19Å
422	A	95.2	Very high	89.1	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.6	166.6	0	0	0	0	0	108.6	P338 F340 V363 F378 M436	P338-A422 HydrophobicContact CB-CB 3.86Å; P338-A422 HydrophobicContact CG-CB 4.45Å; F340-A422 HydrophobicContact CE1-CB 4.02Å; F340-A422 HydrophobicContact CE2-CB 4.11Å; F340-A422 HydrophobicContact CZ-CB 3.53Å; V363-A422 HydrophobicContact CG1-CB 4.21Å; F378-A422 HydrophobicContact CD1-CB 4.01Å; F378-A422 HydrophobicContact CE1-CB 3.76Å; F378-A422 HydrophobicContact CZ-CB 4.44Å; A422-M436 PolarHBondContact N-O 2.72Å; A422-M436 VanDerWaalsContact N-O 3.13Å
423	Q	93.8	Very high	87.9	Confident	53 Å²	53	61 Å²	61	25%	0.248	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152.7	-175.9	-52.1	-177.8	-2.8	0	0	107.9	S376 K377 S421 W435	S376-Q423 CarbonylContact C-O 3.59Å; S376-Q423 WeakPolarHBondContact CA-O 3.29Å; K377-Q423 WeakPolarHBondContact CA-O 3.34Å; K377-Q423 WeakPolarHBondContact CB-O 3.24Å; K377-Q423 PolarHBondContact N-O 3.06Å; K377-Q423 PolarHBondContact O-N 2.82Å; S421-Q423 PolarHBondContact OG-NE2 2.9Å; S421-Q423 VanDerWaalsContact OG-NE2 3.13Å; Q423-W435 HydrophobicContact CB-CD2 3.9Å; Q423-W435 HydrophobicContact CB-CE3 3.87Å; Q423-W435 HydrophobicContact CB-CG 4.46Å; Q423-W435 HydrophobicContact CB-CH2 4.31Å; Q423-W435 HydrophobicContact CB-CZ2 4.32Å; Q423-W435 HydrophobicContact CB-CZ3 4.1Å; Q423-W435 HydrophobicContact CG-CB 4.06Å; Q423-W435 HydrophobicContact CG-CD2 3.72Å; Q423-W435 HydrophobicContact CG-CE3 4.02Å; Q423-W435 HydrophobicContact CG-CG 3.76Å
424	N	93.6	Very high	87.3	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.032	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-179.8	175.2	-53	104.5	0	0	0	111.4	N334 P338 D365 N373 I375 W435	N334-N424 WeakPolarHBondContact ND2-CB 3.4Å; N334-N424 PolarHBondContact ND2-OD1 2.85Å; N334-N424 PolarHBondContact OD1-OD1 2.94Å; P338-N424 WeakPolarHBondContact CD-ND2 3.14Å; P338-N424 WeakPolarHBondContact CD-OD1 3.3Å; P338-N424 VanDerWaalsContact CG-ND2 3.31Å; P338-N424 WeakPolarHBondContact CG-ND2 3.49Å; D365-N424 PolarHBondContact OD2-ND2 3.4Å; N373-N424 WeakPolarHBondContact O-CB 3.49Å; N373-N424 PolarHBondContact O-ND2 3.28Å; I375-N424 CarbonylContact O-C 3.45Å; I375-N424 WeakPolarHBondContact O-CA 3.19Å; N424-W435 HydrophobicContact CB-CH2 4.1Å; N424-W435 HydrophobicContact CB-CZ3 4.38Å; N424-W435 WeakPolarHBondContact OD1-CH2 3.47Å; N424-W435 WeakPolarHBondContact OD1-CZ3 3.4Å
425	Q	91.7	Very high	87	Confident	118 Å²	118	65.8 Å²	65.8	55%	0.551	36%	0.355	S	S	*	.	S	Bend	trans	-74.9	-40.4	167.6	-62.4	-169.9	0.7	0	0	111.1	P372 I375	P372-Q425 HydrophobicContact CB-CB 4.1Å; P372-Q425 PolarHBondContact O-N 3.25Å; I375-Q425 HydrophobicContact CB-CG 4.19Å; I375-Q425 HydrophobicContact CG2-CG 4.09Å; I375-Q425 PolarHBondContact O-N 3.24Å; I375-Q425 VanDerWaalsContact O-N 3.13Å
426	E	91.2	Very high	86.7	Confident	108 Å²	108	65.3 Å²	65.3	51%	0.505	36%	0.356	S	S	.	.	S	Bend	trans	-87.2	173.7	171.4	-80.6	-60.9	162.1	0	0	113.3	P372	P372-E426 HydrophobicContact CB-CG 3.84Å; P372-E426 PolarHBondContact O-N 3.29Å; P372-E426 VanDerWaalsContact O-N 3.13Å
427	K	89.6	Confident	86.7	Confident	163 Å²	163	67 Å²	67	71%	0.709	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-91.2	143.4	176.9	-62.7	175.4	-175.1	171.8	0	111.2
428	L	89.6	Confident	86.7	Confident	40 Å²	40	62.6 Å²	62.6	21%	0.209	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-53.5	137	166.6	-74	155.1	0	0	0	112.3	N334 P337 A431 W435	N334-L428 CarbonylContact O-C 3.56Å; N334-L428 WeakPolarHBondContact O-CA 3.47Å; N334-L428 WeakPolarHBondContact OD1-CD2 3.4Å; P337-L428 HydrophobicContact CB-CD1 4.15Å; P337-L428 HydrophobicContact CB-CD2 3.88Å; P337-L428 HydrophobicContact CG-CD2 4.05Å; L428-A431 HydrophobicContact CD2-CB 3.97Å; L428-W435 HydrophobicContact CD1-CD2 3.89Å; L428-W435 HydrophobicContact CD1-CE3 3.64Å; L428-W435 HydrophobicContact CD1-CH2 3.74Å; L428-W435 HydrophobicContact CD1-CZ2 3.99Å; L428-W435 HydrophobicContact CD1-CZ3 3.54Å; L428-W435 HydrophobicContact CG-CE3 4.39Å; L428-W435 HydrophobicContact CG-CH2 3.67Å; L428-W435 HydrophobicContact CG-CZ2 4.17Å; L428-W435 HydrophobicContact CG-CZ3 3.78Å
429	V	85.9	Confident	86.7	Confident	86 Å²	86	65.2 Å²	65.2	52%	0.521	36%	0.364	S	S	.	.			trans	-132.9	138	178.8	179.4	0	0	0	0	108.1	N334 D335 A431	N334-V429 PolarHBondContact O-N 2.89Å; N334-V429 VanDerWaalsContact O-O 3.1Å; D335-V429 VanDerWaalsContact CB-O 3.3Å; D335-V429 WeakPolarHBondContact CB-O 3.46Å; V429-A431 PolarHBondContact O-N 2.94Å
430	G	67.8	Low	86.7	Confident	65 Å²	65	62.6 Å²	62.6	67%	0.67	35%	0.352	S	S	*	.	S	Bend	trans	74.7	-41	177.3	0	0	0	0	0	115
431	A	61.3	Low	86.7	Confident	32 Å²	32	64.5 Å²	64.5	26%	0.264	36%	0.36	S	S	.	.			trans	-56.5	137.4	180	0	0	0	0	0	113.6	D335 L428 V429 A433	D335-A431 HydrophobicContact CB-CB 4.3Å; D335-A431 WeakPolarHBondContact O-CB 3.3Å; L428-A431 HydrophobicContact CD2-CB 3.97Å; V429-A431 PolarHBondContact O-N 2.94Å; A431-A433 HydrophobicContact CB-CB 4.34Å; A431-A433 PolarHBondContact O-N 3.24Å
432	S	61.3	Low	86.8	Confident	135 Å²	135	64.4 Å²	64.4	94%	0.944	36%	0.36	S	S	*	.			trans	-88	19	165.5	71.1	0	0	0	0	112.7
433	A	63.7	Low	86.8	Confident	46 Å²	46	65.7 Å²	65.7	38%	0.38	37%	0.371	S	S	.	.			trans	-102.9	143.7	-173.3	0	0	0	0	0	111.2	P337 A431	P337-A433 HydrophobicContact CG-CB 3.73Å; A431-A433 HydrophobicContact CB-CB 4.34Å; A431-A433 PolarHBondContact O-N 3.24Å
434	E	79.3	Confident	86.9	Confident	172 Å²	172	63.5 Å²	63.5	80%	0.804	36%	0.361	S	S	*	.			trans	-95.6	164.4	173.7	-63.4	-171.3	157.3	0	0	111.2	M436	E434-M436 PolarHBondContact O-N 2.83Å; E434-M436 VanDerWaalsContact O-N 3.11Å
435	W	87.4	Confident	87	Confident	81 Å²	81	65.9 Å²	65.9	31%	0.307	38%	0.376	S	S	.	.			trans	-61.1	112.8	174.1	-66.5	128.8	0	0	0	111.7	P337 Q423 N424 L428	P337-W435 HydrophobicContact CB-CE3 4.37Å; P337-W435 HydrophobicContact CB-CZ3 4.32Å; Q423-W435 HydrophobicContact CB-CD2 3.9Å; Q423-W435 HydrophobicContact CB-CE3 3.87Å; Q423-W435 HydrophobicContact CB-CG 4.46Å; Q423-W435 HydrophobicContact CB-CH2 4.31Å; Q423-W435 HydrophobicContact CB-CZ2 4.32Å; Q423-W435 HydrophobicContact CB-CZ3 4.1Å; Q423-W435 HydrophobicContact CG-CB 4.06Å; Q423-W435 HydrophobicContact CG-CD2 3.72Å; Q423-W435 HydrophobicContact CG-CE3 4.02Å; Q423-W435 HydrophobicContact CG-CG 3.76Å; N424-W435 HydrophobicContact CB-CH2 4.1Å; N424-W435 HydrophobicContact CB-CZ3 4.38Å; N424-W435 WeakPolarHBondContact OD1-CH2 3.47Å; N424-W435 WeakPolarHBondContact OD1-CZ3 3.4Å; L428-W435 HydrophobicContact CD1-CD2 3.89Å; L428-W435 HydrophobicContact CD1-CE3 3.64Å; L428-W435 HydrophobicContact CD1-CH2 3.74Å; L428-W435 HydrophobicContact CD1-CZ2 3.99Å; L428-W435 HydrophobicContact CD1-CZ3 3.54Å; L428-W435 HydrophobicContact CG-CE3 4.39Å; L428-W435 HydrophobicContact CG-CH2 3.67Å; L428-W435 HydrophobicContact CG-CZ2 4.17Å; L428-W435 HydrophobicContact CG-CZ3 3.78Å
436	M	88.1	Confident	87.1	Confident	94 Å²	94	64.3 Å²	64.3	46%	0.463	37%	0.371	S	S	.	.			trans	-62.3	145.1	-179.5	-66.7	-60.1	-68.6	0	0	111.4	F340 S421 A422 E434	F340-M436 HydrophobicContact CD2-CB 4.13Å; F340-M436 HydrophobicContact CE2-CB 3.98Å; S421-M436 VanDerWaalsContact CA-O 3.3Å; S421-M436 WeakPolarHBondContact CA-O 3.3Å; S421-M436 PolarHBondContact OG-O 3.25Å; A422-M436 PolarHBondContact N-O 2.72Å; A422-M436 VanDerWaalsContact N-O 3.13Å; E434-M436 PolarHBondContact O-N 2.83Å; E434-M436 VanDerWaalsContact O-N 3.11Å
437	S	94.6	Very high	87.1	Confident	53 Å²	53	62.4 Å²	62.4	37%	0.371	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.6	173.4	-62.1	0	0	0	0	110.6	I420 S421	I420-S437 CarbonylContact O-C 3.39Å; I420-S437 VanDerWaalsContact O-CA 3.3Å; I420-S437 WeakPolarHBondContact O-CA 3.36Å; S421-S437 WeakPolarHBondContact CB-OG 3.19Å
438	V	97	Very high	87.1	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.8	-179.1	71.8	0	0	0	0	110.9	F340 Y345 I420 V440	F340-V438 HydrophobicContact CD1-CB 4.14Å; F340-V438 HydrophobicContact CD1-CG1 3.65Å; F340-V438 HydrophobicContact CD2-CB 3.76Å; F340-V438 HydrophobicContact CD2-CG1 4.09Å; F340-V438 HydrophobicContact CE1-CB 4.23Å; F340-V438 HydrophobicContact CE1-CG1 3.46Å; F340-V438 VanDerWaalsContact CE1-CG1 3.46Å; F340-V438 HydrophobicContact CE2-CB 3.87Å; F340-V438 HydrophobicContact CE2-CG1 3.93Å; F340-V438 HydrophobicContact CG-CB 3.89Å; F340-V438 HydrophobicContact CG-CG1 3.95Å; F340-V438 HydrophobicContact CG-CG2 4.45Å; F340-V438 HydrophobicContact CZ-CB 4.09Å; F340-V438 HydrophobicContact CZ-CG1 3.6Å; Y345-V438 HydrophobicContact CD2-CG1 4.03Å; Y345-V438 HydrophobicContact CD2-CG2 3.8Å; Y345-V438 HydrophobicContact CE2-CG1 4.14Å; Y345-V438 HydrophobicContact CE2-CG2 3.96Å; I420-V438 HydrophobicContact CB-CG1 4.37Å; I420-V438 PolarHBondContact N-O 2.9Å; I420-V438 PolarHBondContact O-N 2.68Å; V438-V440 HydrophobicContact CG1-CG2 4.2Å
439	P	97.9	Very high	87	Confident	59 Å²	59	58.8 Å²	58.8	38%	0.383	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.2	169.9	30.4	-33.4	0	0	0	110.7	S343 S344 Y345 L418	S343-P439 WeakPolarHBondContact O-CD 3.44Å; S344-P439 WeakPolarHBondContact CA-O 3.41Å; Y345-P439 PolarHBondContact N-O 2.85Å; Y345-P439 VanDerWaalsContact N-O 3.08Å; L418-P439 WeakPolarHBondContact O-CA 3.22Å
440	V	98.2	Very high	87.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.9	175.1	-176	0	0	0	0	109.7	Y345 L359 I361 L402 L418 I420 V438 V442	Y345-V440 HydrophobicContact CD2-CG2 4.41Å; Y345-V440 WeakPolarHBondContact O-CA 3.18Å; L359-V440 HydrophobicContact CD2-CG1 3.65Å; I361-V440 HydrophobicContact CD1-CG2 4.18Å; L402-V440 HydrophobicContact CD2-CG1 4.18Å; L418-V440 HydrophobicContact CB-CB 4.31Å; L418-V440 PolarHBondContact N-O 2.69Å; L418-V440 PolarHBondContact O-N 3.39Å; I420-V440 HydrophobicContact CD1-CB 4.35Å; I420-V440 HydrophobicContact CD1-CG2 3.81Å; I420-V440 HydrophobicContact CG1-CG2 4.19Å; V438-V440 HydrophobicContact CG1-CG2 4.2Å; V440-V442 HydrophobicContact CG1-CG2 4.5Å
441	E	97.8	Very high	88.4	Confident	39 Å²	39	52.5 Å²	52.5	18%	0.182	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.5	175.1	171.7	167.8	167.6	0	0	109.8	Y345 K346 T347 K415 M417	Y345-E441 PolarHBondContact O-N 3.15Å; K346-E441 CarbonylContact C-O 3.52Å; K346-E441 WeakPolarHBondContact CA-O 3.46Å; K346-E441 HydrophobicContact CD-CB 4.32Å; K346-E441 HydrophobicContact CD-CG 4.32Å; K346-E441 WeakPolarHBondContact CE-OE2 3.41Å; K346-E441 HydrophobicContact CG-CB 4.12Å; K346-E441 VanDerWaalsContact NZ-CD 3.31Å; K346-E441 IonicContact NZ-OE1 2.95Å; K346-E441 PolarHBondContact NZ-OE1 2.7Å; K346-E441 IonicContact NZ-OE2 3.03Å; K346-E441 PolarHBondContact NZ-OE2 2.64Å; T347-E441 PolarHBondContact N-O 2.71Å; K415-E441 HydrophobicContact CD-CG 4.36Å; K415-E441 VanDerWaalsContact CE-CD 3.43Å; K415-E441 WeakPolarHBondContact CE-OE1 3.45Å; K415-E441 IonicContact NZ-OE1 3.23Å; K415-E441 PolarHBondContact NZ-OE1 2.81Å; K415-E441 IonicContact NZ-OE2 2.67Å; K415-E441 PolarHBondContact NZ-OE2 2.89Å; M417-E441 HydrophobicContact CE-CB 4.15Å; M417-E441 HydrophobicContact SD-CB 3.87Å; M417-E441 HydrophobicContact SD-CG 4.07Å
442	V	97.4	Very high	89.9	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.1	169.7	-174.3	0	0	0	0	107.8	T347 V349 I358 F389 K415 V416 L418 V440	T347-V442 HydrophobicContact CG2-CG1 4.35Å; T347-V442 HydrophobicContact CG2-CG2 4.04Å; T347-V442 WeakPolarHBondContact O-CA 3.18Å; V349-V442 HydrophobicContact CG1-CG1 3.86Å; I358-V442 HydrophobicContact CD1-CG1 4.14Å; I358-V442 HydrophobicContact CD1-CG2 4.16Å; F389-V442 HydrophobicContact CE1-CB 4.36Å; F389-V442 HydrophobicContact CE1-CG1 4.02Å; F389-V442 HydrophobicContact CE1-CG2 3.99Å; F389-V442 HydrophobicContact CZ-CB 4.23Å; F389-V442 HydrophobicContact CZ-CG1 4.08Å; F389-V442 HydrophobicContact CZ-CG2 4.18Å; K415-V442 WeakPolarHBondContact CA-O 3.34Å; V416-V442 HydrophobicContact CB-CB 4.43Å; V416-V442 PolarHBondContact N-O 3.18Å; V416-V442 PolarHBondContact O-N 3.33Å; L418-V442 HydrophobicContact CD1-CG2 4.08Å; L418-V442 HydrophobicContact CG-CG2 4.48Å; V440-V442 HydrophobicContact CG1-CG2 4.5Å
443	A	96.5	Very high	91.5	Very high	28 Å²	28	48.9 Å²	48.9	23%	0.231	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	132.7	168.1	0	0	0	0	0	109.2	T347 T348 V349	T347-A443 PolarHBondContact O-N 3.21Å; T348-A443 CarbonylContact C-O 3.52Å; T348-A443 VanDerWaalsContact CA-O 3.32Å; T348-A443 WeakPolarHBondContact CA-O 3.5Å; T348-A443 HydrophobicContact CG2-CB 4.33Å; V349-A443 PolarHBondContact N-O 2.97Å
444	V	96.1	Very high	92.6	Very high	6 Å²	6	51.8 Å²	51.8	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.7	170.9	-177.2	0	0	0	0	107.6	V349 E351 L408 Y410 T413 K414	V349-V444 CarbonylContact O-C 3.51Å; V349-V444 WeakPolarHBondContact O-CA 3.45Å; E351-V444 HydrophobicContact CB-CG1 3.9Å; L408-V444 HydrophobicContact CB-CG1 4.44Å; L408-V444 HydrophobicContact CB-CG2 4.1Å; L408-V444 HydrophobicContact CD1-CG2 3.8Å; L408-V444 HydrophobicContact CG-CG2 4.44Å; Y410-V444 HydrophobicContact CD2-CB 4.19Å; Y410-V444 HydrophobicContact CD2-CG1 4.14Å; Y410-V444 VanDerWaalsContact CD2-O 3.31Å; Y410-V444 WeakPolarHBondContact CD2-O 3.41Å; Y410-V444 VanDerWaalsContact CE2-O 3.25Å; Y410-V444 WeakPolarHBondContact CE2-O 3.38Å; T413-V444 WeakPolarHBondContact O-CG2 3.11Å; K414-V444 PolarHBondContact O-N 2.84Å
445	T	94.9	Very high	93.3	Very high	56 Å²	56	47.1 Å²	47.1	34%	0.344	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.5	175.7	58.8	0	0	0	0	110.6	T348 V349 P350 E351 V447	T348-T445 HydrophobicContact CG2-CG2 4.4Å; V349-T445 PolarHBondContact O-N 3.44Å; V349-T445 PolarHBondContact O-OG1 3.17Å; P350-T445 WeakPolarHBondContact CA-OG1 3.22Å; E351-T445 PolarHBondContact N-O 3.12Å; T445-V447 WeakPolarHBondContact O-CG2 3.28Å
446	D	92.9	Very high	93.5	Very high	85 Å²	85	47.3 Å²	47.3	46%	0.455	27%	0.273	S	S	.	.			trans	-26.8	125.6	161.5	-161.1	-49.2	0	0	0	114.1	E351 Y410	E351-D446 VanDerWaalsContact OE1-CA 3.28Å; E351-D446 WeakPolarHBondContact OE1-CA 2.87Å; Y410-D446 HydrophobicContact CD1-CB 3.6Å; Y410-D446 HydrophobicContact CE1-CB 3.45Å; Y410-D446 VanDerWaalsContact CE1-CB 3.45Å; Y410-D446 WeakPolarHBondContact CE1-OD2 2.92Å; Y410-D446 HydrophobicContact CE2-CB 4.46Å; Y410-D446 HydrophobicContact CG-CB 4.22Å
447	V	91.6	Very high	93.9	Very high	69 Å²	69	46 Å²	46	42%	0.418	27%	0.271	S	S	.	.			trans	-140.5	84.2	171.4	-171.6	0	0	0	0	111.3	P350 E351 T445 E449	P350-V447 HydrophobicContact CB-CG2 3.79Å; E351-V447 HydrophobicContact CG-CB 4.06Å; E351-V447 HydrophobicContact CG-CG2 4.22Å; E351-V447 PolarHBondContact OE1-N 2.88Å; T445-V447 WeakPolarHBondContact O-CG2 3.28Å; V447-E449 WeakPolarHBondContact O-CG 3.24Å; V447-E449 PolarHBondContact O-N 3.27Å
448	D	88.9	Confident	93.9	Very high	67 Å²	67	44.6 Å²	44.6	36%	0.358	26%	0.26	S	S	.	.			trans	-0.5	90.5	159.2	-174.7	77.6	0	0	0	113	E481 T537 K539	D448-E481 WeakPolarHBondContact CA-OE1 3.4Å; D448-T537 PolarHBondContact OD1-OG1 3.36Å; D448-T537 PolarHBondContact OD2-OG1 2.82Å; D448-K539 PolarHBondContact O-NZ 2.92Å; D448-K539 IonicContact OD2-NZ 2.6Å; D448-K539 PolarHBondContact OD2-NZ 2.84Å
449	E	89.1	Confident	93.8	Very high	60 Å²	60	53 Å²	53	28%	0.28	29%	0.291	S	S	.	.			trans	-82.1	-146.4	-179.2	-62	-146.6	75.4	0	0	109.4	N352 V447 P480 E481 K539	N352-E449 VanDerWaalsContact ND2-CD 3.28Å; N352-E449 PolarHBondContact ND2-OE1 3.27Å; V447-E449 WeakPolarHBondContact O-CG 3.24Å; V447-E449 PolarHBondContact O-N 3.27Å; E449-P480 HydrophobicContact CB-CG 4.05Å; E449-E481 WeakPolarHBondContact CB-OE1 3.31Å; E449-E481 PolarHBondContact N-OE1 3.17Å; E449-K539 WeakPolarHBondContact O-CB 3.29Å; E449-K539 WeakPolarHBondContact O-CG 3.4Å
450	G	89.8	Confident	93.7	Very high	18 Å²	18	52.2 Å²	52.2	19%	0.186	28%	0.281	C	S	.	.			trans	-139.6	158.6	168.9	0	0	0	0	0	110	E452	G450-E452 PolarHBondContact O-N 2.79Å; G450-E452 VanDerWaalsContact O-N 3.1Å
451	P	93.8	Very high	93.5	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.006	31%	0.307	C	S	.	.			trans	-61.8	115.3	-170.1	22.5	-35	0	0	0	111.5	A477 I478 I488 A533 D535 G541	P451-A477 HydrophobicContact CB-CB 4.06Å; P451-I478 CarbonylContact C-O 3.55Å; P451-I478 VanDerWaalsContact CA-O 3.3Å; P451-I478 WeakPolarHBondContact CA-O 3.25Å; P451-I488 HydrophobicContact CB-CD1 3.57Å; P451-I488 HydrophobicContact CB-CG1 4.09Å; P451-I488 HydrophobicContact CB-CG2 4.33Å; P451-I488 HydrophobicContact CG-CD1 4.46Å; P451-I488 HydrophobicContact CG-CG1 4.5Å; P451-I488 HydrophobicContact CG-CG2 4.29Å; P451-A533 HydrophobicContact CB-CB 4.05Å; P451-A533 HydrophobicContact CG-CB 3.72Å; P451-D535 WeakPolarHBondContact CD-OD2 3.46Å; P451-D535 HydrophobicContact CG-CB 4.16Å; P451-G541 VanDerWaalsContact O-CA 3.26Å; P451-G541 WeakPolarHBondContact O-CA 3.24Å; P451-G541 PolarHBondContact O-N 2.88Å
452	E	92.6	Very high	93.3	Very high	84 Å²	84	55.1 Å²	55.1	39%	0.393	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	154.7	-177.8	64.1	160.1	177.8	0	0	112.3	G450 L454 A477 I478	G450-E452 PolarHBondContact O-N 2.79Å; G450-E452 VanDerWaalsContact O-N 3.1Å; E452-L454 HydrophobicContact CG-CG 4.26Å; E452-L454 WeakPolarHBondContact OE1-CD1 3.46Å; E452-L454 WeakPolarHBondContact OE2-CD2 3.44Å; E452-A477 CarbonylContact O-C 3.51Å; E452-A477 WeakPolarHBondContact O-CA 3.29Å; E452-A477 VanDerWaalsContact O-CB 3.31Å; E452-A477 WeakPolarHBondContact O-CB 3.49Å; E452-I478 PolarHBondContact N-O 3Å; E452-I478 PolarHBondContact O-N 2.77Å
453	F	93.4	Very high	93	Very high	7 Å²	7	59 Å²	59	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.8	172.2	-70.4	-93.1	0	0	0	109.3	P455 P456 Y475 A477 Y490 V531 A533 G543	F453-P455 VanDerWaalsContact C-C 3.49Å; F453-P455 CarbonylContact C-O 3.53Å; F453-P455 CarbonylContact O-C 3.47Å; F453-P456 VanDerWaalsContact O-CA 3.28Å; F453-P456 WeakPolarHBondContact O-CA 3.39Å; F453-P456 WeakPolarHBondContact O-CD 2.88Å; F453-Y475 HydrophobicContact CB-CE1 4.46Å; F453-Y475 HydrophobicContact CB-CE2 4.09Å; F453-Y475 WeakPolarHBondContact CB-OH 3.09Å; F453-Y475 AromaticContact CD1-CD1 3.76Å; F453-Y475 HydrophobicContact CD1-CD1 3.76Å; F453-Y475 AromaticContact CD1-CD2 3.98Å; F453-Y475 HydrophobicContact CD1-CD2 3.98Å; F453-Y475 AromaticContact CD1-CE1 3.45Å; F453-Y475 HydrophobicContact CD1-CE1 3.45Å; F453-Y475 VanDerWaalsContact CD1-CE1 3.45Å; F453-Y475 AromaticContact CD1-CE2 3.66Å; F453-Y475 HydrophobicContact CD1-CE2 3.66Å; F453-Y475 HydrophobicContact CD1-CG 4.05Å; F453-Y475 AromaticContact CD1-CZ 3.4Å; F453-Y475 VanDerWaalsContact CD1-CZ 3.4Å; F453-Y475 AromaticContact CE1-CD1 3.67Å; F453-Y475 HydrophobicContact CE1-CD1 3.67Å; F453-Y475 AromaticContact CE1-CE1 3.71Å; F453-Y475 HydrophobicContact CE1-CE1 3.71Å; F453-Y475 HydrophobicContact CE1-CG 4.12Å; F453-Y475 AromaticContact CG-CE1 3.99Å; F453-Y475 HydrophobicContact CG-CE1 3.99Å; F453-Y475 HydrophobicContact CG-CE2 4.25Å; F453-Y475 AromaticContact CG-CZ 3.74Å; F453-Y475 HydrophobicContact CZ-CE1 4.44Å; F453-A477 HydrophobicContact CD1-CB 3.97Å; F453-A477 HydrophobicContact CD2-CB 4.17Å; F453-A477 HydrophobicContact CE1-CB 3.88Å; F453-A477 HydrophobicContact CE2-CB 4.08Å; F453-A477 HydrophobicContact CG-CB 4.13Å; F453-A477 HydrophobicContact CZ-CB 3.94Å; F453-Y490 HydrophobicContact CE1-CD1 4.37Å; F453-Y490 HydrophobicContact CE1-CE1 4.04Å; F453-Y490 HydrophobicContact CZ-CD1 4.26Å; F453-Y490 HydrophobicContact CZ-CE1 4.19Å; F453-V531 HydrophobicContact CE1-CG1 4.49Å; F453-V531 HydrophobicContact CZ-CB 4.31Å; F453-V531 HydrophobicContact CZ-CG1 4.04Å; F453-A533 HydrophobicContact CE2-CB 3.68Å; F453-A533 HydrophobicContact CZ-CB 3.73Å; F453-G543 VanDerWaalsContact CD2-N 3.28Å
454	L	88.6	Confident	92.7	Very high	107 Å²	107	58 Å²	58	56%	0.56	31%	0.31	S	S	*	.	S	Bend	trans	-112.2	102.3	174.5	-66.3	-178.8	0	0	0	109.7	E452	E452-L454 HydrophobicContact CG-CG 4.26Å; E452-L454 WeakPolarHBondContact OE1-CD1 3.46Å; E452-L454 WeakPolarHBondContact OE2-CD2 3.44Å
455	P	92.6	Very high	92.4	Very high	73 Å²	73	61.6 Å²	61.6	47%	0.474	33%	0.329	S	S	.	.	S	Bend	cis	-80.3	157.4	1.4	33.5	-36.8	0	0	0	114.4	F453 T457 Y475	F453-P455 VanDerWaalsContact C-C 3.49Å; F453-P455 CarbonylContact C-O 3.53Å; F453-P455 CarbonylContact O-C 3.47Å; P455-T457 WeakPolarHBondContact CG-O 3.48Å; P455-T457 PolarHBondContact O-N 3.08Å; P455-T457 VanDerWaalsContact O-N 3.12Å; P455-Y475 WeakPolarHBondContact O-CE2 3.41Å; P455-Y475 PolarHBondContact O-OH 3.15Å
456	P	92.6	Very high	92.1	Very high	85 Å²	85	60.8 Å²	60.8	55%	0.552	32%	0.322	S	S	*	.	S	Bend	trans	-71.8	-6.4	179.3	29.4	-37	0	0	0	113.2	F453 Y475 T544	F453-P456 VanDerWaalsContact O-CA 3.28Å; F453-P456 WeakPolarHBondContact O-CA 3.39Å; F453-P456 WeakPolarHBondContact O-CD 2.88Å; P456-Y475 VanDerWaalsContact C-OH 3.25Å; P456-Y475 PolarHBondContact O-OH 2.81Å; P456-T544 PolarHBondContact O-N 3.33Å
457	T	94.9	Very high	92	Very high	67 Å²	67	60.9 Å²	60.9	41%	0.411	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	120.7	165.3	-56.9	0	0	0	0	109.6	P455 T544 V546	P455-T457 WeakPolarHBondContact CG-O 3.48Å; P455-T457 PolarHBondContact O-N 3.08Å; P455-T457 VanDerWaalsContact O-N 3.12Å; T457-T544 CarbonylContact C-O 3.6Å; T457-T544 VanDerWaalsContact CA-O 3.25Å; T457-T544 WeakPolarHBondContact CA-O 3.22Å; T457-T544 HydrophobicContact CG2-CG2 4.31Å; T457-V546 HydrophobicContact CG2-CG2 3.69Å
458	V	95.1	Very high	92	Very high	23 Å²	23	62.3 Å²	62.3	14%	0.139	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	154.5	172.1	69.9	0	0	0	0	110.2	Y460 Y475 T544 V545 V546	V458-Y460 HydrophobicContact CB-CE2 4.42Å; V458-Y460 HydrophobicContact CG1-CD2 4.29Å; V458-Y460 HydrophobicContact CG1-CE2 3.53Å; V458-Y460 HydrophobicContact CG2-CE1 4.3Å; V458-Y460 HydrophobicContact CG2-CE2 3.97Å; V458-Y475 HydrophobicContact CB-CD2 3.76Å; V458-Y475 HydrophobicContact CB-CE2 3.65Å; V458-Y475 HydrophobicContact CG1-CD1 4.05Å; V458-Y475 HydrophobicContact CG1-CD2 3.36Å; V458-Y475 HydrophobicContact CG1-CE1 4.16Å; V458-Y475 HydrophobicContact CG1-CE2 3.53Å; V458-Y475 HydrophobicContact CG1-CG 3.63Å; V458-Y475 HydrophobicContact CG2-CD2 4.43Å; V458-T544 PolarHBondContact N-O 2.74Å; V458-V545 HydrophobicContact CG1-CB 4.13Å; V458-V545 HydrophobicContact CG1-CG1 4.06Å; V458-V545 HydrophobicContact CG1-CG2 3.74Å; V458-V546 PolarHBondContact O-N 2.92Å
459	R	95	Very high	91.9	Very high	179 Å²	179	61.8 Å²	61.8	68%	0.675	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.5	175.4	-60.5	-172.7	170.3	-124.6	-4.4	109.6	V546	R459-V546 WeakPolarHBondContact CA-O 3.4Å; R459-V546 HydrophobicContact CG-CB 4.21Å
460	Y	95.3	Very high	92.1	Very high	42 Å²	42	61 Å²	61	17%	0.165	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146	167.1	-59.8	-74.6	0	0	0	109.3	V458 I472 M474 L509 V545 V546 L547 V548	V458-Y460 HydrophobicContact CB-CE2 4.42Å; V458-Y460 HydrophobicContact CG1-CD2 4.29Å; V458-Y460 HydrophobicContact CG1-CE2 3.53Å; V458-Y460 HydrophobicContact CG2-CE1 4.3Å; V458-Y460 HydrophobicContact CG2-CE2 3.97Å; Y460-I472 HydrophobicContact CD1-CG2 4.43Å; Y460-I472 HydrophobicContact CD2-CG2 4.01Å; Y460-I472 HydrophobicContact CG-CG2 3.79Å; Y460-M474 VanDerWaalsContact OH-C 3.25Å; Y460-M474 PolarHBondContact OH-O 2.79Å; Y460-L509 HydrophobicContact CD2-CD1 4.1Å; Y460-L509 HydrophobicContact CE2-CD1 3.56Å; Y460-V545 HydrophobicContact CD2-CG1 3.57Å; Y460-V545 HydrophobicContact CE2-CG1 3.79Å; Y460-V546 PolarHBondContact N-O 2.99Å; Y460-L547 HydrophobicContact CD2-CD2 4.45Å; Y460-L547 WeakPolarHBondContact O-CA 3.38Å; Y460-V548 PolarHBondContact O-N 2.85Å
461	V	94.3	Very high	92.3	Very high	91 Å²	91	64 Å²	64	55%	0.552	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.3	168.8	-174.4	0	0	0	0	106.9	V548 E550	V461-V548 WeakPolarHBondContact CA-O 3.33Å; V461-V548 HydrophobicContact CG2-CB 4.41Å; V461-E550 HydrophobicContact CG1-CG 3.54Å; V461-E550 WeakPolarHBondContact CG1-OE1 3.44Å
462	V	94	Very high	92.4	Very high	9 Å²	9	65.1 Å²	65.1	6%	0.055	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.4	179.3	-65.4	0	0	0	0	108.6	L466 I472 I515 L547 V548 I549 E550	V462-L466 HydrophobicContact CB-CD1 4.23Å; V462-I472 HydrophobicContact CG1-CB 4.42Å; V462-I472 HydrophobicContact CG1-CD1 4.49Å; V462-I472 HydrophobicContact CG1-CG1 4.11Å; V462-I472 HydrophobicContact CG1-CG2 3.69Å; V462-I515 HydrophobicContact CG2-CD1 4.25Å; V462-L547 HydrophobicContact CG1-CD2 4.49Å; V462-L547 HydrophobicContact CG2-CB 4.14Å; V462-L547 HydrophobicContact CG2-CD1 4.31Å; V462-V548 PolarHBondContact N-O 2.61Å; V462-I549 HydrophobicContact CG2-CG1 4.14Å; V462-I549 CarbonylContact O-C 3.5Å; V462-I549 WeakPolarHBondContact O-CA 3.38Å; V462-E550 PolarHBondContact O-N 2.88Å
463	Q	91	Very high	92.4	Very high	82 Å²	82	62 Å²	62	38%	0.383	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	153.3	164.4	-55.7	-166.8	-85.2	0	0	109.2	L466 E550 E552	Q463-L466 HydrophobicContact CB-CG 4.33Å; Q463-L466 WeakPolarHBondContact O-CD1 3.26Å; Q463-L466 VanDerWaalsContact O-CG 3.27Å; Q463-L466 WeakPolarHBondContact O-CG 3.32Å; Q463-E550 HydrophobicContact CG-CB 4.36Å; Q463-E552 PolarHBondContact NE2-OE1 2.86Å
464	E	91	Very high	92.3	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.028	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	177.3	167.3	70	-169.4	127	0	0	112.6	L466 I515 R517 I549 E550 D551 E552	E464-L466 PolarHBondContact O-N 2.88Å; E464-I515 HydrophobicContact CB-CG2 4.4Å; E464-R517 WeakPolarHBondContact OE2-CB 3.36Å; E464-R517 PolarHBondContact OE2-N 2.85Å; E464-I549 HydrophobicContact CB-CG2 3.82Å; E464-E550 PolarHBondContact N-O 2.83Å; E464-D551 WeakPolarHBondContact OE1-CA 3.24Å; E464-E552 HydrophobicContact CG-CB 4.09Å; E464-E552 HydrophobicContact CG-CG 4.48Å; E464-E552 PolarHBondContact OE1-N 3.41Å
465	N	88.4	Confident	92.5	Very high	83 Å²	83	63.4 Å²	63.4	44%	0.444	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	11.1	-179.4	-81.2	-64.9	0	0	0	115.6	I515 D554	N465-I515 PolarHBondContact N-O 2.99Å; N465-D554 PolarHBondContact ND2-OD2 2.8Å
466	L	90.5	Very high	92.5	Very high	38 Å²	38	65 Å²	65	20%	0.199	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-58.6	140.2	177.9	-78.4	174.6	0	0	0	111.8	V462 Q463 E464 T470 V511	V462-L466 HydrophobicContact CB-CD1 4.23Å; Q463-L466 HydrophobicContact CB-CG 4.33Å; Q463-L466 WeakPolarHBondContact O-CD1 3.26Å; Q463-L466 VanDerWaalsContact O-CG 3.27Å; Q463-L466 WeakPolarHBondContact O-CG 3.32Å; E464-L466 PolarHBondContact O-N 2.88Å; L466-T470 HydrophobicContact CD1-CG2 4.27Å; L466-T470 HydrophobicContact CD2-CG2 4.44Å; L466-V511 HydrophobicContact CB-CG2 4.24Å; L466-V511 HydrophobicContact CD1-CG2 4.5Å
467	P	90.5	Very high	92.5	Very high	87 Å²	87	61 Å²	61	57%	0.565	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-68.6	139.7	-177.8	26.4	-32.4	0	0	0	112	G469 T470	P467-G469 PolarHBondContact O-N 2.84Å; P467-T470 WeakPolarHBondContact CG-OG1 3.03Å; P467-T470 WeakPolarHBondContact O-CB 3.46Å; P467-T470 PolarHBondContact O-N 3.35Å; P467-T470 PolarHBondContact O-OG1 2.76Å
468	N	90.5	Very high	92.4	Very high	100 Å²	100	60.1 Å²	60.1	54%	0.535	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	131.2	174.9	-66.2	-4.3	0	0	0	110.9	V511 T512 N513	N468-V511 CarbonylContact C-O 3.51Å; N468-V511 WeakPolarHBondContact CA-O 3.36Å; N468-T512 PolarHBondContact ND2-O 3.31Å; N468-N513 WeakPolarHBondContact OD1-CA 3.4Å
469	G	88.3	Confident	92.3	Very high	56 Å²	56	60.7 Å²	60.7	58%	0.577	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	-8.7	-172.5	0	0	0	0	0	114.6	P467 V471 V511	P467-G469 PolarHBondContact O-N 2.84Å; G469-V471 PolarHBondContact O-N 3.18Å; G469-V511 PolarHBondContact N-O 2.81Å
470	T	92.8	Very high	92	Very high	43 Å²	43	53 Å²	53	26%	0.264	30%	0.299	S	S	.	.			trans	-60.8	131.2	172.3	-59.1	0	0	0	0	111	L466 P467 T510 V511	L466-T470 HydrophobicContact CD1-CG2 4.27Å; L466-T470 HydrophobicContact CD2-CG2 4.44Å; P467-T470 WeakPolarHBondContact CG-OG1 3.03Å; P467-T470 WeakPolarHBondContact O-CB 3.46Å; P467-T470 PolarHBondContact O-N 3.35Å; P467-T470 PolarHBondContact O-OG1 2.76Å; T470-T510 CarbonylContact O-C 3.47Å; T470-T510 VanDerWaalsContact O-CA 3.25Å; T470-T510 WeakPolarHBondContact O-CA 3.43Å; T470-V511 PolarHBondContact O-N 2.67Å
471	V	94.4	Very high	91.7	Very high	81 Å²	81	53.7 Å²	53.7	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	125.7	174.9	-179.9	0	0	0	0	109.8	G469 E508 T510	G469-V471 PolarHBondContact O-N 3.18Å; V471-E508 HydrophobicContact CG1-CG 3.88Å; V471-T510 HydrophobicContact CG2-CG2 4.12Å
472	I	94.3	Very high	91.3	Very high	25 Å²	25	53.6 Å²	53.6	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-40.2	177.6	-60.8	170.4	0	0	0	110.5	Y460 V462 V500 L509 V511 L547	Y460-I472 HydrophobicContact CD1-CG2 4.43Å; Y460-I472 HydrophobicContact CD2-CG2 4.01Å; Y460-I472 HydrophobicContact CG-CG2 3.79Å; V462-I472 HydrophobicContact CG1-CB 4.42Å; V462-I472 HydrophobicContact CG1-CD1 4.49Å; V462-I472 HydrophobicContact CG1-CG1 4.11Å; V462-I472 HydrophobicContact CG1-CG2 3.69Å; I472-V500 HydrophobicContact CD1-CG1 4.25Å; I472-V500 HydrophobicContact CD1-CG2 3.82Å; I472-L509 HydrophobicContact CB-CB 4.11Å; I472-L509 PolarHBondContact N-O 2.91Å; I472-V511 HydrophobicContact CD1-CG2 4.07Å; I472-V511 HydrophobicContact CG1-CG2 4.01Å; I472-L547 HydrophobicContact CG2-CD2 4.07Å
473	G	92.1	Very high	90.9	Very high	17 Å²	17	59.3 Å²	59.3	18%	0.175	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-172.7	-178.6	0	0	0	0	0	112.5	L509	G473-L509 PolarHBondContact O-N 3.07Å
474	M	91.8	Very high	90.8	Very high	138 Å²	138	57.3 Å²	57.3	68%	0.68	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.1	171.2	-63.5	-177.2	-67.1	0	0	109.4	Y460	Y460-M474 VanDerWaalsContact OH-C 3.25Å; Y460-M474 PolarHBondContact OH-O 2.79Å
475	Y	93.7	Very high	90.6	Very high	7 Å²	7	58.5 Å²	58.5	3%	0.027	34%	0.338	C	S	.	.			trans	-111.2	111.8	170.2	-171.7	-138.4	0	0	0	110	F453 P455 P456 V458 G507 V531 G543 V545	F453-Y475 HydrophobicContact CB-CE1 4.46Å; F453-Y475 HydrophobicContact CB-CE2 4.09Å; F453-Y475 WeakPolarHBondContact CB-OH 3.09Å; F453-Y475 AromaticContact CD1-CD1 3.76Å; F453-Y475 HydrophobicContact CD1-CD1 3.76Å; F453-Y475 AromaticContact CD1-CD2 3.98Å; F453-Y475 HydrophobicContact CD1-CD2 3.98Å; F453-Y475 AromaticContact CD1-CE1 3.45Å; F453-Y475 HydrophobicContact CD1-CE1 3.45Å; F453-Y475 VanDerWaalsContact CD1-CE1 3.45Å; F453-Y475 AromaticContact CD1-CE2 3.66Å; F453-Y475 HydrophobicContact CD1-CE2 3.66Å; F453-Y475 HydrophobicContact CD1-CG 4.05Å; F453-Y475 AromaticContact CD1-CZ 3.4Å; F453-Y475 VanDerWaalsContact CD1-CZ 3.4Å; F453-Y475 AromaticContact CE1-CD1 3.67Å; F453-Y475 HydrophobicContact CE1-CD1 3.67Å; F453-Y475 AromaticContact CE1-CE1 3.71Å; F453-Y475 HydrophobicContact CE1-CE1 3.71Å; F453-Y475 HydrophobicContact CE1-CG 4.12Å; F453-Y475 AromaticContact CG-CE1 3.99Å; F453-Y475 HydrophobicContact CG-CE1 3.99Å; F453-Y475 HydrophobicContact CG-CE2 4.25Å; F453-Y475 AromaticContact CG-CZ 3.74Å; F453-Y475 HydrophobicContact CZ-CE1 4.44Å; P455-Y475 WeakPolarHBondContact O-CE2 3.41Å; P455-Y475 PolarHBondContact O-OH 3.15Å; P456-Y475 VanDerWaalsContact C-OH 3.25Å; P456-Y475 PolarHBondContact O-OH 2.81Å; V458-Y475 HydrophobicContact CB-CD2 3.76Å; V458-Y475 HydrophobicContact CB-CE2 3.65Å; V458-Y475 HydrophobicContact CG1-CD1 4.05Å; V458-Y475 HydrophobicContact CG1-CD2 3.36Å; V458-Y475 HydrophobicContact CG1-CE1 4.16Å; V458-Y475 HydrophobicContact CG1-CE2 3.53Å; V458-Y475 HydrophobicContact CG1-CG 3.63Å; V458-Y475 HydrophobicContact CG2-CD2 4.43Å; Y475-G507 PolarHBondContact N-O 2.56Å; Y475-G507 WeakPolarHBondContact O-CA 3.43Å; Y475-V531 HydrophobicContact CD1-CB 4.28Å; Y475-V531 HydrophobicContact CD1-CG2 4.28Å; Y475-G543 WeakPolarHBondContact OH-CA 3.39Å; Y475-V545 HydrophobicContact CD1-CG2 3.28Å; Y475-V545 HydrophobicContact CE1-CG2 3.72Å; Y475-V545 HydrophobicContact CG-CG2 3.91Å
476	K	92.3	Very high	90.5	Very high	107 Å²	107	60.9 Å²	60.9	47%	0.465	36%	0.355	S	S	.	.			trans	-123.4	135.7	-159.3	-179.3	-179.1	176.5	176.8	0	110.1	S485	K476-S485 WeakPolarHBondContact CE-OG 3.02Å; K476-S485 PolarHBondContact NZ-OG 3.1Å
477	A	93.4	Very high	90.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	162.2	172.9	0	0	0	0	0	111.1	P451 E452 F453 S485 I488 Y490 A533	P451-A477 HydrophobicContact CB-CB 4.06Å; E452-A477 CarbonylContact O-C 3.51Å; E452-A477 WeakPolarHBondContact O-CA 3.29Å; E452-A477 VanDerWaalsContact O-CB 3.31Å; E452-A477 WeakPolarHBondContact O-CB 3.49Å; F453-A477 HydrophobicContact CD1-CB 3.97Å; F453-A477 HydrophobicContact CD2-CB 4.17Å; F453-A477 HydrophobicContact CE1-CB 3.88Å; F453-A477 HydrophobicContact CE2-CB 4.08Å; F453-A477 HydrophobicContact CG-CB 4.13Å; F453-A477 HydrophobicContact CZ-CB 3.94Å; A477-S485 WeakPolarHBondContact O-CB 3.49Å; A477-I488 HydrophobicContact CB-CD1 4.29Å; A477-I488 WeakPolarHBondContact O-CD1 3.31Å; A477-Y490 HydrophobicContact CB-CE1 4.04Å; A477-Y490 PolarHBondContact N-OH 2.92Å; A477-Y490 PolarHBondContact O-OH 2.77Å; A477-A533 HydrophobicContact CB-CB 3.44Å; A477-A533 VanDerWaalsContact CB-CB 3.44Å
478	I	92.3	Very high	90.4	Very high	49 Å²	49	57.7 Å²	57.7	25%	0.251	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.2	177.5	-61.9	176.9	0	0	0	108	P451 E452 S484	P451-I478 CarbonylContact C-O 3.55Å; P451-I478 VanDerWaalsContact CA-O 3.3Å; P451-I478 WeakPolarHBondContact CA-O 3.25Å; E452-I478 PolarHBondContact N-O 3Å; E452-I478 PolarHBondContact O-N 2.77Å; I478-S484 CarbonylContact C-O 3.55Å; I478-S484 WeakPolarHBondContact CA-O 3.38Å
479	D	92.1	Very high	90.6	Very high	34 Å²	34	55.8 Å²	55.8	18%	0.182	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-72.4	114.7	167.3	164.1	-59.1	0	0	0	107	T482 N483 S484 I488	D479-T482 WeakPolarHBondContact OD1-CB 3.22Å; D479-T482 VanDerWaalsContact OD1-CG2 3.28Å; D479-T482 WeakPolarHBondContact OD1-CG2 3.24Å; D479-T482 PolarHBondContact OD1-N 2.79Å; D479-T482 PolarHBondContact OD1-OG1 2.82Å; D479-N483 WeakPolarHBondContact O-CA 3.38Å; D479-N483 PolarHBondContact O-N 3.09Å; D479-S484 PolarHBondContact N-O 3.33Å; D479-S484 PolarHBondContact O-N 2.92Å; D479-I488 HydrophobicContact CB-CD1 4.27Å
480	P	89.4	Confident	90.9	Very high	18 Å²	18	53.4 Å²	53.4	12%	0.117	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-34.5	-167.5	24	-31.1	0	0	0	113.1	E411 E449 N483	E411-P480 HydrophobicContact CG-CB 4.32Å; E411-P480 WeakPolarHBondContact CG-O 3.4Å; E449-P480 HydrophobicContact CB-CG 4.05Å; P480-N483 PolarHBondContact O-N 2.76Å
481	E	88.7	Confident	90.9	Very high	57 Å²	57	56.5 Å²	56.5	27%	0.266	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-44	-179.6	-60.9	74.6	-167.2	0	0	111.7	D448 E449	D448-E481 WeakPolarHBondContact CA-OE1 3.4Å; E449-E481 WeakPolarHBondContact CB-OE1 3.31Å; E449-E481 PolarHBondContact N-OE1 3.17Å
482	T	86.1	Confident	90.9	Very high	89 Å²	89	56.5 Å²	56.5	55%	0.546	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-12.4	178.5	67.9	0	0	0	0	113.4	D479 S484	D479-T482 WeakPolarHBondContact OD1-CB 3.22Å; D479-T482 VanDerWaalsContact OD1-CG2 3.28Å; D479-T482 WeakPolarHBondContact OD1-CG2 3.24Å; D479-T482 PolarHBondContact OD1-N 2.79Å; D479-T482 PolarHBondContact OD1-OG1 2.82Å; T482-S484 PolarHBondContact O-N 2.88Å; T482-S484 WeakPolarHBondContact OG1-CB 3.36Å; T482-S484 PolarHBondContact OG1-N 3.13Å
483	N	86.3	Confident	90.9	Very high	128 Å²	128	59.4 Å²	59.4	68%	0.684	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	43	-167.9	-166.4	0.1	0	0	0	111.7	D479 P480	D479-N483 WeakPolarHBondContact O-CA 3.38Å; D479-N483 PolarHBondContact O-N 3.09Å; P480-N483 PolarHBondContact O-N 2.76Å
484	S	87.3	Confident	90.9	Very high	40 Å²	40	61.4 Å²	61.4	28%	0.28	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-132.1	171.9	-171.5	-165.7	0	0	0	0	111.7	I478 D479 T482 V486	I478-S484 CarbonylContact C-O 3.55Å; I478-S484 WeakPolarHBondContact CA-O 3.38Å; D479-S484 PolarHBondContact N-O 3.33Å; D479-S484 PolarHBondContact O-N 2.92Å; T482-S484 PolarHBondContact O-N 2.88Å; T482-S484 WeakPolarHBondContact OG1-CB 3.36Å; T482-S484 PolarHBondContact OG1-N 3.13Å; S484-V486 PolarHBondContact OG-N 3.34Å
485	S	86.8	Confident	91	Very high	31 Å²	31	55.4 Å²	55.4	22%	0.217	31%	0.31	C	S	.	.			trans	-127.5	12.9	171.5	76.3	0	0	0	0	113.4	K476 A477 G487	K476-S485 WeakPolarHBondContact CE-OG 3.02Å; K476-S485 PolarHBondContact NZ-OG 3.1Å; A477-S485 WeakPolarHBondContact O-CB 3.49Å; S485-G487 PolarHBondContact O-N 3.33Å
486	V	86.2	Confident	90.8	Very high	133 Å²	133	58.8 Å²	58.8	81%	0.806	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	116.5	-173.8	177.6	0	0	0	0	108.4	S484	S484-V486 PolarHBondContact OG-N 3.34Å
487	G	86.5	Confident	90.7	Very high	51 Å²	51	54.4 Å²	54.4	53%	0.526	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-6.3	-175.6	0	0	0	0	0	114.7	S485	S485-G487 PolarHBondContact O-N 3.33Å
488	I	93.4	Very high	90.6	Very high	7 Å²	7	57.7 Å²	57.7	4%	0.036	34%	0.341	C	S	.	.			trans	-72.7	128.9	172.1	-57.2	176.5	0	0	0	110	P451 A477 D479 Y490 A533 V534	P451-I488 HydrophobicContact CB-CD1 3.57Å; P451-I488 HydrophobicContact CB-CG1 4.09Å; P451-I488 HydrophobicContact CB-CG2 4.33Å; P451-I488 HydrophobicContact CG-CD1 4.46Å; P451-I488 HydrophobicContact CG-CG1 4.5Å; P451-I488 HydrophobicContact CG-CG2 4.29Å; A477-I488 HydrophobicContact CB-CD1 4.29Å; A477-I488 WeakPolarHBondContact O-CD1 3.31Å; D479-I488 HydrophobicContact CB-CD1 4.27Å; I488-Y490 HydrophobicContact CB-CE2 4.15Å; I488-Y490 HydrophobicContact CG2-CD2 4.37Å; I488-Y490 HydrophobicContact CG2-CE1 4.23Å; I488-Y490 HydrophobicContact CG2-CE2 3.77Å; I488-A533 HydrophobicContact CG2-CB 3.72Å; I488-V534 CarbonylContact C-O 3.55Å; I488-V534 WeakPolarHBondContact CA-O 3.18Å
489	L	93.9	Very high	90.7	Very high	61 Å²	61	55.8 Å²	55.8	32%	0.319	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.2	172.1	-63.4	177	0	0	0	111.5	Y491 S504 A533 V534	L489-Y491 HydrophobicContact CB-CE2 3.64Å; L489-S504 CarbonylContact C-O 3.54Å; L489-S504 VanDerWaalsContact CA-O 3.24Å; L489-S504 WeakPolarHBondContact CA-O 3.5Å; L489-S504 WeakPolarHBondContact CD2-O 3.38Å; L489-A533 CarbonylContact O-C 3.58Å; L489-A533 WeakPolarHBondContact O-CA 3.33Å; L489-V534 PolarHBondContact N-O 2.84Å; L489-V534 PolarHBondContact O-N 2.86Å
490	Y	95	Very high	90.8	Very high	6 Å²	6	54.1 Å²	54.1	2%	0.024	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136	-173.7	-63	-95.1	0	0	0	112	F453 A477 I488 S504 V531 A533	F453-Y490 HydrophobicContact CE1-CD1 4.37Å; F453-Y490 HydrophobicContact CE1-CE1 4.04Å; F453-Y490 HydrophobicContact CZ-CD1 4.26Å; F453-Y490 HydrophobicContact CZ-CE1 4.19Å; A477-Y490 HydrophobicContact CB-CE1 4.04Å; A477-Y490 PolarHBondContact N-OH 2.92Å; A477-Y490 PolarHBondContact O-OH 2.77Å; I488-Y490 HydrophobicContact CB-CE2 4.15Å; I488-Y490 HydrophobicContact CG2-CD2 4.37Å; I488-Y490 HydrophobicContact CG2-CE1 4.23Å; I488-Y490 HydrophobicContact CG2-CE2 3.77Å; Y490-S504 PolarHBondContact N-O 3.12Å; Y490-S504 WeakPolarHBondContact O-CA 3.31Å; Y490-S504 WeakPolarHBondContact O-CB 3.25Å; Y490-V531 HydrophobicContact CD1-CG1 4.31Å; Y490-A533 HydrophobicContact CE1-CB 4.33Å
491	Y	93.6	Very high	91	Very high	107 Å²	107	53.9 Å²	53.9	42%	0.42	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	140	-176.8	-58.6	-89.3	0	0	0	111.1	L489 V531 K532 V534	L489-Y491 HydrophobicContact CB-CE2 3.64Å; Y491-V531 CarbonylContact O-C 3.59Å; Y491-V531 WeakPolarHBondContact O-CA 3.36Å; Y491-K532 PolarHBondContact N-O 2.81Å; Y491-K532 PolarHBondContact O-N 3.34Å; Y491-V534 HydrophobicContact CD2-CB 4.42Å; Y491-V534 HydrophobicContact CD2-CG2 3.76Å; Y491-V534 HydrophobicContact CE2-CB 3.99Å; Y491-V534 HydrophobicContact CE2-CG2 3.74Å
492	K	93.8	Very high	91.3	Very high	82 Å²	82	52.7 Å²	52.7	36%	0.357	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.5	172.4	-165.2	170.6	74.4	171.8	0	109.6	D495 V500 V502	K492-D495 HydrophobicContact CD-CB 3.54Å; K492-D495 WeakPolarHBondContact CD-OD2 3.46Å; K492-D495 WeakPolarHBondContact CE-OD2 3.44Å; K492-D495 HydrophobicContact CG-CB 4.01Å; K492-D495 IonicContact NZ-OD2 2.66Å; K492-D495 PolarHBondContact NZ-OD2 3.33Å; K492-V500 WeakPolarHBondContact CD-O 3.34Å; K492-V500 WeakPolarHBondContact CE-O 3.24Å; K492-V500 PolarHBondContact NZ-O 3.2Å; K492-V502 HydrophobicContact CB-CG2 3.94Å; K492-V502 HydrophobicContact CD-CG2 4.35Å; K492-V502 HydrophobicContact CG-CG2 4.25Å
493	V	93.2	Very high	91.7	Very high	86 Å²	86	51.1 Å²	51.1	52%	0.521	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-48.9	-178.7	178	0	0	0	0	111.5	T530 K532	V493-T530 PolarHBondContact N-O 2.84Å; V493-K532 HydrophobicContact CG2-CB 3.47Å; V493-K532 VanDerWaalsContact CG2-CB 3.47Å; V493-K532 HydrophobicContact CG2-CD 4.5Å
494	S	93.6	Very high	92	Very high	58 Å²	58	47.4 Å²	47.4	41%	0.406	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	133.6	175.7	-170.3	0	0	0	0	110.6	I529 T530	S494-I529 CarbonylContact O-C 3.54Å; S494-I529 VanDerWaalsContact O-CA 3.26Å; S494-I529 WeakPolarHBondContact O-CA 3.48Å; S494-I529 WeakPolarHBondContact O-CB 3.18Å; S494-T530 VanDerWaalsContact CB-OG1 3.29Å; S494-T530 WeakPolarHBondContact CB-OG1 3.48Å; S494-T530 PolarHBondContact N-OG1 2.87Å; S494-T530 VanDerWaalsContact N-OG1 3.11Å; S494-T530 PolarHBondContact O-N 3.33Å
495	D	93.1	Very high	92.1	Very high	12 Å²	12	50.9 Å²	50.9	6%	0.064	31%	0.307	C	S	.	.			trans	-160.9	84.3	177.2	172.5	16.8	0	0	0	107.2	K492 G497 S498 W499 V500 Y527 I529	K492-D495 HydrophobicContact CD-CB 3.54Å; K492-D495 WeakPolarHBondContact CD-OD2 3.46Å; K492-D495 WeakPolarHBondContact CE-OD2 3.44Å; K492-D495 HydrophobicContact CG-CB 4.01Å; K492-D495 IonicContact NZ-OD2 2.66Å; K492-D495 PolarHBondContact NZ-OD2 3.33Å; D495-G497 VanDerWaalsContact C-N 3.34Å; D495-G497 PolarHBondContact O-N 3.47Å; D495-S498 PolarHBondContact O-N 3.38Å; D495-S498 PolarHBondContact OD1-N 2.74Å; D495-S498 VanDerWaalsContact OD2-CA 3.23Å; D495-S498 WeakPolarHBondContact OD2-CA 3.35Å; D495-W499 PolarHBondContact OD1-N 2.82Å; D495-W499 PolarHBondContact OD2-N 3.5Å; D495-W499 VanDerWaalsContact OD2-N 3.09Å; D495-V500 PolarHBondContact OD2-N 3.15Å; D495-Y527 VanDerWaalsContact C-OH 3.26Å; D495-Y527 WeakPolarHBondContact OD1-CE1 3.36Å; D495-Y527 PolarHBondContact OD1-OH 2.86Å; D495-I529 HydrophobicContact CB-CB 4.33Å; D495-I529 HydrophobicContact CB-CG2 3.83Å
496	P	90.6	Very high	92.2	Very high	78 Å²	78	52.4 Å²	52.4	51%	0.506	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-40.2	-168.7	-31.5	36.7	0	0	0	116.6	L521 Y527	P496-L521 HydrophobicContact CB-CD1 4.3Å; P496-L521 HydrophobicContact CB-CD2 4.11Å; P496-Y527 HydrophobicContact CB-CE2 4.48Å; P496-Y527 VanDerWaalsContact CD-OH 3.29Å; P496-Y527 WeakPolarHBondContact CD-OH 3.33Å
497	G	88.8	Confident	92.4	Very high	15 Å²	15	46.1 Å²	46.1	16%	0.155	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.9	177.4	0	0	0	0	0	114.5	D495 W499 Y527	D495-G497 VanDerWaalsContact C-N 3.34Å; D495-G497 PolarHBondContact O-N 3.47Å; G497-W499 VanDerWaalsContact O-CD1 3.24Å; G497-W499 PolarHBondContact O-N 3.02Å; G497-Y527 PolarHBondContact N-OH 2.94Å
498	S	93	Very high	92.8	Very high	69 Å²	69	46.7 Å²	46.7	48%	0.483	27%	0.266	S	S	.	.			trans	54.3	36.4	-172.1	-65.2	0	0	0	0	113.5	D495 T512	D495-S498 PolarHBondContact O-N 3.38Å; D495-S498 PolarHBondContact OD1-N 2.74Å; D495-S498 VanDerWaalsContact OD2-CA 3.23Å; D495-S498 WeakPolarHBondContact OD2-CA 3.35Å; S498-T512 PolarHBondContact O-OG1 3.36Å
499	W	93.4	Very high	92.9	Very high	9 Å²	9	46.4 Å²	46.4	3%	0.034	26%	0.264	C	S	.	.			trans	-79.1	-26	-174.5	-63.2	-27	0	0	0	113.5	D495 G497 T512 N513 T514 I515 D516 L521 V522 Y527 I549	D495-W499 PolarHBondContact OD1-N 2.82Å; D495-W499 PolarHBondContact OD2-N 3.5Å; D495-W499 VanDerWaalsContact OD2-N 3.09Å; G497-W499 VanDerWaalsContact O-CD1 3.24Å; G497-W499 PolarHBondContact O-N 3.02Å; W499-T512 VanDerWaalsContact C-OG1 3.24Å; W499-T512 PolarHBondContact O-N 3.37Å; W499-T512 PolarHBondContact O-OG1 2.81Å; W499-T512 VanDerWaalsContact O-OG1 3.05Å; W499-N513 PolarHBondContact O-N 2.97Å; W499-T514 VanDerWaalsContact CD1-O 3.27Å; W499-T514 PolarHBondContact NE1-O 3.47Å; W499-I515 HydrophobicContact CB-CG1 3.91Å; W499-I515 HydrophobicContact CD2-CG1 4.4Å; W499-I515 HydrophobicContact CE3-CG1 4.39Å; W499-I515 HydrophobicContact CE3-CG2 4.42Å; W499-I515 HydrophobicContact CG-CG1 4.24Å; W499-D516 WeakPolarHBondContact CH2-O 3.4Å; W499-L521 HydrophobicContact CH2-CB 4.33Å; W499-L521 HydrophobicContact CZ2-CD1 4.41Å; W499-V522 HydrophobicContact CH2-CG2 3.67Å; W499-V522 HydrophobicContact CZ3-CG2 3.85Å; W499-Y527 HydrophobicContact CD2-CE1 4.28Å; W499-Y527 HydrophobicContact CD2-CE2 4.46Å; W499-Y527 AromaticContact CE3-CD1 3.65Å; W499-Y527 HydrophobicContact CE3-CD1 3.65Å; W499-Y527 AromaticContact CE3-CD2 3.8Å; W499-Y527 HydrophobicContact CE3-CD2 3.8Å; W499-Y527 AromaticContact CE3-CE1 3.52Å; W499-Y527 HydrophobicContact CE3-CE1 3.52Å; W499-Y527 AromaticContact CE3-CE2 3.7Å; W499-Y527 HydrophobicContact CE3-CE2 3.7Å; W499-Y527 AromaticContact CE3-CG 3.76Å; W499-Y527 HydrophobicContact CE3-CG 3.76Å; W499-Y527 AromaticContact CE3-CZ 3.53Å; W499-Y527 HydrophobicContact CH2-CD2 4.26Å; W499-Y527 HydrophobicContact CH2-CE2 4.32Å; W499-Y527 AromaticContact CZ3-CD1 4Å; W499-Y527 HydrophobicContact CZ3-CD1 4Å; W499-Y527 AromaticContact CZ3-CD2 3.4Å; W499-Y527 HydrophobicContact CZ3-CD2 3.4Å; W499-Y527 VanDerWaalsContact CZ3-CD2 3.4Å; W499-Y527 HydrophobicContact CZ3-CE1 4.17Å; W499-Y527 AromaticContact CZ3-CE2 3.62Å; W499-Y527 HydrophobicContact CZ3-CE2 3.62Å; W499-Y527 AromaticContact CZ3-CG 3.59Å; W499-Y527 HydrophobicContact CZ3-CG 3.59Å; W499-Y527 AromaticContact CZ3-CZ 3.98Å; W499-I549 HydrophobicContact CZ3-CD1 4.03Å
500	V	94.7	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.7	-173.2	-179.4	0	0	0	0	112.8	I472 K492 D495 L509 T510 T512 I529 L547	I472-V500 HydrophobicContact CD1-CG1 4.25Å; I472-V500 HydrophobicContact CD1-CG2 3.82Å; K492-V500 WeakPolarHBondContact CD-O 3.34Å; K492-V500 WeakPolarHBondContact CE-O 3.24Å; K492-V500 PolarHBondContact NZ-O 3.2Å; D495-V500 PolarHBondContact OD2-N 3.15Å; V500-L509 HydrophobicContact CG1-CB 4.12Å; V500-L509 HydrophobicContact CG1-CD2 4.32Å; V500-T510 CarbonylContact C-O 3.53Å; V500-T510 WeakPolarHBondContact CA-O 3.24Å; V500-T512 PolarHBondContact N-OG1 3.23Å; V500-I529 HydrophobicContact CB-CD1 3.68Å; V500-I529 HydrophobicContact CG1-CD1 3.6Å; V500-I529 HydrophobicContact CG2-CD1 3.94Å; V500-L547 HydrophobicContact CG2-CD1 3.84Å
501	G	92.9	Very high	93	Very high	13 Å²	13	44.7 Å²	44.7	13%	0.134	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	145.3	164.4	0	0	0	0	0	110.9	L509 T510 T512	G501-L509 WeakPolarHBondContact O-CA 3.35Å; G501-T510 PolarHBondContact N-O 3.15Å; G501-T510 PolarHBondContact O-N 3.07Å; G501-T512 VanDerWaalsContact CA-CG2 3.48Å; G501-T512 PolarHBondContact N-OG1 2.95Å
502	V	95.3	Very high	92.8	Very high	31 Å²	31	42.7 Å²	42.7	19%	0.188	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.4	171.7	-174.8	0	0	0	0	107.8	K492 S504 E508 L509 V531	K492-V502 HydrophobicContact CB-CG2 3.94Å; K492-V502 HydrophobicContact CD-CG2 4.35Å; K492-V502 HydrophobicContact CG-CG2 4.25Å; V502-S504 PolarHBondContact O-N 3.1Å; V502-E508 WeakPolarHBondContact CA-O 3.47Å; V502-L509 HydrophobicContact CB-CD2 4.43Å; V502-L509 HydrophobicContact CG1-CD2 4.26Å; V502-L509 HydrophobicContact CG2-CD2 3.83Å; V502-V531 HydrophobicContact CG1-CG1 4.11Å; V502-V531 HydrophobicContact CG2-CG2 4.21Å
503	N	94.4	Very high	92.7	Very high	57 Å²	57	42.1 Å²	42.1	31%	0.305	26%	0.257	S	S	.	.			trans	-74.2	115.8	174.8	-176.5	-29.9	0	0	0	109.6	N505 T506 G507 E508	N503-N505 PolarHBondContact O-N 3.05Å; N503-N505 PolarHBondContact OD1-N 3.07Å; N503-T506 VanDerWaalsContact CB-OG1 3.32Å; N503-T506 WeakPolarHBondContact CB-OG1 3.46Å; N503-T506 PolarHBondContact ND2-OG1 2.89Å; N503-T506 PolarHBondContact O-N 3.24Å; N503-G507 PolarHBondContact O-N 2.82Å; N503-E508 HydrophobicContact CB-CB 3.91Å; N503-E508 PolarHBondContact N-O 3.21Å
504	S	91.7	Very high	92.5	Very high	50 Å²	50	41.5 Å²	41.5	35%	0.35	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15	-170.5	62.2	0	0	0	0	115.2	L489 Y490 V502	L489-S504 CarbonylContact C-O 3.54Å; L489-S504 VanDerWaalsContact CA-O 3.24Å; L489-S504 WeakPolarHBondContact CA-O 3.5Å; L489-S504 WeakPolarHBondContact CD2-O 3.38Å; Y490-S504 PolarHBondContact N-O 3.12Å; Y490-S504 WeakPolarHBondContact O-CA 3.31Å; Y490-S504 WeakPolarHBondContact O-CB 3.25Å; V502-S504 PolarHBondContact O-N 3.1Å
505	N	90.2	Very high	92.5	Very high	113 Å²	113	38.7 Å²	38.7	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-13.3	-178.3	-55.2	-83.4	0	0	0	113.8	N503	N503-N505 PolarHBondContact O-N 3.05Å; N503-N505 PolarHBondContact OD1-N 3.07Å
506	T	89.9	Confident	92.5	Very high	63 Å²	63	40.9 Å²	40.9	39%	0.387	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-17.5	-172.1	63.1	0	0	0	0	114.6	N503 E508	N503-T506 VanDerWaalsContact CB-OG1 3.32Å; N503-T506 WeakPolarHBondContact CB-OG1 3.46Å; N503-T506 PolarHBondContact ND2-OG1 2.89Å; N503-T506 PolarHBondContact O-N 3.24Å; T506-E508 PolarHBondContact O-N 2.82Å; T506-E508 VanDerWaalsContact OG1-CB 3.27Å; T506-E508 WeakPolarHBondContact OG1-CB 3.49Å; T506-E508 PolarHBondContact OG1-N 3.44Å
507	G	90.5	Very high	92.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.232	C	C	.	.			trans	71.3	12.5	-170.4	0	0	0	0	0	113.6	Y475 N503	Y475-G507 PolarHBondContact N-O 2.56Å; Y475-G507 WeakPolarHBondContact O-CA 3.43Å; N503-G507 PolarHBondContact O-N 2.82Å
508	E	94.8	Very high	92.7	Very high	64 Å²	64	41.4 Å²	41.4	30%	0.299	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.8	173.8	-174.8	-177.8	80.7	0	0	110.8	V471 V502 N503 T506 T510	V471-E508 HydrophobicContact CG1-CG 3.88Å; V502-E508 WeakPolarHBondContact CA-O 3.47Å; N503-E508 HydrophobicContact CB-CB 3.91Å; N503-E508 PolarHBondContact N-O 3.21Å; T506-E508 PolarHBondContact O-N 2.82Å; T506-E508 VanDerWaalsContact OG1-CB 3.27Å; T506-E508 WeakPolarHBondContact OG1-CB 3.49Å; T506-E508 PolarHBondContact OG1-N 3.44Å; E508-T510 HydrophobicContact CG-CG2 4.31Å
509	L	95.3	Very high	92.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.8	-179.8	-55.7	-179.1	0	0	0	109.4	Y460 I472 G473 V500 G501 V502 V531 V545	Y460-L509 HydrophobicContact CD2-CD1 4.1Å; Y460-L509 HydrophobicContact CE2-CD1 3.56Å; I472-L509 HydrophobicContact CB-CB 4.11Å; I472-L509 PolarHBondContact N-O 2.91Å; G473-L509 PolarHBondContact O-N 3.07Å; V500-L509 HydrophobicContact CG1-CB 4.12Å; V500-L509 HydrophobicContact CG1-CD2 4.32Å; G501-L509 WeakPolarHBondContact O-CA 3.35Å; V502-L509 HydrophobicContact CB-CD2 4.43Å; V502-L509 HydrophobicContact CG1-CD2 4.26Å; V502-L509 HydrophobicContact CG2-CD2 3.83Å; L509-V531 HydrophobicContact CD2-CG2 4.43Å; L509-V545 HydrophobicContact CD1-CG1 3.92Å; L509-V545 HydrophobicContact CD1-CG2 3.91Å
510	T	94.6	Very high	92.5	Very high	30 Å²	30	44.5 Å²	44.5	18%	0.184	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.1	-177.5	55.3	0	0	0	0	112.3	T470 V471 V500 G501 E508 T512	T470-T510 CarbonylContact O-C 3.47Å; T470-T510 VanDerWaalsContact O-CA 3.25Å; T470-T510 WeakPolarHBondContact O-CA 3.43Å; V471-T510 HydrophobicContact CG2-CG2 4.12Å; V500-T510 CarbonylContact C-O 3.53Å; V500-T510 WeakPolarHBondContact CA-O 3.24Å; G501-T510 PolarHBondContact N-O 3.15Å; G501-T510 PolarHBondContact O-N 3.07Å; E508-T510 HydrophobicContact CG-CG2 4.31Å; T510-T512 PolarHBondContact O-N 3.05Å
511	V	95	Very high	92.3	Very high	2 Å²	2	48 Å²	48	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	120	172.4	-177.3	0	0	0	0	108.9	L466 N468 G469 T470 I472 N513 I515	L466-V511 HydrophobicContact CB-CG2 4.24Å; L466-V511 HydrophobicContact CD1-CG2 4.5Å; N468-V511 CarbonylContact C-O 3.51Å; N468-V511 WeakPolarHBondContact CA-O 3.36Å; G469-V511 PolarHBondContact N-O 2.81Å; T470-V511 PolarHBondContact O-N 2.67Å; I472-V511 HydrophobicContact CD1-CG2 4.07Å; I472-V511 HydrophobicContact CG1-CG2 4.01Å; V511-N513 WeakPolarHBondContact CG1-O 3.42Å; V511-I515 HydrophobicContact CG1-CD1 4.39Å; V511-I515 HydrophobicContact CG1-CG1 4.49Å; V511-I515 HydrophobicContact CG2-CD1 4.02Å
512	T	91.1	Very high	92.2	Very high	65 Å²	65	48.3 Å²	48.3	40%	0.399	27%	0.273	S	S	.	.			trans	-109.1	-21.1	179.3	44.2	0	0	0	0	114.2	N468 S498 W499 V500 G501 T510	N468-T512 PolarHBondContact ND2-O 3.31Å; S498-T512 PolarHBondContact O-OG1 3.36Å; W499-T512 VanDerWaalsContact C-OG1 3.24Å; W499-T512 PolarHBondContact O-N 3.37Å; W499-T512 PolarHBondContact O-OG1 2.81Å; W499-T512 VanDerWaalsContact O-OG1 3.05Å; V500-T512 PolarHBondContact N-OG1 3.23Å; G501-T512 VanDerWaalsContact CA-CG2 3.48Å; G501-T512 PolarHBondContact N-OG1 2.95Å; T510-T512 PolarHBondContact O-N 3.05Å
513	N	90.6	Very high	91.9	Very high	70 Å²	70	53.6 Å²	53.6	37%	0.374	30%	0.295	S	S	.	.	S	Bend	trans	-148.9	162	177.1	-172.5	31.4	0	0	0	108.4	N468 W499 V511 I515	N468-N513 WeakPolarHBondContact OD1-CA 3.4Å; W499-N513 PolarHBondContact O-N 2.97Å; V511-N513 WeakPolarHBondContact CG1-O 3.42Å; N513-I515 PolarHBondContact O-N 2.84Å; N513-I515 VanDerWaalsContact O-N 3.1Å
514	T	90.3	Very high	91.5	Very high	72 Å²	72	59 Å²	59	44%	0.442	33%	0.325	S	S	.	.			trans	-59	114	-175.7	49.4	0	0	0	0	111.6	W499	W499-T514 VanDerWaalsContact CD1-O 3.27Å; W499-T514 PolarHBondContact NE1-O 3.47Å
515	I	92.6	Very high	91.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.315	C	S	.	.			trans	-71	128.9	164.3	-63.2	170.1	0	0	0	106.8	V462 E464 N465 W499 V511 N513 L547 I549	V462-I515 HydrophobicContact CG2-CD1 4.25Å; E464-I515 HydrophobicContact CB-CG2 4.4Å; N465-I515 PolarHBondContact N-O 2.99Å; W499-I515 HydrophobicContact CB-CG1 3.91Å; W499-I515 HydrophobicContact CD2-CG1 4.4Å; W499-I515 HydrophobicContact CE3-CG1 4.39Å; W499-I515 HydrophobicContact CE3-CG2 4.42Å; W499-I515 HydrophobicContact CG-CG1 4.24Å; V511-I515 HydrophobicContact CG1-CD1 4.39Å; V511-I515 HydrophobicContact CG1-CG1 4.49Å; V511-I515 HydrophobicContact CG2-CD1 4.02Å; N513-I515 PolarHBondContact O-N 2.84Å; N513-I515 VanDerWaalsContact O-N 3.1Å; I515-L547 HydrophobicContact CD1-CD1 4.32Å; I515-I549 HydrophobicContact CG2-CD1 3.7Å; I515-I549 HydrophobicContact CG2-CG1 3.97Å; I515-I549 HydrophobicContact CG2-CG2 4Å
516	D	92.4	Very high	91.5	Very high	57 Å²	57	53.8 Å²	53.8	31%	0.305	30%	0.297	S	S	.	.			trans	-138	125	-174.3	131.9	39.4	0	0	0	105.8	W499 E518 S519 V522	W499-D516 WeakPolarHBondContact CH2-O 3.4Å; D516-E518 PolarHBondContact OD1-N 2.76Å; D516-S519 VanDerWaalsContact CG-CB 3.42Å; D516-S519 WeakPolarHBondContact O-CB 3.24Å; D516-S519 PolarHBondContact OD1-N 2.66Å; D516-S519 WeakPolarHBondContact OD2-CB 3.32Å; D516-S519 PolarHBondContact OD2-OG 2.83Å; D516-V522 WeakPolarHBondContact O-CG2 3.22Å
517	R	92.3	Very high	91.7	Very high	56 Å²	56	50.9 Å²	50.9	21%	0.211	28%	0.279	C	S	.	.	S	Bend	trans	-82.1	-33.5	-170.2	-174	-170.6	160.5	-79.4	2.1	112.3	E464 S519 V522 I549 D551	E464-R517 WeakPolarHBondContact OE2-CB 3.36Å; E464-R517 PolarHBondContact OE2-N 2.85Å; R517-S519 PolarHBondContact O-N 3.04Å; R517-V522 WeakPolarHBondContact O-CB 3.46Å; R517-V522 WeakPolarHBondContact O-CG2 3.29Å; R517-I549 HydrophobicContact CB-CG2 3.78Å; R517-I549 HydrophobicContact CG-CB 4.33Å; R517-I549 HydrophobicContact CG-CG2 4Å; R517-D551 WeakPolarHBondContact CD-OD1 3.43Å; R517-D551 IonicContact CZ-OD1 3.97Å; R517-D551 IonicContact NE-OD1 2.97Å; R517-D551 PolarHBondContact NE-OD1 3.16Å; R517-D551 IonicContact NH1-OD1 3.33Å; R517-D551 PolarHBondContact NH1-OD1 2.64Å; R517-D551 IonicContact NH2-OD1 3.07Å
518	E	91.9	Very high	91.9	Very high	48 Å²	48	55 Å²	55	22%	0.224	30%	0.301	C	S	.	.	S	Bend	trans	-78.8	-9.9	-179.5	-71.6	59.9	-113.9	0	0	112.4	D516 N555 N583	D516-E518 PolarHBondContact OD1-N 2.76Å; E518-N555 PolarHBondContact OE2-ND2 2.9Å; E518-N583 HydrophobicContact CB-CB 4.28Å; E518-N583 HydrophobicContact CG-CB 3.39Å
519	S	91.6	Very high	91.9	Very high	21 Å²	21	52 Å²	52	15%	0.147	29%	0.287	C	S	.	.	S	Bend	trans	-49.9	134.2	171.9	-129.5	0	0	0	0	111.8	D516 R517 L521 V522	D516-S519 VanDerWaalsContact CG-CB 3.42Å; D516-S519 WeakPolarHBondContact O-CB 3.24Å; D516-S519 PolarHBondContact OD1-N 2.66Å; D516-S519 WeakPolarHBondContact OD2-CB 3.32Å; D516-S519 PolarHBondContact OD2-OG 2.83Å; R517-S519 PolarHBondContact O-N 3.04Å; S519-L521 PolarHBondContact O-N 2.96Å; S519-V522 PolarHBondContact O-N 3.43Å
520	P	89.6	Confident	91.9	Very high	122 Å²	122	53.7 Å²	53.7	79%	0.792	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	5.5	178.6	30.6	-37.4	0	0	0	114.2
521	L	90.9	Very high	91.9	Very high	74 Å²	74	52.3 Å²	52.3	39%	0.387	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-17.2	172.4	-57.3	179.1	0	0	0	112.7	P496 W499 S519 Y527	P496-L521 HydrophobicContact CB-CD1 4.3Å; P496-L521 HydrophobicContact CB-CD2 4.11Å; W499-L521 HydrophobicContact CH2-CB 4.33Å; W499-L521 HydrophobicContact CZ2-CD1 4.41Å; S519-L521 PolarHBondContact O-N 2.96Å; L521-Y527 HydrophobicContact CB-CD2 4.43Å; L521-Y527 HydrophobicContact CB-CE2 4.09Å
522	V	91.6	Very high	91.9	Very high	19 Å²	19	55.6 Å²	55.6	12%	0.115	30%	0.303	C	S	.	.			trans	-87.9	139.8	175.8	-173.2	0	0	0	0	109.2	W499 D516 R517 S519 T526 I549	W499-V522 HydrophobicContact CH2-CG2 3.67Å; W499-V522 HydrophobicContact CZ3-CG2 3.85Å; D516-V522 WeakPolarHBondContact O-CG2 3.22Å; R517-V522 WeakPolarHBondContact O-CB 3.46Å; R517-V522 WeakPolarHBondContact O-CG2 3.29Å; S519-V522 PolarHBondContact O-N 3.43Å; V522-T526 WeakPolarHBondContact CG1-O 3.47Å; V522-I549 HydrophobicContact CG1-CD1 4.18Å; V522-I549 HydrophobicContact CG2-CD1 3.71Å
523	Q	88.4	Confident	92.1	Very high	142 Å²	142	52.5 Å²	52.5	66%	0.664	28%	0.284	S	S	*	.	B	Isolated β-bridge	trans	-130.4	123.5	176.5	-64	-176.4	1	0	0	109	G525 T526	Q523-G525 PolarHBondContact O-N 3.14Å; Q523-T526 PolarHBondContact N-O 2.91Å; Q523-T526 WeakPolarHBondContact O-CA 3.42Å; Q523-T526 PolarHBondContact O-N 3.19Å; Q523-T526 PolarHBondContact O-OG1 2.79Å
524	D	86.4	Confident	92.3	Very high	172 Å²	172	50.2 Å²	50.2	92%	0.92	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	37.4	-176.3	-57.2	-32.5	0	0	0	114.1	T526	D524-T526 VanDerWaalsContact C-N 3.26Å; D524-T526 PolarHBondContact O-N 3.13Å
525	G	88.3	Confident	92.3	Very high	14 Å²	14	47.4 Å²	47.4	14%	0.144	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	13.8	-175.6	0	0	0	0	0	114.4	Q523 I549	Q523-G525 PolarHBondContact O-N 3.14Å; G525-I549 PolarHBondContact O-N 2.68Å
526	T	92.9	Very high	92.1	Very high	38 Å²	38	51.9 Å²	51.9	23%	0.233	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.4	-180	70	0	0	0	0	113	V522 Q523 D524 V546 L547 V548	V522-T526 WeakPolarHBondContact CG1-O 3.47Å; Q523-T526 PolarHBondContact N-O 2.91Å; Q523-T526 WeakPolarHBondContact O-CA 3.42Å; Q523-T526 PolarHBondContact O-N 3.19Å; Q523-T526 PolarHBondContact O-OG1 2.79Å; D524-T526 VanDerWaalsContact C-N 3.26Å; D524-T526 PolarHBondContact O-N 3.13Å; T526-V546 HydrophobicContact CG2-CG1 4.39Å; T526-L547 CarbonylContact C-O 3.59Å; T526-L547 VanDerWaalsContact CA-O 3.26Å; T526-L547 WeakPolarHBondContact CA-O 3.29Å; T526-V548 HydrophobicContact CG2-CG2 4.38Å
527	Y	94.7	Very high	91.8	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	125.1	-179.4	179.8	-101.3	0	0	0	110.4	D495 P496 G497 W499 L521 I529 L547	D495-Y527 VanDerWaalsContact C-OH 3.26Å; D495-Y527 WeakPolarHBondContact OD1-CE1 3.36Å; D495-Y527 PolarHBondContact OD1-OH 2.86Å; P496-Y527 HydrophobicContact CB-CE2 4.48Å; P496-Y527 VanDerWaalsContact CD-OH 3.29Å; P496-Y527 WeakPolarHBondContact CD-OH 3.33Å; G497-Y527 PolarHBondContact N-OH 2.94Å; W499-Y527 HydrophobicContact CD2-CE1 4.28Å; W499-Y527 HydrophobicContact CD2-CE2 4.46Å; W499-Y527 AromaticContact CE3-CD1 3.65Å; W499-Y527 HydrophobicContact CE3-CD1 3.65Å; W499-Y527 AromaticContact CE3-CD2 3.8Å; W499-Y527 HydrophobicContact CE3-CD2 3.8Å; W499-Y527 AromaticContact CE3-CE1 3.52Å; W499-Y527 HydrophobicContact CE3-CE1 3.52Å; W499-Y527 AromaticContact CE3-CE2 3.7Å; W499-Y527 HydrophobicContact CE3-CE2 3.7Å; W499-Y527 AromaticContact CE3-CG 3.76Å; W499-Y527 HydrophobicContact CE3-CG 3.76Å; W499-Y527 AromaticContact CE3-CZ 3.53Å; W499-Y527 HydrophobicContact CH2-CD2 4.26Å; W499-Y527 HydrophobicContact CH2-CE2 4.32Å; W499-Y527 AromaticContact CZ3-CD1 4Å; W499-Y527 HydrophobicContact CZ3-CD1 4Å; W499-Y527 AromaticContact CZ3-CD2 3.4Å; W499-Y527 HydrophobicContact CZ3-CD2 3.4Å; W499-Y527 VanDerWaalsContact CZ3-CD2 3.4Å; W499-Y527 HydrophobicContact CZ3-CE1 4.17Å; W499-Y527 AromaticContact CZ3-CE2 3.62Å; W499-Y527 HydrophobicContact CZ3-CE2 3.62Å; W499-Y527 AromaticContact CZ3-CG 3.59Å; W499-Y527 HydrophobicContact CZ3-CG 3.59Å; W499-Y527 AromaticContact CZ3-CZ 3.98Å; L521-Y527 HydrophobicContact CB-CD2 4.43Å; L521-Y527 HydrophobicContact CB-CE2 4.09Å; Y527-I529 HydrophobicContact CD1-CG2 3.95Å; Y527-I529 HydrophobicContact CE1-CG2 3.38Å; Y527-L547 HydrophobicContact CD1-CD1 4.04Å; Y527-L547 HydrophobicContact CD1-CG 4.47Å; Y527-L547 PolarHBondContact N-O 2.87Å; Y527-L547 PolarHBondContact O-N 2.94Å
528	N	94.6	Very high	91.6	Very high	87 Å²	87	55 Å²	55	47%	0.465	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.7	-169.2	-63.4	-40.6	0	0	0	111.3	V546	N528-V546 WeakPolarHBondContact OD1-CG2 3.44Å
529	I	94.6	Very high	91.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.5	169.9	70.2	176.2	0	0	0	110.4	S494 D495 V500 Y527 V545	S494-I529 CarbonylContact O-C 3.54Å; S494-I529 VanDerWaalsContact O-CA 3.26Å; S494-I529 WeakPolarHBondContact O-CA 3.48Å; S494-I529 WeakPolarHBondContact O-CB 3.18Å; D495-I529 HydrophobicContact CB-CB 4.33Å; D495-I529 HydrophobicContact CB-CG2 3.83Å; V500-I529 HydrophobicContact CB-CD1 3.68Å; V500-I529 HydrophobicContact CG1-CD1 3.6Å; V500-I529 HydrophobicContact CG2-CD1 3.94Å; Y527-I529 HydrophobicContact CD1-CG2 3.95Å; Y527-I529 HydrophobicContact CE1-CG2 3.38Å; I529-V545 HydrophobicContact CD1-CB 4.15Å; I529-V545 HydrophobicContact CD1-CG1 4.42Å; I529-V545 HydrophobicContact CG1-CB 3.63Å; I529-V545 HydrophobicContact CG1-CG1 4.25Å; I529-V545 HydrophobicContact CG1-CG2 4.29Å; I529-V545 PolarHBondContact N-O 2.7Å; I529-V545 PolarHBondContact O-N 3.31Å
530	T	95.8	Very high	91.6	Very high	35 Å²	35	58 Å²	58	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.2	177.1	45.7	0	0	0	0	111.3	V493 S494	V493-T530 PolarHBondContact N-O 2.84Å; S494-T530 VanDerWaalsContact CB-OG1 3.29Å; S494-T530 WeakPolarHBondContact CB-OG1 3.48Å; S494-T530 PolarHBondContact N-OG1 2.87Å; S494-T530 VanDerWaalsContact N-OG1 3.11Å; S494-T530 PolarHBondContact O-N 3.33Å
531	V	95.5	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.3	-178.3	-174.7	0	0	0	0	108.4	F453 Y475 Y490 Y491 V502 L509 I542 G543 V545	F453-V531 HydrophobicContact CE1-CG1 4.49Å; F453-V531 HydrophobicContact CZ-CB 4.31Å; F453-V531 HydrophobicContact CZ-CG1 4.04Å; Y475-V531 HydrophobicContact CD1-CB 4.28Å; Y475-V531 HydrophobicContact CD1-CG2 4.28Å; Y490-V531 HydrophobicContact CD1-CG1 4.31Å; Y491-V531 CarbonylContact O-C 3.59Å; Y491-V531 WeakPolarHBondContact O-CA 3.36Å; V502-V531 HydrophobicContact CG1-CG1 4.11Å; V502-V531 HydrophobicContact CG2-CG2 4.21Å; L509-V531 HydrophobicContact CD2-CG2 4.43Å; V531-I542 WeakPolarHBondContact O-CA 3.39Å; V531-G543 PolarHBondContact N-O 2.97Å; V531-G543 PolarHBondContact O-N 2.9Å; V531-V545 HydrophobicContact CG2-CG2 4.01Å
532	K	94.8	Very high	91.8	Very high	71 Å²	71	54.5 Å²	54.5	31%	0.309	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.8	174	179.3	-179.6	-172.3	-173.8	0	109.2	Y491 V493 V534 S540 G541 I542	Y491-K532 PolarHBondContact N-O 2.81Å; Y491-K532 PolarHBondContact O-N 3.34Å; V493-K532 HydrophobicContact CG2-CB 3.47Å; V493-K532 VanDerWaalsContact CG2-CB 3.47Å; V493-K532 HydrophobicContact CG2-CD 4.5Å; K532-V534 HydrophobicContact CD-CG2 4.14Å; K532-V534 HydrophobicContact CG-CG2 4.09Å; K532-S540 WeakPolarHBondContact CE-OG 3.26Å; K532-S540 PolarHBondContact NZ-OG 2.96Å; K532-G541 WeakPolarHBondContact CA-O 3.46Å; K532-I542 HydrophobicContact CG-CG1 4.47Å
533	A	95.1	Very high	92	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	145.5	165.9	0	0	0	0	0	109.1	P451 F453 A477 I488 L489 Y490 S540 G541	P451-A533 HydrophobicContact CB-CB 4.05Å; P451-A533 HydrophobicContact CG-CB 3.72Å; F453-A533 HydrophobicContact CE2-CB 3.68Å; F453-A533 HydrophobicContact CZ-CB 3.73Å; A477-A533 HydrophobicContact CB-CB 3.44Å; A477-A533 VanDerWaalsContact CB-CB 3.44Å; I488-A533 HydrophobicContact CG2-CB 3.72Å; L489-A533 CarbonylContact O-C 3.58Å; L489-A533 WeakPolarHBondContact O-CA 3.33Å; Y490-A533 HydrophobicContact CE1-CB 4.33Å; A533-S540 WeakPolarHBondContact O-CA 3.4Å; A533-S540 WeakPolarHBondContact O-CB 3.45Å; A533-G541 PolarHBondContact N-O 3.37Å; A533-G541 PolarHBondContact O-N 3.27Å
534	V	93.6	Very high	92.3	Very high	23 Å²	23	49 Å²	49	14%	0.139	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	126.3	175.5	-175	0	0	0	0	108.1	I488 L489 Y491 K532 K539	I488-V534 CarbonylContact C-O 3.55Å; I488-V534 WeakPolarHBondContact CA-O 3.18Å; L489-V534 PolarHBondContact N-O 2.84Å; L489-V534 PolarHBondContact O-N 2.86Å; Y491-V534 HydrophobicContact CD2-CB 4.42Å; Y491-V534 HydrophobicContact CD2-CG2 3.76Å; Y491-V534 HydrophobicContact CE2-CB 3.99Å; Y491-V534 HydrophobicContact CE2-CG2 3.74Å; K532-V534 HydrophobicContact CD-CG2 4.14Å; K532-V534 HydrophobicContact CG-CG2 4.09Å; V534-K539 WeakPolarHBondContact CA-O 3.47Å; V534-K539 WeakPolarHBondContact CG1-O 3.48Å
535	D	91.9	Very high	92.8	Very high	13 Å²	13	40.8 Å²	40.8	7%	0.07	25%	0.249	C	C	.	.			trans	-84.1	-166.2	178.1	51.8	64.3	0	0	0	113	P451 T537 S538 K539	P451-D535 WeakPolarHBondContact CD-OD2 3.46Å; P451-D535 HydrophobicContact CG-CB 4.16Å; D535-T537 VanDerWaalsContact OD1-C 3.28Å; D535-T537 VanDerWaalsContact OD1-CA 3.31Å; D535-T537 WeakPolarHBondContact OD1-CA 3.34Å; D535-T537 PolarHBondContact OD1-N 3.32Å; D535-T537 PolarHBondContact OD1-OG1 2.86Å; D535-S538 PolarHBondContact OD1-N 2.91Å; D535-K539 PolarHBondContact OD1-N 2.85Å; D535-K539 VanDerWaalsContact OD2-CA 3.23Å; D535-K539 WeakPolarHBondContact OD2-CA 3.41Å; D535-K539 WeakPolarHBondContact OD2-CB 3.44Å; D535-K539 PolarHBondContact OD2-N 2.87Å
536	A	86.4	Confident	93.1	Very high	94 Å²	94	40.7 Å²	40.7	78%	0.777	25%	0.246	S	C	*	.	S	Bend	trans	-82.4	-18.3	175.6	0	0	0	0	0	114.7	S538	A536-S538 VanDerWaalsContact C-N 3.3Å
537	T	86.2	Confident	93.2	Very high	78 Å²	78	38.9 Å²	38.9	48%	0.479	24%	0.235	S	C	.	.	S	Bend	trans	-87.2	-2.9	174.4	67.8	0	0	0	0	112.4	D448 D535 K539	D448-T537 PolarHBondContact OD1-OG1 3.36Å; D448-T537 PolarHBondContact OD2-OG1 2.82Å; D535-T537 VanDerWaalsContact OD1-C 3.28Å; D535-T537 VanDerWaalsContact OD1-CA 3.31Å; D535-T537 WeakPolarHBondContact OD1-CA 3.34Å; D535-T537 PolarHBondContact OD1-N 3.32Å; D535-T537 PolarHBondContact OD1-OG1 2.86Å; T537-K539 VanDerWaalsContact C-N 3.35Å; T537-K539 WeakPolarHBondContact OG1-CG 3.48Å
538	S	88.6	Confident	93.3	Very high	99 Å²	99	41 Å²	41	69%	0.692	25%	0.248	S	C	*	.	S	Bend	trans	69.9	23.1	-176.5	-51.9	0	0	0	0	114.8	D535 A536	D535-S538 PolarHBondContact OD1-N 2.91Å; A536-S538 VanDerWaalsContact C-N 3.3Å
539	K	90.7	Very high	93.2	Very high	82 Å²	82	37.2 Å²	37.2	36%	0.357	23%	0.227	S	C	.	.			trans	-80	177.7	166.3	-59.5	-82.7	-175.1	59.5	0	109.1	D448 E449 V534 D535 T537	D448-K539 PolarHBondContact O-NZ 2.92Å; D448-K539 IonicContact OD2-NZ 2.6Å; D448-K539 PolarHBondContact OD2-NZ 2.84Å; E449-K539 WeakPolarHBondContact O-CB 3.29Å; E449-K539 WeakPolarHBondContact O-CG 3.4Å; V534-K539 WeakPolarHBondContact CA-O 3.47Å; V534-K539 WeakPolarHBondContact CG1-O 3.48Å; D535-K539 PolarHBondContact OD1-N 2.85Å; D535-K539 VanDerWaalsContact OD2-CA 3.23Å; D535-K539 WeakPolarHBondContact OD2-CA 3.41Å; D535-K539 WeakPolarHBondContact OD2-CB 3.44Å; D535-K539 PolarHBondContact OD2-N 2.87Å; T537-K539 VanDerWaalsContact C-N 3.35Å; T537-K539 WeakPolarHBondContact OG1-CG 3.48Å
540	S	92.5	Very high	93.1	Very high	51 Å²	51	41.9 Å²	41.9	36%	0.357	25%	0.249	S	C	.	.			trans	-169.5	129.8	-175.5	59.4	0	0	0	0	116	K532 A533	K532-S540 WeakPolarHBondContact CE-OG 3.26Å; K532-S540 PolarHBondContact NZ-OG 2.96Å; A533-S540 WeakPolarHBondContact O-CA 3.4Å; A533-S540 WeakPolarHBondContact O-CB 3.45Å
541	G	92	Very high	92.8	Very high	15 Å²	15	41.2 Å²	41.2	16%	0.155	25%	0.245	C	C	.	.			trans	-92.8	164.3	161	0	0	0	0	0	113.5	P451 K532 A533	P451-G541 VanDerWaalsContact O-CA 3.26Å; P451-G541 WeakPolarHBondContact O-CA 3.24Å; P451-G541 PolarHBondContact O-N 2.88Å; K532-G541 WeakPolarHBondContact CA-O 3.46Å; A533-G541 PolarHBondContact N-O 3.37Å; A533-G541 PolarHBondContact O-N 3.27Å
542	I	93.9	Very high	92.6	Very high	108 Å²	108	45 Å²	45	55%	0.554	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127	130.2	174.8	-58.4	175.4	0	0	0	108.3	V531 K532	V531-I542 WeakPolarHBondContact O-CA 3.39Å; K532-I542 HydrophobicContact CG-CG1 4.47Å
543	G	94.6	Very high	92.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	151	174.3	0	0	0	0	0	111.3	F453 Y475 V531	F453-G543 VanDerWaalsContact CD2-N 3.28Å; Y475-G543 WeakPolarHBondContact OH-CA 3.39Å; V531-G543 PolarHBondContact N-O 2.97Å; V531-G543 PolarHBondContact O-N 2.9Å
544	T	96.4	Very high	91.9	Very high	44 Å²	44	47.3 Å²	47.3	27%	0.27	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.2	176.9	-55.9	0	0	0	0	110.5	P456 T457 V458 V546	P456-T544 PolarHBondContact O-N 3.33Å; T457-T544 CarbonylContact C-O 3.6Å; T457-T544 VanDerWaalsContact CA-O 3.25Å; T457-T544 WeakPolarHBondContact CA-O 3.22Å; T457-T544 HydrophobicContact CG2-CG2 4.31Å; V458-T544 PolarHBondContact N-O 2.74Å; T544-V546 HydrophobicContact CG2-CG2 4.43Å
545	V	95.8	Very high	91.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.9	170.3	-179.7	0	0	0	0	107.8	V458 Y460 Y475 L509 I529 V531 L547	V458-V545 HydrophobicContact CG1-CB 4.13Å; V458-V545 HydrophobicContact CG1-CG1 4.06Å; V458-V545 HydrophobicContact CG1-CG2 3.74Å; Y460-V545 HydrophobicContact CD2-CG1 3.57Å; Y460-V545 HydrophobicContact CE2-CG1 3.79Å; Y475-V545 HydrophobicContact CD1-CG2 3.28Å; Y475-V545 HydrophobicContact CE1-CG2 3.72Å; Y475-V545 HydrophobicContact CG-CG2 3.91Å; L509-V545 HydrophobicContact CD1-CG1 3.92Å; L509-V545 HydrophobicContact CD1-CG2 3.91Å; I529-V545 HydrophobicContact CD1-CB 4.15Å; I529-V545 HydrophobicContact CD1-CG1 4.42Å; I529-V545 HydrophobicContact CG1-CB 3.63Å; I529-V545 HydrophobicContact CG1-CG1 4.25Å; I529-V545 HydrophobicContact CG1-CG2 4.29Å; I529-V545 PolarHBondContact N-O 2.7Å; I529-V545 PolarHBondContact O-N 3.31Å; V531-V545 HydrophobicContact CG2-CG2 4.01Å; V545-L547 HydrophobicContact CG1-CD2 4Å
546	V	95.7	Very high	91.6	Very high	12 Å²	12	52.9 Å²	52.9	7%	0.073	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.5	171.5	-175.9	0	0	0	0	107.6	T457 V458 R459 Y460 T526 N528 T544	T457-V546 HydrophobicContact CG2-CG2 3.69Å; V458-V546 PolarHBondContact O-N 2.92Å; R459-V546 WeakPolarHBondContact CA-O 3.4Å; R459-V546 HydrophobicContact CG-CB 4.21Å; Y460-V546 PolarHBondContact N-O 2.99Å; T526-V546 HydrophobicContact CG2-CG1 4.39Å; N528-V546 WeakPolarHBondContact OD1-CG2 3.44Å; T544-V546 HydrophobicContact CG2-CG2 4.43Å
547	L	94.9	Very high	91.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	130.4	163.3	-53.4	-173.1	0	0	0	108.2	Y460 V462 I472 V500 I515 T526 Y527 V545	Y460-L547 HydrophobicContact CD2-CD2 4.45Å; Y460-L547 WeakPolarHBondContact O-CA 3.38Å; V462-L547 HydrophobicContact CG1-CD2 4.49Å; V462-L547 HydrophobicContact CG2-CB 4.14Å; V462-L547 HydrophobicContact CG2-CD1 4.31Å; I472-L547 HydrophobicContact CG2-CD2 4.07Å; V500-L547 HydrophobicContact CG2-CD1 3.84Å; I515-L547 HydrophobicContact CD1-CD1 4.32Å; T526-L547 CarbonylContact C-O 3.59Å; T526-L547 VanDerWaalsContact CA-O 3.26Å; T526-L547 WeakPolarHBondContact CA-O 3.29Å; Y527-L547 HydrophobicContact CD1-CD1 4.04Å; Y527-L547 HydrophobicContact CD1-CG 4.47Å; Y527-L547 PolarHBondContact N-O 2.87Å; Y527-L547 PolarHBondContact O-N 2.94Å; V545-L547 HydrophobicContact CG1-CD2 4Å
548	V	94.9	Very high	91.9	Very high	47 Å²	47	48 Å²	48	29%	0.285	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.1	162.5	-177.3	0	0	0	0	105.7	Y460 V461 V462 T526	Y460-V548 PolarHBondContact O-N 2.85Å; V461-V548 WeakPolarHBondContact CA-O 3.33Å; V461-V548 HydrophobicContact CG2-CB 4.41Å; V462-V548 PolarHBondContact N-O 2.61Å; T526-V548 HydrophobicContact CG2-CG2 4.38Å
549	I	93.9	Very high	92	Very high	8 Å²	8	44 Å²	44	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.9	-175.4	-56.9	169.4	0	0	0	108.3	V462 E464 W499 I515 R517 V522 G525	V462-I549 HydrophobicContact CG2-CG1 4.14Å; V462-I549 CarbonylContact O-C 3.5Å; V462-I549 WeakPolarHBondContact O-CA 3.38Å; E464-I549 HydrophobicContact CB-CG2 3.82Å; W499-I549 HydrophobicContact CZ3-CD1 4.03Å; I515-I549 HydrophobicContact CG2-CD1 3.7Å; I515-I549 HydrophobicContact CG2-CG1 3.97Å; I515-I549 HydrophobicContact CG2-CG2 4Å; R517-I549 HydrophobicContact CB-CG2 3.78Å; R517-I549 HydrophobicContact CG-CB 4.33Å; R517-I549 HydrophobicContact CG-CG2 4Å; V522-I549 HydrophobicContact CG1-CD1 4.18Å; V522-I549 HydrophobicContact CG2-CD1 3.71Å; G525-I549 PolarHBondContact O-N 2.68Å
550	E	92.4	Very high	91.9	Very high	100 Å²	100	42.5 Å²	42.5	47%	0.467	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	135.4	171.4	-71.1	-176	150.7	0	0	110.4	V461 V462 Q463 E464	V461-E550 HydrophobicContact CG1-CG 3.54Å; V461-E550 WeakPolarHBondContact CG1-OE1 3.44Å; V462-E550 PolarHBondContact O-N 2.88Å; Q463-E550 HydrophobicContact CG-CB 4.36Å; E464-E550 PolarHBondContact N-O 2.83Å
551	D	90.3	Very high	91.7	Very high	21 Å²	21	48.3 Å²	48.3	11%	0.112	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-75.7	132	-174.3	-162.1	88.1	0	0	0	111.2	E464 R517 A585 F588	E464-D551 WeakPolarHBondContact OE1-CA 3.24Å; R517-D551 WeakPolarHBondContact CD-OD1 3.43Å; R517-D551 IonicContact CZ-OD1 3.97Å; R517-D551 IonicContact NE-OD1 2.97Å; R517-D551 PolarHBondContact NE-OD1 3.16Å; R517-D551 IonicContact NH1-OD1 3.33Å; R517-D551 PolarHBondContact NH1-OD1 2.64Å; R517-D551 IonicContact NH2-OD1 3.07Å; D551-A585 HydrophobicContact CB-CB 3.92Å; D551-A585 WeakPolarHBondContact OD1-CB 3.41Å; D551-A585 PolarHBondContact OD1-N 2.85Å; D551-A585 WeakPolarHBondContact OD2-CA 3.45Å; D551-A585 VanDerWaalsContact OD2-CB 3.31Å; D551-A585 WeakPolarHBondContact OD2-CB 3.49Å; D551-A585 PolarHBondContact OD2-N 3.32Å; D551-F588 HydrophobicContact CB-CD2 4.39Å; D551-F588 VanDerWaalsContact O-CE2 3.31Å; D551-F588 WeakPolarHBondContact O-CE2 3.4Å; D551-F588 VanDerWaalsContact OD2-CD2 3.3Å; D551-F588 WeakPolarHBondContact OD2-CD2 3.5Å
552	E	89.9	Confident	91.4	Very high	78 Å²	78	54 Å²	54	36%	0.364	27%	0.273	S	S	.	.			trans	-120.1	148.7	169.6	-78.2	-77	178.9	0	0	110.1	Q463 E464 D554	Q463-E552 PolarHBondContact NE2-OE1 2.86Å; E464-E552 HydrophobicContact CG-CB 4.09Å; E464-E552 HydrophobicContact CG-CG 4.48Å; E464-E552 PolarHBondContact OE1-N 3.41Å; E552-D554 VanDerWaalsContact C-N 3.34Å; E552-D554 PolarHBondContact O-N 2.98Å
553	N	88.8	Confident	91	Very high	37 Å²	37	49.9 Å²	49.9	20%	0.198	25%	0.252	C	S	.	.	S	Bend	trans	-77.3	80.7	-177.3	-177.1	-110	0	0	0	112.1	D584 F588 N639	N553-D584 WeakPolarHBondContact CA-OD2 3.32Å; N553-D584 PolarHBondContact ND2-OD2 2.86Å; N553-F588 HydrophobicContact CB-CB 4.02Å; N553-F588 HydrophobicContact CB-CD1 3.68Å; N553-F588 HydrophobicContact CB-CE1 4.36Å; N553-F588 HydrophobicContact CB-CG 3.98Å; N553-F588 PolarHBondContact ND2-O 2.72Å; N553-N639 WeakPolarHBondContact OD1-CB 3.49Å; N553-N639 PolarHBondContact OD1-ND2 3.44Å
554	D	86.8	Confident	90.6	Very high	83 Å²	83	52.9 Å²	52.9	44%	0.444	27%	0.27	S	S	.	.			trans	-110.2	-26.8	-174.3	128.4	-34.4	0	0	0	113	N465 E552	N465-D554 PolarHBondContact ND2-OD2 2.8Å; E552-D554 VanDerWaalsContact C-N 3.34Å; E552-D554 PolarHBondContact O-N 2.98Å
555	N	88.8	Confident	90	Very high	36 Å²	36	51 Å²	51	19%	0.193	26%	0.258	C	S	.	.	S	Bend	trans	-79.6	-149.1	170	-59.4	-96.6	0	0	0	110.5	E518 D582 N583 D584 N639	E518-N555 PolarHBondContact OE2-ND2 2.9Å; N555-D582 VanDerWaalsContact CB-OD1 3.27Å; N555-D582 WeakPolarHBondContact CB-OD1 3.03Å; N555-N583 PolarHBondContact OD1-ND2 2.83Å; N555-N583 VanDerWaalsContact OD1-ND2 3.13Å; N555-D584 WeakPolarHBondContact CB-OD1 3.19Å; N555-D584 PolarHBondContact N-OD1 3.39Å; N555-D584 PolarHBondContact ND2-OD1 2.9Å; N555-N639 PolarHBondContact O-ND2 3.47Å
556	K	89.4	Confident	89.4	Confident	118 Å²	118	52.6 Å²	52.6	51%	0.513	27%	0.269	S	S	.	.			trans	-178.4	148.6	179.7	55.3	-174.1	166.8	-86	0	109.4	T558 D582	K556-T558 WeakPolarHBondContact O-CG2 3.25Å; K556-T558 PolarHBondContact O-N 2.84Å; K556-D582 VanDerWaalsContact CA-OD2 3.31Å; K556-D582 WeakPolarHBondContact CA-OD2 3.44Å; K556-D582 PolarHBondContact N-OD1 2.87Å
557	P	91.1	Very high	88.5	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	29%	0.289	C	S	.	.			trans	-66.2	126	-170.8	-22.4	32.4	0	0	0	110.6	A580 D582 F592 V633 D635 Q643	P557-A580 HydrophobicContact CB-CB 4.32Å; P557-D582 WeakPolarHBondContact CA-OD2 3.47Å; P557-D582 HydrophobicContact CB-CB 4.48Å; P557-D582 WeakPolarHBondContact CD-OD2 3.28Å; P557-D582 VanDerWaalsContact CG-OD2 3.31Å; P557-D582 WeakPolarHBondContact CG-OD2 3.42Å; P557-F592 HydrophobicContact CB-CD1 3.59Å; P557-F592 HydrophobicContact CB-CE1 3.66Å; P557-F592 HydrophobicContact CB-CG 4.14Å; P557-F592 HydrophobicContact CB-CZ 4.27Å; P557-F592 HydrophobicContact CG-CD1 3.31Å; P557-F592 HydrophobicContact CG-CE1 3.49Å; P557-F592 VanDerWaalsContact CG-CE1 3.49Å; P557-F592 HydrophobicContact CG-CG 4.24Å; P557-V633 HydrophobicContact CB-CG1 3.8Å; P557-V633 HydrophobicContact CG-CG1 4.48Å; P557-D635 HydrophobicContact CG-CB 4.18Å; P557-Q643 PolarHBondContact O-NE2 3.29Å
558	T	89.8	Confident	87.5	Confident	68 Å²	68	61.5 Å²	61.5	42%	0.417	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-104.6	154.2	-179.3	72.2	0	0	0	0	111.9	K556 A580 E581	K556-T558 WeakPolarHBondContact O-CG2 3.25Å; K556-T558 PolarHBondContact O-N 2.84Å; T558-A580 CarbonylContact O-C 3.58Å; T558-A580 WeakPolarHBondContact O-CA 3.49Å; T558-A580 WeakPolarHBondContact O-CB 3.44Å; T558-E581 PolarHBondContact N-O 2.7Å; T558-E581 PolarHBondContact O-N 2.85Å; T558-E581 PolarHBondContact OG1-O 2.64Å
559	I	89.6	Confident	86.1	Confident	14 Å²	14	69.2 Å²	69.2	7%	0.072	34%	0.34	C	S	.	.			trans	-121.6	151.5	176.4	61.9	173.5	0	0	0	112.9	K561 V578 A580 F631 V633 Q643 T645	I559-K561 PolarHBondContact O-N 2.81Å; I559-V578 HydrophobicContact CB-CG1 4.39Å; I559-V578 HydrophobicContact CG2-CG1 4.45Å; I559-A580 HydrophobicContact CG2-CB 4Å; I559-F631 HydrophobicContact CD1-CE1 3.85Å; I559-F631 HydrophobicContact CD1-CE2 3.8Å; I559-F631 HydrophobicContact CD1-CZ 3.42Å; I559-F631 VanDerWaalsContact CD1-CZ 3.42Å; I559-F631 HydrophobicContact CG2-CE2 4.08Å; I559-F631 HydrophobicContact CG2-CZ 4.27Å; I559-V633 HydrophobicContact CG2-CG2 3.81Å; I559-Q643 HydrophobicContact CD1-CB 3.7Å; I559-Q643 HydrophobicContact CG1-CB 3.86Å; I559-Q643 VanDerWaalsContact N-OE1 3.13Å; I559-T645 HydrophobicContact CD1-CG2 4.12Å
560	P	88.8	Confident	84.6	Confident	51 Å²	51	75.3 Å²	75.3	33%	0.331	37%	0.372	S	S	.	.			trans	-53.3	126.4	173.1	-28.2	35	0	0	0	112.9	E562 L563 V579 T645	P560-E562 VanDerWaalsContact C-N 3.33Å; P560-E562 PolarHBondContact O-N 3.49Å; P560-L563 HydrophobicContact CB-CD2 3.95Å; P560-L563 HydrophobicContact CB-CG 4.49Å; P560-L563 HydrophobicContact CG-CD2 4.42Å; P560-V579 WeakPolarHBondContact CD-O 3.27Å; P560-T645 VanDerWaalsContact O-CB 3.27Å; P560-T645 WeakPolarHBondContact O-CB 3.38Å; P560-T645 PolarHBondContact O-OG1 3.13Å
561	K	87.3	Confident	83.1	Confident	174 Å²	174	72.8 Å²	72.8	76%	0.757	37%	0.373	S	S	*	.	S	Bend	trans	-68.9	-28.7	-175.2	-66.4	172	-177.1	166.8	0	113.5	I559 T645 T646	I559-K561 PolarHBondContact O-N 2.81Å; K561-T645 PolarHBondContact O-OG1 3.39Å; K561-T646 PolarHBondContact O-N 3.18Å
562	E	86.8	Confident	82.1	Confident	135 Å²	135	74.2 Å²	74.2	63%	0.631	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.6	171.6	-66.6	-161.8	175.3	0	0	110.5	P560	P560-E562 VanDerWaalsContact C-N 3.33Å; P560-E562 PolarHBondContact O-N 3.49Å
563	L	86.4	Confident	81.4	Confident	21 Å²	21	74.6 Å²	74.6	11%	0.11	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146.5	-177.5	-74.8	176	0	0	0	109.2	P560 L576 V578 T645 T646 V647 R648	P560-L563 HydrophobicContact CB-CD2 3.95Å; P560-L563 HydrophobicContact CB-CG 4.49Å; P560-L563 HydrophobicContact CG-CD2 4.42Å; L563-L576 HydrophobicContact CB-CD2 3.76Å; L563-L576 HydrophobicContact CD1-CD2 3.92Å; L563-L576 HydrophobicContact CD2-CD2 4.16Å; L563-L576 HydrophobicContact CG-CD2 4.17Å; L563-V578 HydrophobicContact CD1-CB 4.39Å; L563-V578 HydrophobicContact CD1-CG1 3.89Å; L563-V578 HydrophobicContact CD1-CG2 3.58Å; L563-V578 HydrophobicContact CD2-CG1 4.38Å; L563-T645 HydrophobicContact CD1-CG2 3.63Å; L563-T645 WeakPolarHBondContact CD1-OG1 3.1Å; L563-T645 WeakPolarHBondContact CG-OG1 3.39Å; L563-T646 PolarHBondContact N-O 3.29Å; L563-V647 HydrophobicContact CB-CG2 4.2Å; L563-V647 HydrophobicContact CD1-CG2 4.31Å; L563-V647 CarbonylContact O-C 2.96Å; L563-V647 WeakPolarHBondContact O-CA 3.22Å; L563-R648 WeakPolarHBondContact O-CB 3.49Å; L563-R648 PolarHBondContact O-N 2.96Å
564	T	85.1	Confident	80.9	Confident	63 Å²	63	74.4 Å²	74.4	39%	0.387	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.7	-179.9	-67.5	0	0	0	0	111.1	C657	T564-C657 VanDerWaalsContact CG2-SG 3.53Å
565	L	84.5	Confident	80.7	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	113.9	174.8	-175.5	68.7	0	0	0	110.6	N574 L576 W604 V647 R648 I649 C650	L565-N574 HydrophobicContact CD1-CB 3.98Å; L565-N574 HydrophobicContact CD2-CB 4.44Å; L565-N574 HydrophobicContact CG-CB 4.43Å; L565-L576 HydrophobicContact CD1-CB 4.24Å; L565-W604 HydrophobicContact CD2-CH2 3.65Å; L565-W604 HydrophobicContact CD2-CZ3 3.89Å; L565-V647 HydrophobicContact CB-CG1 3.81Å; L565-R648 PolarHBondContact N-O 3.23Å; L565-I649 HydrophobicContact CB-CG1 4.4Å; L565-I649 HydrophobicContact CD2-CG1 4.4Å; L565-I649 WeakPolarHBondContact O-CA 3.12Å; L565-C650 PolarHBondContact O-N 2.99Å
566	C	81.7	Confident	80.6	Confident	33 Å²	33	72.7 Å²	72.7	22%	0.223	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	128.8	175.2	-61.4	0	0	0	0	111.2	N574 C652 G655	C566-N574 PolarHBondContact O-ND2 2.89Å; C566-C652 WeakPolarHBondContact CA-SG 3.08Å; C566-C652 HydrophobicContact CB-CB 3.65Å; C566-C652 WeakPolarHBondContact CB-SG 3.49Å; C566-C652 WeakPolarHBondContact SG-CB 3.2Å; C566-C652 CovalentContact SG-SG 2.03Å; C566-C652 PolarHBondContact SG-SG 3.34Å; C566-G655 PolarHBondContact SG-O 3.11Å; C566-G655 VanDerWaalsContact SG-O 3.33Å
567	K	78.4	Confident	80.5	Confident	113 Å²	113	69.8 Å²	69.8	49%	0.491	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-75.4	123.4	173.8	-176.8	169.7	-178.7	171.9	0	110.5	L624 C650	K567-L624 HydrophobicContact CB-CD2 4.27Å; K567-L624 HydrophobicContact CD-CD2 3.99Å; K567-C650 PolarHBondContact N-O 3.1Å
568	K	73.3	Confident	80.4	Confident	86 Å²	86	69.9 Å²	69.9	37%	0.374	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-64.4	140.7	172	-74.3	164.9	167.1	155.5	0	110.6	D570 G571 L573 N574	K568-D570 VanDerWaalsContact C-N 3.31Å; K568-D570 PolarHBondContact O-N 2.99Å; K568-G571 PolarHBondContact O-N 2.73Å; K568-L573 PolarHBondContact NZ-O 3.45Å; K568-N574 HydrophobicContact CD-CB 4.19Å; K568-N574 WeakPolarHBondContact CE-OD1 3.46Å; K568-N574 PolarHBondContact NZ-OD1 2.9Å
569	Q	64.8	Low	80.4	Confident	209 Å²	209	69.5 Å²	69.5	98%	0.977	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-33.2	-179.7	-65.1	-175.5	-2.9	0	0	112.3	G571	Q569-G571 PolarHBondContact O-N 3.16Å
570	D	62.5	Low	80.4	Confident	136 Å²	136	69 Å²	69	73%	0.727	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.8	177.2	178.9	63.6	0	0	0	114.3	K568 S572	K568-D570 VanDerWaalsContact C-N 3.31Å; K568-D570 PolarHBondContact O-N 2.99Å; D570-S572 PolarHBondContact O-N 3.24Å; D570-S572 WeakPolarHBondContact OD2-CB 3.35Å; D570-S572 PolarHBondContact OD2-OG 2.81Å
571	G	62.2	Low	80.5	Confident	47 Å²	47	72.8 Å²	72.8	49%	0.485	38%	0.384	S	S	.	.			trans	72.1	-10.9	179.1	0	0	0	0	0	115.5	K568 Q569	K568-G571 PolarHBondContact O-N 2.73Å; Q569-G571 PolarHBondContact O-N 3.16Å
572	S	68.5	Low	80.6	Confident	51 Å²	51	65.7 Å²	65.7	36%	0.357	35%	0.354	S	S	.	.			trans	-56.7	139.9	174.8	38.7	0	0	0	0	112.7	D570	D570-S572 PolarHBondContact O-N 3.24Å; D570-S572 WeakPolarHBondContact OD2-CB 3.35Å; D570-S572 PolarHBondContact OD2-OG 2.81Å
573	L	75.3	Confident	80.8	Confident	86 Å²	86	64.1 Å²	64.1	45%	0.45	35%	0.35	S	S	.	.			trans	-57.7	145.7	-179	-64.9	168.5	0	0	0	110.7	K568 Q618	K568-L573 PolarHBondContact NZ-O 3.45Å; L573-Q618 HydrophobicContact CD2-CB 4.41Å; L573-Q618 HydrophobicContact CD2-CG 4.02Å
574	N	77.5	Confident	80.9	Confident	32 Å²	32	63.4 Å²	63.4	17%	0.171	35%	0.346	C	S	.	.			trans	-120.1	160.5	-177.4	-152.7	18.7	0	0	0	112.5	L565 C566 K568 Q618	L565-N574 HydrophobicContact CD1-CB 3.98Å; L565-N574 HydrophobicContact CD2-CB 4.44Å; L565-N574 HydrophobicContact CG-CB 4.43Å; C566-N574 PolarHBondContact O-ND2 2.89Å; K568-N574 HydrophobicContact CD-CB 4.19Å; K568-N574 WeakPolarHBondContact CE-OD1 3.46Å; K568-N574 PolarHBondContact NZ-OD1 2.9Å; N574-Q618 WeakPolarHBondContact O-CB 3.18Å; N574-Q618 PolarHBondContact O-N 2.72Å
575	S	83.5	Confident	81.1	Confident	50 Å²	50	61.6 Å²	61.6	35%	0.35	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.4	-176.2	59.4	0	0	0	0	110.6	M615 L616	S575-M615 VanDerWaalsContact CB-SD 3.59Å; S575-L616 CarbonylContact C-O 3.55Å; S575-L616 VanDerWaalsContact CA-O 3.31Å; S575-L616 WeakPolarHBondContact CA-O 3.42Å
576	L	86.8	Confident	81	Confident	33 Å²	33	66.1 Å²	66.1	17%	0.173	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.4	-177.2	-179.6	62.7	0	0	0	109.7	L563 L565 V578 M615 L616	L563-L576 HydrophobicContact CB-CD2 3.76Å; L563-L576 HydrophobicContact CD1-CD2 3.92Å; L563-L576 HydrophobicContact CD2-CD2 4.16Å; L563-L576 HydrophobicContact CG-CD2 4.17Å; L565-L576 HydrophobicContact CD1-CB 4.24Å; L576-V578 HydrophobicContact CD2-CG2 4.36Å; L576-V578 HydrophobicContact CG-CG2 4.36Å; L576-M615 CarbonylContact O-C 3.5Å; L576-M615 WeakPolarHBondContact O-CA 3.43Å; L576-L616 PolarHBondContact N-O 2.77Å; L576-L616 PolarHBondContact O-N 2.92Å
577	V	87.6	Confident	81.2	Confident	58 Å²	58	68 Å²	68	35%	0.352	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	124.4	165.4	-178.9	0	0	0	0	107.8	V579 Y609 A613 A614 M615	V577-V579 HydrophobicContact CG1-CG2 4.47Å; V577-Y609 HydrophobicContact CG1-CD1 4.13Å; V577-Y609 HydrophobicContact CG2-CD1 4.2Å; V577-Y609 HydrophobicContact CG2-CE1 4.23Å; V577-A613 HydrophobicContact CG1-CB 3.68Å; V577-A614 CarbonylContact C-O 3.56Å; V577-A614 WeakPolarHBondContact CA-O 3.26Å; V577-M615 HydrophobicContact CG2-CE 3.54Å; V577-M615 HydrophobicContact CG2-SD 4.07Å
578	V	88.8	Confident	81.5	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.012	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.5	168.8	-166.6	0	0	0	0	107.6	I559 L563 L576 A613 A614 L616 F631	I559-V578 HydrophobicContact CB-CG1 4.39Å; I559-V578 HydrophobicContact CG2-CG1 4.45Å; L563-V578 HydrophobicContact CD1-CB 4.39Å; L563-V578 HydrophobicContact CD1-CG1 3.89Å; L563-V578 HydrophobicContact CD1-CG2 3.58Å; L563-V578 HydrophobicContact CD2-CG1 4.38Å; L576-V578 HydrophobicContact CD2-CG2 4.36Å; L576-V578 HydrophobicContact CG-CG2 4.36Å; V578-A613 CarbonylContact O-C 3.55Å; V578-A613 VanDerWaalsContact O-CA 3.24Å; V578-A613 WeakPolarHBondContact O-CA 3.35Å; V578-A613 WeakPolarHBondContact O-CB 3.28Å; V578-A614 PolarHBondContact N-O 3.49Å; V578-A614 PolarHBondContact O-N 2.91Å; V578-L616 HydrophobicContact CG2-CB 4.07Å; V578-L616 HydrophobicContact CG2-CD2 4.4Å; V578-F631 HydrophobicContact CB-CZ 4.3Å; V578-F631 HydrophobicContact CG1-CZ 4.04Å; V578-F631 HydrophobicContact CG2-CZ 4.43Å
579	V	90.2	Very high	82.1	Confident	60 Å²	60	61.8 Å²	61.8	36%	0.364	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	141	170.7	-172.5	0	0	0	0	107.9	P560 V577 E581 A613	P560-V579 WeakPolarHBondContact CD-O 3.27Å; V577-V579 HydrophobicContact CG1-CG2 4.47Å; V579-E581 HydrophobicContact CG1-CG 4.41Å; V579-A613 HydrophobicContact CB-CB 4.38Å; V579-A613 HydrophobicContact CG2-CB 4.04Å
580	A	89.3	Confident	83.1	Confident	3 Å²	3	53.9 Å²	53.9	3%	0.025	32%	0.324	C	S	.	.			trans	-104.4	146.8	162.2	0	0	0	0	0	109.3	P557 T558 I559 F592 Y594 T612 V633	P557-A580 HydrophobicContact CB-CB 4.32Å; T558-A580 CarbonylContact O-C 3.58Å; T558-A580 WeakPolarHBondContact O-CA 3.49Å; T558-A580 WeakPolarHBondContact O-CB 3.44Å; I559-A580 HydrophobicContact CG2-CB 4Å; A580-F592 HydrophobicContact CB-CD2 3.82Å; A580-F592 HydrophobicContact CB-CE2 4.04Å; A580-F592 HydrophobicContact CB-CG 4.43Å; A580-F592 VanDerWaalsContact O-CE2 3.29Å; A580-F592 WeakPolarHBondContact O-CE2 3.31Å; A580-Y594 HydrophobicContact CB-CE1 4.38Å; A580-Y594 WeakPolarHBondContact CB-OH 3.35Å; A580-Y594 PolarHBondContact N-OH 3.25Å; A580-T612 PolarHBondContact N-O 3.49Å; A580-V633 HydrophobicContact CB-CG1 4.02Å
581	E	89.7	Confident	84.3	Confident	132 Å²	132	50.2 Å²	50.2	62%	0.617	31%	0.308	S	S	*	.	B	Isolated β-bridge	trans	-127.5	132	-179.7	-69.8	170.7	177.2	0	0	107.8	T558 V579	T558-E581 PolarHBondContact N-O 2.7Å; T558-E581 PolarHBondContact O-N 2.85Å; T558-E581 PolarHBondContact OG1-O 2.64Å; V579-E581 HydrophobicContact CG1-CG 4.41Å
582	D	90.6	Very high	85.6	Confident	24 Å²	24	48.6 Å²	48.6	13%	0.128	29%	0.288	C	S	.	.			trans	-129.6	153.4	175.4	-148.4	-13.8	0	0	0	108.2	N555 K556 P557 F592	N555-D582 VanDerWaalsContact CB-OD1 3.27Å; N555-D582 WeakPolarHBondContact CB-OD1 3.03Å; K556-D582 VanDerWaalsContact CA-OD2 3.31Å; K556-D582 WeakPolarHBondContact CA-OD2 3.44Å; K556-D582 PolarHBondContact N-OD1 2.87Å; P557-D582 WeakPolarHBondContact CA-OD2 3.47Å; P557-D582 HydrophobicContact CB-CB 4.48Å; P557-D582 WeakPolarHBondContact CD-OD2 3.28Å; P557-D582 VanDerWaalsContact CG-OD2 3.31Å; P557-D582 WeakPolarHBondContact CG-OD2 3.42Å; D582-F592 HydrophobicContact CB-CE1 3.89Å; D582-F592 HydrophobicContact CB-CZ 3.86Å
583	N	89.4	Confident	86.6	Confident	103 Å²	103	49.9 Å²	49.9	55%	0.551	29%	0.293	S	S	*	.	S	Bend	trans	-90	-29.9	-173.6	-56.1	-35.9	0	0	0	112.2	E518 N555	E518-N583 HydrophobicContact CB-CB 4.28Å; E518-N583 HydrophobicContact CG-CB 3.39Å; N555-N583 PolarHBondContact OD1-ND2 2.83Å; N555-N583 VanDerWaalsContact OD1-ND2 3.13Å
584	D	90.3	Very high	87.2	Confident	5 Å²	5	47 Å²	47	3%	0.027	28%	0.277	C	S	.	.	S	Bend	trans	-51.7	149.9	175.5	-58.5	0.3	0	0	0	112.4	N553 N555 F588 S589	N553-D584 WeakPolarHBondContact CA-OD2 3.32Å; N553-D584 PolarHBondContact ND2-OD2 2.86Å; N555-D584 WeakPolarHBondContact CB-OD1 3.19Å; N555-D584 PolarHBondContact N-OD1 3.39Å; N555-D584 PolarHBondContact ND2-OD1 2.9Å; D584-F588 HydrophobicContact CB-CB 3.93Å; D584-S589 WeakPolarHBondContact O-CB 3.23Å; D584-S589 PolarHBondContact O-OG 3.49Å
585	A	87.4	Confident	87.8	Confident	25 Å²	25	48.2 Å²	48.2	21%	0.207	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-65.6	168.8	172.1	0	0	0	0	0	112.8	D551 F588 S589	D551-A585 HydrophobicContact CB-CB 3.92Å; D551-A585 WeakPolarHBondContact OD1-CB 3.41Å; D551-A585 PolarHBondContact OD1-N 2.85Å; D551-A585 WeakPolarHBondContact OD2-CA 3.45Å; D551-A585 VanDerWaalsContact OD2-CB 3.31Å; D551-A585 WeakPolarHBondContact OD2-CB 3.49Å; D551-A585 PolarHBondContact OD2-N 3.32Å; A585-F588 WeakPolarHBondContact O-CA 3.35Å; A585-F588 PolarHBondContact O-N 2.97Å; A585-S589 PolarHBondContact O-N 3.07Å; A585-S589 PolarHBondContact O-OG 2.9Å
586	S	84.1	Confident	87.9	Confident	101 Å²	101	48 Å²	48	71%	0.706	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	125.8	157.4	167.4	0	0	0	0	108.2
587	P	85	Confident	87.9	Confident	73 Å²	73	47.2 Å²	47.2	47%	0.474	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	cis	-106.9	11.6	26.1	40.9	-37.5	0	0	0	115.7	Q637	P587-Q637 PolarHBondContact O-NE2 3.2Å
588	F	85.4	Confident	87.5	Confident	51 Å²	51	49.8 Å²	49.8	22%	0.224	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-25.5	-173.9	-65.7	-62.7	0	0	0	113.6	D551 N553 D584 A585 D635 Q637	D551-F588 HydrophobicContact CB-CD2 4.39Å; D551-F588 VanDerWaalsContact O-CE2 3.31Å; D551-F588 WeakPolarHBondContact O-CE2 3.4Å; D551-F588 VanDerWaalsContact OD2-CD2 3.3Å; D551-F588 WeakPolarHBondContact OD2-CD2 3.5Å; N553-F588 HydrophobicContact CB-CB 4.02Å; N553-F588 HydrophobicContact CB-CD1 3.68Å; N553-F588 HydrophobicContact CB-CE1 4.36Å; N553-F588 HydrophobicContact CB-CG 3.98Å; N553-F588 PolarHBondContact ND2-O 2.72Å; D584-F588 HydrophobicContact CB-CB 3.93Å; A585-F588 WeakPolarHBondContact O-CA 3.35Å; A585-F588 PolarHBondContact O-N 2.97Å; F588-D635 WeakPolarHBondContact O-CB 3.32Å; F588-Q637 HydrophobicContact CD1-CG 4.03Å; F588-Q637 HydrophobicContact CE1-CG 4.31Å
589	S	85.9	Confident	86.9	Confident	16 Å²	16	59.1 Å²	59.1	11%	0.112	35%	0.346	C	S	.	.	S	Bend	trans	-81.8	-107.3	169.3	55	0	0	0	0	113.6	D584 A585 F592	D584-S589 WeakPolarHBondContact O-CB 3.23Å; D584-S589 PolarHBondContact O-OG 3.49Å; A585-S589 PolarHBondContact O-N 3.07Å; A585-S589 PolarHBondContact O-OG 2.9Å; S589-F592 WeakPolarHBondContact O-CD1 3.5Å; S589-F592 WeakPolarHBondContact O-CE1 3.4Å
590	S	85.5	Confident	86.4	Confident	43 Å²	43	60.5 Å²	60.5	30%	0.301	35%	0.349	S	S	.	.	S	Bend	trans	-86	145.8	-170.9	86.7	0	0	0	0	112.2
591	P	87.6	Confident	85.9	Confident	60 Å²	60	66.8 Å²	66.8	39%	0.39	38%	0.382	S	S	.	.	S	Bend	cis	-87.8	140.4	15	33	-37.8	0	0	0	116.4	G611 M636	P591-G611 CarbonylContact C-O 3.58Å; P591-G611 VanDerWaalsContact CA-O 3.32Å; P591-G611 WeakPolarHBondContact CA-O 3.33Å; P591-M636 VanDerWaalsContact CD-SD 3.59Å; P591-M636 HydrophobicContact CG-CG 3.89Å; P591-M636 HydrophobicContact CG-SD 3.69Å; P591-M636 WeakPolarHBondContact O-CG 3.4Å
592	F	89.7	Confident	85.4	Confident	12 Å²	12	62 Å²	62	5%	0.053	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-92.3	147.4	-178.8	-46.7	-61.7	0	0	0	113.3	P557 A580 D582 S589 Y594 G611 T612 V633 K634	P557-F592 HydrophobicContact CB-CD1 3.59Å; P557-F592 HydrophobicContact CB-CE1 3.66Å; P557-F592 HydrophobicContact CB-CG 4.14Å; P557-F592 HydrophobicContact CB-CZ 4.27Å; P557-F592 HydrophobicContact CG-CD1 3.31Å; P557-F592 HydrophobicContact CG-CE1 3.49Å; P557-F592 VanDerWaalsContact CG-CE1 3.49Å; P557-F592 HydrophobicContact CG-CG 4.24Å; A580-F592 HydrophobicContact CB-CD2 3.82Å; A580-F592 HydrophobicContact CB-CE2 4.04Å; A580-F592 HydrophobicContact CB-CG 4.43Å; A580-F592 VanDerWaalsContact O-CE2 3.29Å; A580-F592 WeakPolarHBondContact O-CE2 3.31Å; D582-F592 HydrophobicContact CB-CE1 3.89Å; D582-F592 HydrophobicContact CB-CZ 3.86Å; S589-F592 WeakPolarHBondContact O-CD1 3.5Å; S589-F592 WeakPolarHBondContact O-CE1 3.4Å; F592-Y594 HydrophobicContact CB-CD2 4.45Å; F592-Y594 HydrophobicContact CB-CE2 3.78Å; F592-Y594 WeakPolarHBondContact O-CD2 3.5Å; F592-G611 PolarHBondContact N-O 2.84Å; F592-T612 HydrophobicContact CE2-CG2 4.44Å; F592-V633 HydrophobicContact CB-CG1 4.05Å; F592-K634 CarbonylContact C-O 3.54Å; F592-K634 VanDerWaalsContact CA-O 3.23Å; F592-K634 WeakPolarHBondContact CA-O 3.47Å; F592-K634 WeakPolarHBondContact CB-O 3.33Å
593	T	88.1	Confident	85.1	Confident	78 Å²	78	62.7 Å²	62.7	48%	0.479	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.2	172.2	64.2	0	0	0	0	111.5	V633 K634	T593-V633 WeakPolarHBondContact O-CA 3.19Å; T593-K634 PolarHBondContact N-O 2.85Å; T593-K634 PolarHBondContact O-N 3.02Å
594	Y	89.6	Confident	84.9	Confident	27 Å²	27	58.5 Å²	58.5	11%	0.106	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.7	-170.9	-67.4	-97.2	0	0	0	111.5	A580 F592 V606 T612 A613 A614 F631 I632 V633	A580-Y594 HydrophobicContact CB-CE1 4.38Å; A580-Y594 WeakPolarHBondContact CB-OH 3.35Å; A580-Y594 PolarHBondContact N-OH 3.25Å; F592-Y594 HydrophobicContact CB-CD2 4.45Å; F592-Y594 HydrophobicContact CB-CE2 3.78Å; F592-Y594 WeakPolarHBondContact O-CD2 3.5Å; Y594-V606 HydrophobicContact CD1-CG2 4.44Å; Y594-T612 PolarHBondContact OH-O 3.41Å; Y594-A613 WeakPolarHBondContact OH-CA 3.43Å; Y594-A614 HydrophobicContact CD1-CB 3.48Å; Y594-A614 VanDerWaalsContact CD1-CB 3.48Å; Y594-A614 HydrophobicContact CD2-CB 3.81Å; Y594-A614 HydrophobicContact CE1-CB 3.71Å; Y594-A614 HydrophobicContact CE2-CB 4.02Å; Y594-A614 HydrophobicContact CG-CB 3.53Å; Y594-F631 HydrophobicContact CD1-CD2 4.19Å; Y594-F631 AromaticContact CD1-CE2 4Å; Y594-F631 HydrophobicContact CD1-CE2 4Å; Y594-F631 HydrophobicContact CE1-CE2 4.18Å; Y594-I632 WeakPolarHBondContact CA-O 3.5Å; Y594-V633 HydrophobicContact CD1-CB 4.46Å; Y594-V633 HydrophobicContact CD1-CG1 4.09Å; Y594-V633 HydrophobicContact CD1-CG2 3.78Å; Y594-V633 HydrophobicContact CE1-CB 4.44Å; Y594-V633 HydrophobicContact CE1-CG1 3.78Å; Y594-V633 HydrophobicContact CE1-CG2 3.79Å
595	S	88.3	Confident	84.8	Confident	57 Å²	57	61.8 Å²	61.8	40%	0.399	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	157.7	178.4	57.6	0	0	0	0	113.9	I632	S595-I632 PolarHBondContact N-O 2.71Å; S595-I632 PolarHBondContact O-N 2.99Å
596	M	87.2	Confident	84.8	Confident	46 Å²	46	61.5 Å²	61.5	23%	0.227	36%	0.359	C	S	.	.			trans	-82.8	141.8	174.5	-60	-58.9	-71.4	0	0	110.7	H600 W604 V606 F631	M596-H600 HydrophobicContact CE-CB 4.09Å; M596-W604 HydrophobicContact CE-CB 4.36Å; M596-V606 HydrophobicContact CG-CG1 4.01Å; M596-V606 HydrophobicContact SD-CB 3.98Å; M596-V606 HydrophobicContact SD-CG1 3.72Å; M596-F631 HydrophobicContact SD-CB 4.27Å
597	P	85.7	Confident	84.9	Confident	15 Å²	15	58.3 Å²	58.3	10%	0.097	34%	0.337	C	S	.	.			trans	-67.9	155	176.4	-14.6	30.4	0	0	0	111.4	K599 H600 S630 I632 T642	P597-K599 CarbonylContact O-C 3.57Å; P597-K599 PolarHBondContact O-N 2.86Å; P597-H600 PolarHBondContact O-ND1 3.42Å; P597-S630 WeakPolarHBondContact CD-O 3.36Å; P597-I632 HydrophobicContact CB-CD1 4.49Å; P597-I632 HydrophobicContact CG-CG1 4.24Å; P597-T642 HydrophobicContact CG-CG2 3.97Å
598	A	79.9	Confident	84.9	Confident	113 Å²	113	58.6 Å²	58.6	93%	0.934	34%	0.341	S	S	*	.	S	Bend	trans	-60.4	-15.6	179.2	0	0	0	0	0	114.5
599	K	75.9	Confident	84.9	Confident	197 Å²	197	63 Å²	63	86%	0.857	36%	0.357	S	S	*	.	S	Bend	trans	-119.4	107.1	166.9	-65.7	179.4	-179.2	177.8	0	108.3	P597	P597-K599 CarbonylContact O-C 3.57Å; P597-K599 PolarHBondContact O-N 2.86Å
600	H	80.6	Confident	84.9	Confident	90 Å²	90	65.8 Å²	65.8	42%	0.417	37%	0.37	S	S	.	.			trans	-148.8	153.5	175.1	66.6	-85.4	0	0	0	110.4	M596 P597 G602	M596-H600 HydrophobicContact CE-CB 4.09Å; P597-H600 PolarHBondContact O-ND1 3.42Å; H600-G602 PolarHBondContact CD2-N 3.04Å; H600-G602 PolarHBondContact O-N 3.11Å
601	D	78.1	Confident	84.7	Confident	135 Å²	135	65.2 Å²	65.2	72%	0.722	37%	0.371	S	S	*	.			trans	-76.6	12.5	-167.4	-51.4	-24.4	0	0	0	114.9	N603	D601-N603 PolarHBondContact O-N 2.79Å; D601-N603 PolarHBondContact O-ND2 2.93Å
602	G	79.2	Confident	84.7	Confident	32 Å²	32	64.9 Å²	64.9	33%	0.33	37%	0.368	S	S	.	.	S	Bend	trans	64.3	-13.3	-178.2	0	0	0	0	0	117	H600 W604	H600-G602 PolarHBondContact CD2-N 3.04Å; H600-G602 PolarHBondContact O-N 3.11Å; G602-W604 VanDerWaalsContact C-N 3.25Å; G602-W604 PolarHBondContact O-N 3.41Å
603	N	84.2	Confident	84.7	Confident	37 Å²	37	64.4 Å²	64.4	20%	0.198	37%	0.366	C	S	.	.	S	Bend	trans	-68.1	-17.6	-172.9	-68.3	-48.6	0	0	0	115.2	D601 K619 L622	D601-N603 PolarHBondContact O-N 2.79Å; D601-N603 PolarHBondContact O-ND2 2.93Å; N603-K619 PolarHBondContact O-N 3.43Å; N603-L622 HydrophobicContact CB-CD1 4.25Å; N603-L622 HydrophobicContact CB-CD2 4.24Å
604	W	85.8	Confident	84.8	Confident	15 Å²	15	60.8 Å²	60.8	6%	0.057	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	157.6	-173.2	-59.4	96	0	0	0	111.5	L565 M596 G602 L616 K617 Q618 L622 V629 V647 I649	L565-W604 HydrophobicContact CD2-CH2 3.65Å; L565-W604 HydrophobicContact CD2-CZ3 3.89Å; M596-W604 HydrophobicContact CE-CB 4.36Å; G602-W604 VanDerWaalsContact C-N 3.25Å; G602-W604 PolarHBondContact O-N 3.41Å; W604-L616 HydrophobicContact CB-CD1 4.06Å; W604-L616 HydrophobicContact CE3-CD1 4.38Å; W604-L616 HydrophobicContact CE3-CD2 4.17Å; W604-L616 HydrophobicContact CE3-CG 3.89Å; W604-L616 HydrophobicContact CZ3-CD2 4.45Å; W604-L616 HydrophobicContact CZ3-CG 4.42Å; W604-K617 WeakPolarHBondContact CA-O 3.5Å; W604-Q618 HydrophobicContact CE3-CB 4.09Å; W604-Q618 HydrophobicContact CH2-CB 4.5Å; W604-Q618 HydrophobicContact CZ3-CB 3.83Å; W604-Q618 HydrophobicContact CZ3-CG 4.27Å; W604-L622 HydrophobicContact CH2-CD1 4.48Å; W604-L622 HydrophobicContact CZ2-CD1 3.53Å; W604-V629 HydrophobicContact CB-CG1 4.22Å; W604-V629 HydrophobicContact CD2-CG2 4.17Å; W604-V629 HydrophobicContact CG-CG1 3.99Å; W604-V629 HydrophobicContact CG-CG2 4.2Å; W604-V629 HydrophobicContact CZ2-CG2 4.16Å; W604-V647 HydrophobicContact CH2-CB 4.37Å; W604-V647 HydrophobicContact CH2-CG1 3.77Å; W604-V647 HydrophobicContact CZ2-CB 4.27Å; W604-V647 HydrophobicContact CZ2-CG1 4.11Å; W604-I649 HydrophobicContact CH2-CD1 4.1Å; W604-I649 HydrophobicContact CZ2-CD1 4.05Å
605	E	86.7	Confident	84.7	Confident	75 Å²	75	61 Å²	61	35%	0.35	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.3	173.5	173.2	167.3	-105.8	0	0	109.4	L616 K617 K619	E605-L616 CarbonylContact O-C 3.6Å; E605-K617 PolarHBondContact N-O 2.9Å; E605-K617 PolarHBondContact O-N 3.38Å; E605-K619 HydrophobicContact CB-CD 3.97Å; E605-K619 HydrophobicContact CB-CG 4.15Å; E605-K619 VanDerWaalsContact CD-NZ 3.28Å; E605-K619 WeakPolarHBondContact OE1-CE 3.49Å; E605-K619 IonicContact OE1-NZ 2.71Å; E605-K619 PolarHBondContact OE1-NZ 2.88Å; E605-K619 WeakPolarHBondContact OE2-CE 3.47Å; E605-K619 IonicContact OE2-NZ 3Å
606	V	88.3	Confident	84.8	Confident	19 Å²	19	58.3 Å²	58.3	12%	0.115	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.4	172.6	73.6	0	0	0	0	109.5	Y594 M596 A614 L616	Y594-V606 HydrophobicContact CD1-CG2 4.44Å; M596-V606 HydrophobicContact CG-CG1 4.01Å; M596-V606 HydrophobicContact SD-CB 3.98Å; M596-V606 HydrophobicContact SD-CG1 3.72Å; V606-A614 HydrophobicContact CG2-CB 3.58Å; V606-L616 HydrophobicContact CB-CD1 4.43Å
607	S	86.8	Confident	84.7	Confident	34 Å²	34	60.1 Å²	60.1	24%	0.238	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.6	170.6	55.7	0	0	0	0	108.4	M615 K617	S607-M615 PolarHBondContact N-O 2.98Å; S607-M615 VanDerWaalsContact N-O 3.07Å; S607-M615 PolarHBondContact O-N 2.67Å; S607-M615 PolarHBondContact OG-O 2.79Å; S607-K617 WeakPolarHBondContact OG-CE 3.22Å; S607-K617 PolarHBondContact OG-NZ 3.2Å
608	S	84.1	Confident	84.7	Confident	79 Å²	79	60.5 Å²	60.5	55%	0.552	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.7	142	174.5	170.2	0	0	0	0	110.8	N610	S608-N610 PolarHBondContact OG-O 2.74Å
609	Y	86.3	Confident	84.8	Confident	144 Å²	144	60 Å²	60	57%	0.565	31%	0.311	S	S	*	.			trans	-112	-44.4	178.4	176.7	-112.3	0	0	0	110.9	V577 A613 M615	V577-Y609 HydrophobicContact CG1-CD1 4.13Å; V577-Y609 HydrophobicContact CG2-CD1 4.2Å; V577-Y609 HydrophobicContact CG2-CE1 4.23Å; Y609-A613 WeakPolarHBondContact CB-O 3.48Å; Y609-A613 PolarHBondContact N-O 3.08Å; Y609-M615 HydrophobicContact CD2-CE 3.63Å; Y609-M615 HydrophobicContact CE2-CE 3.83Å; Y609-M615 HydrophobicContact CG-CE 4.2Å
610	N	86.3	Confident	85	Confident	74 Å²	74	56.2 Å²	56.2	40%	0.396	30%	0.297	S	S	.	.	S	Bend	trans	-149.4	-164.7	167.4	67.6	2.4	0	0	0	108.7	S608 T612 A613	S608-N610 PolarHBondContact OG-O 2.74Å; N610-T612 PolarHBondContact OD1-N 2.79Å; N610-T612 VanDerWaalsContact OD1-N 3.14Å; N610-T612 PolarHBondContact OD1-OG1 3.16Å; N610-A613 PolarHBondContact N-O 2.87Å; N610-A613 VanDerWaalsContact N-O 3.1Å; N610-A613 WeakPolarHBondContact OD1-CA 3.39Å; N610-A613 VanDerWaalsContact OD1-CB 3.3Å; N610-A613 WeakPolarHBondContact OD1-CB 3.5Å; N610-A613 PolarHBondContact OD1-N 3.13Å
611	G	81.5	Confident	84.7	Confident	30 Å²	30	55.6 Å²	55.6	31%	0.309	31%	0.307	S	S	.	.	S	Bend	trans	-66.3	-35.5	178.7	0	0	0	0	0	114.7	P591 F592	P591-G611 CarbonylContact C-O 3.58Å; P591-G611 VanDerWaalsContact CA-O 3.32Å; P591-G611 WeakPolarHBondContact CA-O 3.33Å; F592-G611 PolarHBondContact N-O 2.84Å
612	T	86.5	Confident	84.9	Confident	54 Å²	54	50.2 Å²	50.2	33%	0.331	28%	0.278	S	S	.	.	S	Bend	trans	-95.4	-12.9	-176.7	49.3	0	0	0	0	114	A580 F592 Y594 N610	A580-T612 PolarHBondContact N-O 3.49Å; F592-T612 HydrophobicContact CE2-CG2 4.44Å; Y594-T612 PolarHBondContact OH-O 3.41Å; N610-T612 PolarHBondContact OD1-N 2.79Å; N610-T612 VanDerWaalsContact OD1-N 3.14Å; N610-T612 PolarHBondContact OD1-OG1 3.16Å
613	A	89.5	Confident	84.9	Confident	2 Å²	2	53 Å²	53	2%	0.017	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.4	-168.8	0	0	0	0	0	114.4	V577 V578 V579 Y594 Y609 N610	V577-A613 HydrophobicContact CG1-CB 3.68Å; V578-A613 CarbonylContact O-C 3.55Å; V578-A613 VanDerWaalsContact O-CA 3.24Å; V578-A613 WeakPolarHBondContact O-CA 3.35Å; V578-A613 WeakPolarHBondContact O-CB 3.28Å; V579-A613 HydrophobicContact CB-CB 4.38Å; V579-A613 HydrophobicContact CG2-CB 4.04Å; Y594-A613 WeakPolarHBondContact OH-CA 3.43Å; Y609-A613 WeakPolarHBondContact CB-O 3.48Å; Y609-A613 PolarHBondContact N-O 3.08Å; N610-A613 PolarHBondContact N-O 2.87Å; N610-A613 VanDerWaalsContact N-O 3.1Å; N610-A613 WeakPolarHBondContact OD1-CA 3.39Å; N610-A613 VanDerWaalsContact OD1-CB 3.3Å; N610-A613 WeakPolarHBondContact OD1-CB 3.5Å; N610-A613 PolarHBondContact OD1-N 3.13Å
614	A	89.8	Confident	84.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.4	173	0	0	0	0	0	112.8	V577 V578 Y594 V606	V577-A614 CarbonylContact C-O 3.56Å; V577-A614 WeakPolarHBondContact CA-O 3.26Å; V578-A614 PolarHBondContact N-O 3.49Å; V578-A614 PolarHBondContact O-N 2.91Å; Y594-A614 HydrophobicContact CD1-CB 3.48Å; Y594-A614 VanDerWaalsContact CD1-CB 3.48Å; Y594-A614 HydrophobicContact CD2-CB 3.81Å; Y594-A614 HydrophobicContact CE1-CB 3.71Å; Y594-A614 HydrophobicContact CE2-CB 4.02Å; Y594-A614 HydrophobicContact CG-CB 3.53Å; V606-A614 HydrophobicContact CG2-CB 3.58Å
615	M	88.9	Confident	84.4	Confident	31 Å²	31	56.4 Å²	56.4	15%	0.153	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	106.4	169.3	-169.6	66.9	66.2	0	0	109.3	S575 L576 V577 S607 Y609 K617	S575-M615 VanDerWaalsContact CB-SD 3.59Å; L576-M615 CarbonylContact O-C 3.5Å; L576-M615 WeakPolarHBondContact O-CA 3.43Å; V577-M615 HydrophobicContact CG2-CE 3.54Å; V577-M615 HydrophobicContact CG2-SD 4.07Å; S607-M615 PolarHBondContact N-O 2.98Å; S607-M615 VanDerWaalsContact N-O 3.07Å; S607-M615 PolarHBondContact O-N 2.67Å; S607-M615 PolarHBondContact OG-O 2.79Å; Y609-M615 HydrophobicContact CD2-CE 3.63Å; Y609-M615 HydrophobicContact CE2-CE 3.83Å; Y609-M615 HydrophobicContact CG-CE 4.2Å; M615-K617 HydrophobicContact CG-CG 3.91Å; M615-K617 PolarHBondContact O-N 2.84Å
616	L	89.3	Confident	84.4	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	106.1	170.4	-175.6	67.5	0	0	0	109.1	S575 L576 V578 W604 E605 V606 V629 V647	S575-L616 CarbonylContact C-O 3.55Å; S575-L616 VanDerWaalsContact CA-O 3.31Å; S575-L616 WeakPolarHBondContact CA-O 3.42Å; L576-L616 PolarHBondContact N-O 2.77Å; L576-L616 PolarHBondContact O-N 2.92Å; V578-L616 HydrophobicContact CG2-CB 4.07Å; V578-L616 HydrophobicContact CG2-CD2 4.4Å; W604-L616 HydrophobicContact CB-CD1 4.06Å; W604-L616 HydrophobicContact CE3-CD1 4.38Å; W604-L616 HydrophobicContact CE3-CD2 4.17Å; W604-L616 HydrophobicContact CE3-CG 3.89Å; W604-L616 HydrophobicContact CZ3-CD2 4.45Å; W604-L616 HydrophobicContact CZ3-CG 4.42Å; E605-L616 CarbonylContact O-C 3.6Å; V606-L616 HydrophobicContact CB-CD1 4.43Å; L616-V629 HydrophobicContact CD1-CG1 4.14Å; L616-V629 HydrophobicContact CD2-CG1 4.2Å; L616-V647 HydrophobicContact CD2-CG2 4.05Å
617	K	86.2	Confident	84.3	Confident	84 Å²	84	59 Å²	59	37%	0.365	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.2	-178.3	-63.8	170.5	-178.4	152	0	110.4	W604 E605 S607 M615	W604-K617 WeakPolarHBondContact CA-O 3.5Å; E605-K617 PolarHBondContact N-O 2.9Å; E605-K617 PolarHBondContact O-N 3.38Å; S607-K617 WeakPolarHBondContact OG-CE 3.22Å; S607-K617 PolarHBondContact OG-NZ 3.2Å; M615-K617 HydrophobicContact CG-CG 3.91Å; M615-K617 PolarHBondContact O-N 2.84Å
618	Q	85.9	Confident	84.2	Confident	23 Å²	23	65 Å²	65	11%	0.107	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.7	171.9	-172.5	173.5	31	0	0	110.1	L573 N574 W604 Q620 L622	L573-Q618 HydrophobicContact CD2-CB 4.41Å; L573-Q618 HydrophobicContact CD2-CG 4.02Å; N574-Q618 WeakPolarHBondContact O-CB 3.18Å; N574-Q618 PolarHBondContact O-N 2.72Å; W604-Q618 HydrophobicContact CE3-CB 4.09Å; W604-Q618 HydrophobicContact CH2-CB 4.5Å; W604-Q618 HydrophobicContact CZ3-CB 3.83Å; W604-Q618 HydrophobicContact CZ3-CG 4.27Å; Q618-Q620 WeakPolarHBondContact CG-O 3.39Å; Q618-Q620 PolarHBondContact NE2-O 2.75Å; Q618-Q620 VanDerWaalsContact NE2-O 3.09Å; Q618-L622 VanDerWaalsContact NE2-N 3.11Å
619	K	81.7	Confident	84.4	Confident	103 Å²	103	61.4 Å²	61.4	45%	0.448	33%	0.327	S	S	.	.	S	Bend	trans	-91.6	-28	176.5	-92.4	-177	170.1	163.9	0	113.9	N603 E605	N603-K619 PolarHBondContact O-N 3.43Å; E605-K619 HydrophobicContact CB-CD 3.97Å; E605-K619 HydrophobicContact CB-CG 4.15Å; E605-K619 VanDerWaalsContact CD-NZ 3.28Å; E605-K619 WeakPolarHBondContact OE1-CE 3.49Å; E605-K619 IonicContact OE1-NZ 2.71Å; E605-K619 PolarHBondContact OE1-NZ 2.88Å; E605-K619 WeakPolarHBondContact OE2-CE 3.47Å; E605-K619 IonicContact OE2-NZ 3Å
620	Q	78.9	Confident	84.5	Confident	118 Å²	118	56.6 Å²	56.6	55%	0.551	32%	0.315	S	S	*	.	S	Bend	trans	-134	145.8	177.8	-59.8	-168.6	24	0	0	111.2	Q618 L622	Q618-Q620 WeakPolarHBondContact CG-O 3.39Å; Q618-Q620 PolarHBondContact NE2-O 2.75Å; Q618-Q620 VanDerWaalsContact NE2-O 3.09Å; Q620-L622 PolarHBondContact O-N 3.49Å
621	A	75.6	Confident	84.6	Confident	77 Å²	77	53.1 Å²	53.1	64%	0.636	30%	0.296	S	S	*	.			trans	-71.8	96.6	-176.6	0	0	0	0	0	111.8
622	L	80.7	Confident	84.9	Confident	22 Å²	22	53.4 Å²	53.4	12%	0.115	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-79.1	152.6	-178.8	-68.2	170.8	0	0	0	112.9	N603 W604 Q618 Q620 I649	N603-L622 HydrophobicContact CB-CD1 4.25Å; N603-L622 HydrophobicContact CB-CD2 4.24Å; W604-L622 HydrophobicContact CH2-CD1 4.48Å; W604-L622 HydrophobicContact CZ2-CD1 3.53Å; Q618-L622 VanDerWaalsContact NE2-N 3.11Å; Q620-L622 PolarHBondContact O-N 3.49Å; L622-I649 HydrophobicContact CB-CD1 3.65Å; L622-I649 HydrophobicContact CD1-CD1 3.99Å; L622-I649 HydrophobicContact CG-CD1 4.47Å
623	P	79.6	Confident	85.1	Confident	89 Å²	89	50.8 Å²	50.8	58%	0.578	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-68.5	161.8	174.7	29.4	-35.9	0	0	0	112.5	G625 H627	P623-G625 PolarHBondContact O-N 2.54Å; P623-H627 PolarHBondContact O-NE2 3.21Å
624	L	80.6	Confident	85	Confident	93 Å²	93	54 Å²	54	49%	0.487	29%	0.288	S	S	.	.	S	Bend	trans	-65.1	129.8	173.2	-54.9	-178.3	0	0	0	109.8	K567 I649 Q651	K567-L624 HydrophobicContact CB-CD2 4.27Å; K567-L624 HydrophobicContact CD-CD2 3.99Å; L624-I649 WeakPolarHBondContact CA-O 3.4Å; L624-I649 HydrophobicContact CD2-CG2 4.08Å; L624-Q651 HydrophobicContact CD1-CG 4.27Å
625	G	80.1	Confident	84.9	Confident	32 Å²	32	54.1 Å²	54.1	33%	0.33	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.3	-170.4	-172.9	0	0	0	0	0	113.6	P623 R648 I649	P623-G625 PolarHBondContact O-N 2.54Å; G625-R648 CarbonylContact O-C 3.49Å; G625-R648 WeakPolarHBondContact O-CA 3.4Å; G625-I649 PolarHBondContact N-O 2.76Å; G625-I649 PolarHBondContact O-N 3.45Å
626	L	84.9	Confident	84.6	Confident	113 Å²	113	58.6 Å²	58.6	59%	0.592	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.3	172.6	-65.9	170.4	0	0	0	108.8	T646 R648	L626-T646 HydrophobicContact CB-CG2 3.84Å; L626-T646 HydrophobicContact CD2-CG2 3.89Å; L626-T646 HydrophobicContact CG-CG2 4.34Å; L626-R648 HydrophobicContact CD2-CB 3.76Å; L626-R648 HydrophobicContact CD2-CG 3.79Å
627	H	86.8	Confident	84.2	Confident	36 Å²	36	62.9 Å²	62.9	17%	0.167	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.7	179.4	-63.2	-87.8	0	0	0	109.2	P623 T646 V647	P623-H627 PolarHBondContact O-NE2 3.21Å; H627-T646 CarbonylContact O-C 3.58Å; H627-V647 PolarHBondContact N-O 2.89Å; H627-V647 PolarHBondContact O-N 3.42Å
628	K	85.8	Confident	84	Confident	158 Å²	158	60.6 Å²	60.6	69%	0.687	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	131.7	172.4	-68.9	-174.5	177.3	-175.6	0	108.8	T644	K628-T644 HydrophobicContact CB-CG2 4.04Å; K628-T644 HydrophobicContact CG-CG2 4.48Å
629	V	88.1	Confident	83.8	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.024	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.3	177.6	-168.7	0	0	0	0	107.8	W604 L616 F631 T644 T645 V647	W604-V629 HydrophobicContact CB-CG1 4.22Å; W604-V629 HydrophobicContact CD2-CG2 4.17Å; W604-V629 HydrophobicContact CG-CG1 3.99Å; W604-V629 HydrophobicContact CG-CG2 4.2Å; W604-V629 HydrophobicContact CZ2-CG2 4.16Å; L616-V629 HydrophobicContact CD1-CG1 4.14Å; L616-V629 HydrophobicContact CD2-CG1 4.2Å; V629-F631 HydrophobicContact CG1-CD1 4.31Å; V629-T644 WeakPolarHBondContact O-CA 3.44Å; V629-T645 HydrophobicContact CB-CG2 4.43Å; V629-T645 PolarHBondContact N-O 3.01Å; V629-T645 PolarHBondContact O-N 3.2Å; V629-V647 HydrophobicContact CB-CG2 4.36Å; V629-V647 HydrophobicContact CG2-CB 4.2Å; V629-V647 HydrophobicContact CG2-CG2 3.64Å
630	S	88.1	Confident	83.9	Confident	44 Å²	44	58.2 Å²	58.2	31%	0.308	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.9	178.5	-53.3	0	0	0	0	110.4	P597 Q643 T644	P597-S630 WeakPolarHBondContact CD-O 3.36Å; S630-Q643 CarbonylContact C-O 3.48Å; S630-Q643 WeakPolarHBondContact CA-O 3.4Å; S630-T644 WeakPolarHBondContact OG-CG2 3.44Å; S630-T644 PolarHBondContact OG-OG1 2.86Å
631	F	87.4	Confident	84.4	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.9	172.9	57.2	-90.9	0	0	0	111.4	I559 V578 Y594 M596 V629 V633 Q643 T645	I559-F631 HydrophobicContact CD1-CE1 3.85Å; I559-F631 HydrophobicContact CD1-CE2 3.8Å; I559-F631 HydrophobicContact CD1-CZ 3.42Å; I559-F631 VanDerWaalsContact CD1-CZ 3.42Å; I559-F631 HydrophobicContact CG2-CE2 4.08Å; I559-F631 HydrophobicContact CG2-CZ 4.27Å; V578-F631 HydrophobicContact CB-CZ 4.3Å; V578-F631 HydrophobicContact CG1-CZ 4.04Å; V578-F631 HydrophobicContact CG2-CZ 4.43Å; Y594-F631 HydrophobicContact CD1-CD2 4.19Å; Y594-F631 AromaticContact CD1-CE2 4Å; Y594-F631 HydrophobicContact CD1-CE2 4Å; Y594-F631 HydrophobicContact CE1-CE2 4.18Å; M596-F631 HydrophobicContact SD-CB 4.27Å; V629-F631 HydrophobicContact CG1-CD1 4.31Å; F631-V633 HydrophobicContact CD2-CG2 3.65Å; F631-V633 HydrophobicContact CE2-CG2 3.57Å; F631-Q643 PolarHBondContact N-O 2.87Å; F631-Q643 PolarHBondContact O-N 2.7Å; F631-T645 HydrophobicContact CE1-CG2 3.77Å; F631-T645 HydrophobicContact CZ-CG2 4.45Å
632	I	88.6	Confident	85	Confident	36 Å²	36	54.3 Å²	54.3	19%	0.185	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.1	179.4	-58.3	174.8	0	0	0	107.4	Y594 S595 P597 K634 G641 T642	Y594-I632 WeakPolarHBondContact CA-O 3.5Å; S595-I632 PolarHBondContact N-O 2.71Å; S595-I632 PolarHBondContact O-N 2.99Å; P597-I632 HydrophobicContact CB-CD1 4.49Å; P597-I632 HydrophobicContact CG-CG1 4.24Å; I632-K634 HydrophobicContact CG2-CD 4.37Å; I632-K634 HydrophobicContact CG2-CG 4.06Å; I632-G641 WeakPolarHBondContact CA-O 3.36Å; I632-T642 WeakPolarHBondContact CG1-OG1 3.45Å
633	V	90.4	Very high	85.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.1	167.7	-165.3	0	0	0	0	107.9	P557 I559 A580 F592 T593 Y594 F631 G640 G641	P557-V633 HydrophobicContact CB-CG1 3.8Å; P557-V633 HydrophobicContact CG-CG1 4.48Å; I559-V633 HydrophobicContact CG2-CG2 3.81Å; A580-V633 HydrophobicContact CB-CG1 4.02Å; F592-V633 HydrophobicContact CB-CG1 4.05Å; T593-V633 WeakPolarHBondContact O-CA 3.19Å; Y594-V633 HydrophobicContact CD1-CB 4.46Å; Y594-V633 HydrophobicContact CD1-CG1 4.09Å; Y594-V633 HydrophobicContact CD1-CG2 3.78Å; Y594-V633 HydrophobicContact CE1-CB 4.44Å; Y594-V633 HydrophobicContact CE1-CG1 3.78Å; Y594-V633 HydrophobicContact CE1-CG2 3.79Å; F631-V633 HydrophobicContact CD2-CG2 3.65Å; F631-V633 HydrophobicContact CE2-CG2 3.57Å; V633-G640 CarbonylContact O-C 3.57Å; V633-G641 PolarHBondContact N-O 3.48Å; V633-G641 VanDerWaalsContact N-O 3.13Å; V633-G641 PolarHBondContact O-N 2.88Å
634	K	88.1	Confident	85.9	Confident	70 Å²	70	54.8 Å²	54.8	30%	0.304	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.6	177.1	-67.7	-178.7	162.6	-67	0	110	F592 T593 I632 G638 N639 G640	F592-K634 CarbonylContact C-O 3.54Å; F592-K634 VanDerWaalsContact CA-O 3.23Å; F592-K634 WeakPolarHBondContact CA-O 3.47Å; F592-K634 WeakPolarHBondContact CB-O 3.33Å; T593-K634 PolarHBondContact N-O 2.85Å; T593-K634 PolarHBondContact O-N 3.02Å; I632-K634 HydrophobicContact CG2-CD 4.37Å; I632-K634 HydrophobicContact CG2-CG 4.06Å; K634-G638 PolarHBondContact NZ-O 3.27Å; K634-N639 WeakPolarHBondContact CA-O 3.47Å; K634-N639 WeakPolarHBondContact CB-O 3.29Å; K634-N639 WeakPolarHBondContact CG-O 3.35Å; K634-G640 PolarHBondContact NZ-O 3.45Å
635	D	87.4	Confident	86.3	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.011	29%	0.286	C	S	.	.			trans	-73.7	-163.3	168.7	49.3	59.3	0	0	0	112.3	P557 F588 Q637 G638 N639	P557-D635 HydrophobicContact CG-CB 4.18Å; F588-D635 WeakPolarHBondContact O-CB 3.32Å; D635-Q637 WeakPolarHBondContact OD1-CA 3.16Å; D635-Q637 WeakPolarHBondContact OD1-CB 3.35Å; D635-Q637 PolarHBondContact OD1-N 3.23Å; D635-Q637 PolarHBondContact OD1-OE1 3.5Å; D635-G638 PolarHBondContact OD1-N 2.99Å; D635-N639 PolarHBondContact N-O 3.11Å; D635-N639 PolarHBondContact OD1-N 2.78Å; D635-N639 VanDerWaalsContact OD2-CA 3.32Å; D635-N639 WeakPolarHBondContact OD2-CA 3.49Å; D635-N639 WeakPolarHBondContact OD2-CB 3.43Å; D635-N639 PolarHBondContact OD2-N 3.13Å; D635-N639 VanDerWaalsContact OD2-O 3.11Å
636	M	82.8	Confident	86.7	Confident	125 Å²	125	50.3 Å²	50.3	62%	0.616	28%	0.279	S	S	*	.	S	Bend	trans	-76.9	-28	175.4	-76.8	-159.9	62.5	0	0	113.6	P591	P591-M636 VanDerWaalsContact CD-SD 3.59Å; P591-M636 HydrophobicContact CG-CG 3.89Å; P591-M636 HydrophobicContact CG-SD 3.69Å; P591-M636 WeakPolarHBondContact O-CG 3.4Å
637	Q	81.4	Confident	86.9	Confident	91 Å²	91	44.9 Å²	44.9	43%	0.425	25%	0.251	S	S	.	.	S	Bend	trans	-85.5	-21.5	-174.1	-65	73.2	6.7	0	0	111.1	P587 F588 D635	P587-Q637 PolarHBondContact O-NE2 3.2Å; F588-Q637 HydrophobicContact CD1-CG 4.03Å; F588-Q637 HydrophobicContact CE1-CG 4.31Å; D635-Q637 WeakPolarHBondContact OD1-CA 3.16Å; D635-Q637 WeakPolarHBondContact OD1-CB 3.35Å; D635-Q637 PolarHBondContact OD1-N 3.23Å; D635-Q637 PolarHBondContact OD1-OE1 3.5Å
638	G	80.4	Confident	86.8	Confident	36 Å²	36	48.5 Å²	48.5	37%	0.371	26%	0.263	S	S	.	.	S	Bend	trans	101.3	10.6	176.8	0	0	0	0	0	114.6	K634 D635	K634-G638 PolarHBondContact NZ-O 3.27Å; D635-G638 PolarHBondContact OD1-N 2.99Å
639	N	83.1	Confident	86.9	Confident	59 Å²	59	41.2 Å²	41.2	32%	0.316	23%	0.232	S	C	.	.			trans	-74.4	169.1	168	-178.7	17.7	0	0	0	109.3	N553 N555 K634 D635	N553-N639 WeakPolarHBondContact OD1-CB 3.49Å; N553-N639 PolarHBondContact OD1-ND2 3.44Å; N555-N639 PolarHBondContact O-ND2 3.47Å; K634-N639 WeakPolarHBondContact CA-O 3.47Å; K634-N639 WeakPolarHBondContact CB-O 3.29Å; K634-N639 WeakPolarHBondContact CG-O 3.35Å; D635-N639 PolarHBondContact N-O 3.11Å; D635-N639 PolarHBondContact OD1-N 2.78Å; D635-N639 VanDerWaalsContact OD2-CA 3.32Å; D635-N639 WeakPolarHBondContact OD2-CA 3.49Å; D635-N639 WeakPolarHBondContact OD2-CB 3.43Å; D635-N639 PolarHBondContact OD2-N 3.13Å; D635-N639 VanDerWaalsContact OD2-O 3.11Å
640	G	84	Confident	86.6	Confident	17 Å²	17	41.7 Å²	41.7	18%	0.175	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.4	177.6	-167.1	0	0	0	0	0	115.2	V633 K634	V633-G640 CarbonylContact O-C 3.57Å; K634-G640 PolarHBondContact NZ-O 3.45Å
641	G	88.3	Confident	86.2	Confident	29 Å²	29	45.4 Å²	45.4	30%	0.299	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	-164.2	-165.1	0	0	0	0	0	115.7	I632 V633 Q643	I632-G641 WeakPolarHBondContact CA-O 3.36Å; V633-G641 PolarHBondContact N-O 3.48Å; V633-G641 VanDerWaalsContact N-O 3.13Å; V633-G641 PolarHBondContact O-N 2.88Å; G641-Q643 PolarHBondContact O-N 3.45Å
642	T	89.1	Confident	85.6	Confident	85 Å²	85	47.1 Å²	47.1	52%	0.521	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	119.9	-179.3	-56.5	0	0	0	0	110.7	P597 I632	P597-T642 HydrophobicContact CG-CG2 3.97Å; I632-T642 WeakPolarHBondContact CG1-OG1 3.45Å
643	Q	89.3	Confident	84.7	Confident	45 Å²	45	49.9 Å²	49.9	21%	0.21	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	156.7	174.3	-67.8	-179.3	81.3	0	0	110.5	P557 I559 S630 F631 G641	P557-Q643 PolarHBondContact O-NE2 3.29Å; I559-Q643 HydrophobicContact CD1-CB 3.7Å; I559-Q643 HydrophobicContact CG1-CB 3.86Å; I559-Q643 VanDerWaalsContact N-OE1 3.13Å; S630-Q643 CarbonylContact C-O 3.48Å; S630-Q643 WeakPolarHBondContact CA-O 3.4Å; F631-Q643 PolarHBondContact N-O 2.87Å; F631-Q643 PolarHBondContact O-N 2.7Å; G641-Q643 PolarHBondContact O-N 3.45Å
644	T	88.8	Confident	83.4	Confident	75 Å²	75	58.2 Å²	58.2	46%	0.46	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	120.8	179.8	-56.8	0	0	0	0	110.3	K628 V629 S630	K628-T644 HydrophobicContact CB-CG2 4.04Å; K628-T644 HydrophobicContact CG-CG2 4.48Å; V629-T644 WeakPolarHBondContact O-CA 3.44Å; S630-T644 WeakPolarHBondContact OG-CG2 3.44Å; S630-T644 PolarHBondContact OG-OG1 2.86Å
645	T	88.8	Confident	82.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	156.2	174.9	-177.4	0	0	0	0	110.4	I559 P560 K561 L563 V629 F631 V647	I559-T645 HydrophobicContact CD1-CG2 4.12Å; P560-T645 VanDerWaalsContact O-CB 3.27Å; P560-T645 WeakPolarHBondContact O-CB 3.38Å; P560-T645 PolarHBondContact O-OG1 3.13Å; K561-T645 PolarHBondContact O-OG1 3.39Å; L563-T645 HydrophobicContact CD1-CG2 3.63Å; L563-T645 WeakPolarHBondContact CD1-OG1 3.1Å; L563-T645 WeakPolarHBondContact CG-OG1 3.39Å; V629-T645 HydrophobicContact CB-CG2 4.43Å; V629-T645 PolarHBondContact N-O 3.01Å; V629-T645 PolarHBondContact O-N 3.2Å; F631-T645 HydrophobicContact CE1-CG2 3.77Å; F631-T645 HydrophobicContact CZ-CG2 4.45Å; T645-V647 HydrophobicContact CG2-CG2 4.48Å
646	T	89.6	Confident	81.5	Confident	31 Å²	31	60.2 Å²	60.2	19%	0.19	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	105	178.6	-51.2	0	0	0	0	110.2	K561 L563 L626 H627 R648	K561-T646 PolarHBondContact O-N 3.18Å; L563-T646 PolarHBondContact N-O 3.29Å; L626-T646 HydrophobicContact CB-CG2 3.84Å; L626-T646 HydrophobicContact CD2-CG2 3.89Å; L626-T646 HydrophobicContact CG-CG2 4.34Å; H627-T646 CarbonylContact O-C 3.58Å; T646-R648 PolarHBondContact O-N 3.17Å
647	V	87.8	Confident	81.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	111.4	176.8	-176.4	0	0	0	0	110	L563 L565 W604 L616 H627 V629 T645 I649	L563-V647 HydrophobicContact CB-CG2 4.2Å; L563-V647 HydrophobicContact CD1-CG2 4.31Å; L563-V647 CarbonylContact O-C 2.96Å; L563-V647 WeakPolarHBondContact O-CA 3.22Å; L565-V647 HydrophobicContact CB-CG1 3.81Å; W604-V647 HydrophobicContact CH2-CB 4.37Å; W604-V647 HydrophobicContact CH2-CG1 3.77Å; W604-V647 HydrophobicContact CZ2-CB 4.27Å; W604-V647 HydrophobicContact CZ2-CG1 4.11Å; L616-V647 HydrophobicContact CD2-CG2 4.05Å; H627-V647 PolarHBondContact N-O 2.89Å; H627-V647 PolarHBondContact O-N 3.42Å; V629-V647 HydrophobicContact CB-CG2 4.36Å; V629-V647 HydrophobicContact CG2-CB 4.2Å; V629-V647 HydrophobicContact CG2-CG2 3.64Å; T645-V647 HydrophobicContact CG2-CG2 4.48Å; V647-I649 HydrophobicContact CG1-CG1 4.31Å
648	R	86.6	Confident	80.6	Confident	111 Å²	111	55.2 Å²	55.2	42%	0.419	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	107	175.3	-172.2	177.2	-169.4	163.1	5.7	110.3	L563 L565 G625 L626 T646	L563-R648 WeakPolarHBondContact O-CB 3.49Å; L563-R648 PolarHBondContact O-N 2.96Å; L565-R648 PolarHBondContact N-O 3.23Å; G625-R648 CarbonylContact O-C 3.49Å; G625-R648 WeakPolarHBondContact O-CA 3.4Å; L626-R648 HydrophobicContact CD2-CB 3.76Å; L626-R648 HydrophobicContact CD2-CG 3.79Å; T646-R648 PolarHBondContact O-N 3.17Å
649	I	86	Confident	79.7	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.3	175.2	-56.1	-178.3	0	0	0	109.2	L565 W604 L622 L624 G625 V647	L565-I649 HydrophobicContact CB-CG1 4.4Å; L565-I649 HydrophobicContact CD2-CG1 4.4Å; L565-I649 WeakPolarHBondContact O-CA 3.12Å; W604-I649 HydrophobicContact CH2-CD1 4.1Å; W604-I649 HydrophobicContact CZ2-CD1 4.05Å; L622-I649 HydrophobicContact CB-CD1 3.65Å; L622-I649 HydrophobicContact CD1-CD1 3.99Å; L622-I649 HydrophobicContact CG-CD1 4.47Å; L624-I649 WeakPolarHBondContact CA-O 3.4Å; L624-I649 HydrophobicContact CD2-CG2 4.08Å; G625-I649 PolarHBondContact N-O 2.76Å; G625-I649 PolarHBondContact O-N 3.45Å; V647-I649 HydrophobicContact CG1-CG1 4.31Å
650	C	82	Confident	78.1	Confident	13 Å²	13	70.8 Å²	70.8	9%	0.088	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	165.4	-174.2	62.9	0	0	0	0	112.9	L565 K567 C652 C657	L565-C650 PolarHBondContact O-N 2.99Å; K567-C650 PolarHBondContact N-O 3.1Å; C650-C652 PolarHBondContact SG-SG 3.12Å; C650-C657 HydrophobicContact CB-CB 3.67Å; C650-C657 WeakPolarHBondContact CB-SG 3.05Å; C650-C657 WeakPolarHBondContact SG-CA 3.38Å; C650-C657 WeakPolarHBondContact SG-CB 3.27Å; C650-C657 CovalentContact SG-SG 2.03Å; C650-C657 PolarHBondContact SG-SG 2.93Å
651	Q	80.3	Confident	76.3	Confident	123 Å²	123	73.7 Å²	73.7	58%	0.575	42%	0.419	S	S	*	.			trans	-78.3	132.9	160.2	-71	176.9	-47.8	0	0	108.1	L624 V658	L624-Q651 HydrophobicContact CD1-CG 4.27Å; Q651-V658 PolarHBondContact O-N 2.85Å
652	C	75.6	Confident	74.1	Confident	36 Å²	36	83.6 Å²	83.6	24%	0.243	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.2	-176.5	-63	0	0	0	0	112.7	C566 C650 A656	C566-C652 WeakPolarHBondContact CA-SG 3.08Å; C566-C652 HydrophobicContact CB-CB 3.65Å; C566-C652 WeakPolarHBondContact CB-SG 3.49Å; C566-C652 WeakPolarHBondContact SG-CB 3.2Å; C566-C652 CovalentContact SG-SG 2.03Å; C566-C652 PolarHBondContact SG-SG 3.34Å; C650-C652 PolarHBondContact SG-SG 3.12Å; C652-A656 WeakPolarHBondContact CA-O 3.37Å; C652-A656 WeakPolarHBondContact CB-O 3.32Å
653	T	69.4	Low	72	Confident	93 Å²	93	85 Å²	85	57%	0.571	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.8	156.9	44.4	0	0	0	0	107.3	G655 A656 V658	T653-G655 VanDerWaalsContact C-N 3.26Å; T653-G655 PolarHBondContact O-N 3.14Å; T653-A656 PolarHBondContact N-O 2.61Å; T653-A656 VanDerWaalsContact N-O 3.1Å; T653-A656 PolarHBondContact O-N 3.42Å; T653-A656 VanDerWaalsContact O-N 3.12Å; T653-V658 HydrophobicContact CG2-CG2 4.05Å
654	N	63.5	Low	70	Confident	175 Å²	175	89.5 Å²	89.5	94%	0.936	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	43.4	-178.5	-58.6	2.3	0	0	0	113.8	A656	N654-A656 VanDerWaalsContact C-N 3.26Å; N654-A656 PolarHBondContact O-N 2.87Å
655	G	64.4	Low	68.2	Low	55 Å²	55	94.8 Å²	94.8	57%	0.567	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-12.9	178	0	0	0	0	0	116.3	C566 T653	C566-G655 PolarHBondContact SG-O 3.11Å; C566-G655 VanDerWaalsContact SG-O 3.33Å; T653-G655 VanDerWaalsContact C-N 3.26Å; T653-G655 PolarHBondContact O-N 3.14Å
656	A	71.1	Confident	66.2	Low	59 Å²	59	99.6 Å²	99.6	49%	0.488	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	142.5	-178.6	0	0	0	0	0	112.7	C652 T653 N654 V658	C652-A656 WeakPolarHBondContact CA-O 3.37Å; C652-A656 WeakPolarHBondContact CB-O 3.32Å; T653-A656 PolarHBondContact N-O 2.61Å; T653-A656 VanDerWaalsContact N-O 3.1Å; T653-A656 PolarHBondContact O-N 3.42Å; T653-A656 VanDerWaalsContact O-N 3.12Å; N654-A656 VanDerWaalsContact C-N 3.26Å; N654-A656 PolarHBondContact O-N 2.87Å; A656-V658 PolarHBondContact O-N 2.8Å
657	C	74.8	Confident	65	Low	31 Å²	31	100.3 Å²	100.3	21%	0.209	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	126.5	178.8	-65.2	0	0	0	0	113	T564 C650 K659	T564-C657 VanDerWaalsContact CG2-SG 3.53Å; C650-C657 HydrophobicContact CB-CB 3.67Å; C650-C657 WeakPolarHBondContact CB-SG 3.05Å; C650-C657 WeakPolarHBondContact SG-CA 3.38Å; C650-C657 WeakPolarHBondContact SG-CB 3.27Å; C650-C657 CovalentContact SG-SG 2.03Å; C650-C657 PolarHBondContact SG-SG 2.93Å; C657-K659 PolarHBondContact O-N 2.83Å
658	V	70.8	Confident	63.7	Low	81 Å²	81	105.6 Å²	105.6	49%	0.491	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-71.4	118.3	172.7	-174.9	0	0	0	0	109.9	Q651 T653 A656 R660	Q651-V658 PolarHBondContact O-N 2.85Å; T653-V658 HydrophobicContact CG2-CG2 4.05Å; A656-V658 PolarHBondContact O-N 2.8Å; V658-R660 PolarHBondContact O-N 3.15Å
659	K	59.5	Low	62.5	Low	193 Å²	193	106.8 Å²	106.8	84%	0.839	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-69.6	116.8	167.8	-71.5	178.2	179.7	173.1	0	108.5	C657 G661	C657-K659 PolarHBondContact O-N 2.83Å; K659-G661 PolarHBondContact O-N 2.94Å; K659-G661 VanDerWaalsContact O-N 3.15Å
660	R	51	Low	61.3	Low	229 Å²	229	107.3 Å²	107.3	86%	0.864	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-59.5	117.7	168.3	-92.4	-173.4	171.8	-176.8	-3.9	109.1	V658 R662	V658-R660 PolarHBondContact O-N 3.15Å; R660-R662 PolarHBondContact O-N 3.05Å
661	G	45.4	Very low	60.4	Low	78 Å²	78	111.5 Å²	111.5	80%	0.804	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-61.6	128.3	170.7	0	0	0	0	0	110.4	K659	K659-G661 PolarHBondContact O-N 2.94Å; K659-G661 VanDerWaalsContact O-N 3.15Å
662	R	43	Very low	59.4	Low	236 Å²	236	111.2 Å²	111.2	89%	0.891	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-84.2	116.8	161.1	-81.5	-179	165.7	173.9	-5.5	107.3	R660 I664	R660-R662 PolarHBondContact O-N 3.05Å; R662-I664 PolarHBondContact O-N 2.69Å
663	S	43.9	Very low	58.9	Low	116 Å²	116	113.8 Å²	113.8	81%	0.811	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-62.5	116	162.4	46.9	0	0	0	0	108.4
664	I	48.2	Very low	58.8	Low	139 Å²	139	114.9 Å²	114.9	71%	0.713	64%	0.637	S	S	*	*			trans	-92.6	103.5	178.6	-53.4	178.7	0	0	0	108	R662 L666	R662-I664 PolarHBondContact O-N 2.69Å; I664-L666 HydrophobicContact CG2-CD1 3.99Å; I664-L666 PolarHBondContact O-N 2.88Å
665	E	50.1	Low	59.1	Low	185 Å²	185	111.4 Å²	111.4	86%	0.864	62%	0.617	S	S	*	*			trans	-72.7	115.3	161.2	-66.7	-176.4	155.8	0	0	108.1	G667	E665-G667 PolarHBondContact O-N 3.05Å; E665-G667 VanDerWaalsContact O-N 3.11Å
666	L	48.2	Very low	59.6	Low	102 Å²	102	113.7 Å²	113.7	53%	0.534	62%	0.616	S	S	.	*			trans	-74.1	101.6	174.7	-89.1	76.2	0	0	0	109.4	I664 L674	I664-L666 HydrophobicContact CG2-CD1 3.99Å; I664-L666 PolarHBondContact O-N 2.88Å; L666-L674 HydrophobicContact CD2-CD1 4.04Å
667	G	63.6	Low	59.4	Low	45 Å²	45	114.5 Å²	114.5	46%	0.464	62%	0.616	S	S	.	*			trans	-59.2	164.6	164.3	0	0	0	0	0	111.9	E665 L669 G670	E665-G667 PolarHBondContact O-N 3.05Å; E665-G667 VanDerWaalsContact O-N 3.11Å; G667-L669 PolarHBondContact O-N 2.75Å; G667-G670 PolarHBondContact O-N 3Å
668	P	60.5	Low	59.3	Low	111 Å²	111	119 Å²	119	72%	0.721	64%	0.638	S	S	*	*	H	α-helix	trans	-58.6	-25	-166.5	19.8	-32.7	0	0	0	115.5	G670 I671 L672	P668-G670 VanDerWaalsContact C-N 3.27Å; P668-G670 PolarHBondContact O-N 3.04Å; P668-I671 PolarHBondContact O-N 2.62Å; P668-L672 PolarHBondContact O-N 2.89Å
669	L	61	Low	59.3	Low	137 Å²	137	121.9 Å²	121.9	72%	0.717	64%	0.644	S	S	*	*	H	α-helix	trans	-62.7	-31.2	172	-75	163.6	0	0	0	113.1	G667 L672 T673	G667-L669 PolarHBondContact O-N 2.75Å; L669-L672 WeakPolarHBondContact O-CB 3.43Å; L669-L672 PolarHBondContact O-N 2.83Å; L669-T673 PolarHBondContact O-N 2.99Å; L669-T673 PolarHBondContact O-OG1 2.94Å
670	G	60.4	Low	60	Low	16 Å²	16	117.4 Å²	117.4	17%	0.165	63%	0.629	C	S	.	*	H	α-helix	trans	-68.1	-32.6	175.9	0	0	0	0	0	113.4	G667 P668 T673 L674	G667-G670 PolarHBondContact O-N 3Å; P668-G670 VanDerWaalsContact C-N 3.27Å; P668-G670 PolarHBondContact O-N 3.04Å; G670-T673 WeakPolarHBondContact CA-OG1 3.37Å; G670-T673 PolarHBondContact O-OG1 2.84Å; G670-L674 PolarHBondContact O-N 3.12Å
671	I	64.6	Low	61	Low	102 Å²	102	111.6 Å²	111.6	52%	0.523	61%	0.614	S	S	.	*	H	α-helix	trans	-69	-39.5	172.8	-59.8	169.9	0	0	0	109.6	P668 T673 L674 L675	P668-I671 PolarHBondContact O-N 2.62Å; I671-T673 PolarHBondContact O-N 2.92Å; I671-L674 PolarHBondContact O-N 3.14Å; I671-L675 HydrophobicContact CG2-CD1 4.44Å; I671-L675 PolarHBondContact O-N 2.65Å
672	L	59	Low	62.3	Low	116 Å²	116	113 Å²	113	61%	0.607	60%	0.603	S	S	*	*	H	α-helix	trans	-63.4	-40.7	176.6	-157.1	73.9	0	0	0	112.1	P668 L669 L674 L675 L676	P668-L672 PolarHBondContact O-N 2.89Å; L669-L672 WeakPolarHBondContact O-CB 3.43Å; L669-L672 PolarHBondContact O-N 2.83Å; L672-L674 VanDerWaalsContact C-N 3.32Å; L672-L674 PolarHBondContact O-N 2.9Å; L672-L675 PolarHBondContact O-N 3.11Å; L672-L676 PolarHBondContact O-N 2.9Å; L672-L676 VanDerWaalsContact O-N 3.12Å
673	T	65.4	Low	63.7	Low	91 Å²	91	105.9 Å²	105.9	56%	0.558	58%	0.582	S	S	*	*	H	α-helix	trans	-70.1	-22.8	175.4	50.1	0	0	0	0	114.3	L669 G670 I671 P677	L669-T673 PolarHBondContact O-N 2.99Å; L669-T673 PolarHBondContact O-OG1 2.94Å; G670-T673 WeakPolarHBondContact CA-OG1 3.37Å; G670-T673 PolarHBondContact O-OG1 2.84Å; I671-T673 PolarHBondContact O-N 2.92Å; T673-P677 WeakPolarHBondContact O-CD 3.4Å
674	L	66.6	Low	64.9	Low	115 Å²	115	104.8 Å²	104.8	60%	0.602	57%	0.567	S	S	*	*	H	α-helix	trans	-78.2	-28.1	173.4	-83.2	163.9	0	0	0	112.8	L666 G670 I671 L672 P677	L666-L674 HydrophobicContact CD2-CD1 4.04Å; G670-L674 PolarHBondContact O-N 3.12Å; I671-L674 PolarHBondContact O-N 3.14Å; L672-L674 VanDerWaalsContact C-N 3.32Å; L672-L674 PolarHBondContact O-N 2.9Å; L674-P677 WeakPolarHBondContact O-CD 3.32Å; L674-P677 WeakPolarHBondContact O-CG 3.46Å
675	L	69.8	Low	65.7	Low	102 Å²	102	101.5 Å²	101.5	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-81.9	-27.9	175.1	-68.1	170.4	0	0	0	112.9	I671 L672 L678 F679	I671-L675 HydrophobicContact CG2-CD1 4.44Å; I671-L675 PolarHBondContact O-N 2.65Å; L672-L675 PolarHBondContact O-N 3.11Å; L675-L678 WeakPolarHBondContact O-CB 3.41Å; L675-L678 PolarHBondContact O-N 2.81Å; L675-L678 VanDerWaalsContact O-N 3.13Å; L675-F679 PolarHBondContact O-N 2.88Å
676	L	73.9	Confident	66.4	Low	104 Å²	104	97.6 Å²	97.6	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-53.5	-48.7	178.7	-164.4	75.4	0	0	0	114.6	L672 L678 F679 L680	L672-L676 PolarHBondContact O-N 2.9Å; L672-L676 VanDerWaalsContact O-N 3.12Å; L676-L678 VanDerWaalsContact C-N 3.32Å; L676-L678 PolarHBondContact O-N 3.44Å; L676-F679 PolarHBondContact O-N 2.87Å; L676-L680 HydrophobicContact CG-CD1 4.29Å; L676-L680 PolarHBondContact O-N 3.43Å
677	P	66.9	Low	67	Low	75 Å²	75	98 Å²	98	49%	0.487	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-31.4	176.5	26.8	-35.5	0	0	0	112.5	T673 L674 L680 L681	T673-P677 WeakPolarHBondContact O-CD 3.4Å; L674-P677 WeakPolarHBondContact O-CD 3.32Å; L674-P677 WeakPolarHBondContact O-CG 3.46Å; P677-L680 PolarHBondContact O-N 2.86Å; P677-L681 WeakPolarHBondContact O-CB 3.38Å; P677-L681 PolarHBondContact O-N 2.9Å
678	L	73.1	Confident	66.7	Low	125 Å²	125	101.7 Å²	101.7	65%	0.654	55%	0.55	S	S	*	*	H	α-helix	trans	-65.4	-41.7	175.2	-132.7	88.4	0	0	0	111.1	L675 L676 L681 L682	L675-L678 WeakPolarHBondContact O-CB 3.41Å; L675-L678 PolarHBondContact O-N 2.81Å; L675-L678 VanDerWaalsContact O-N 3.13Å; L676-L678 VanDerWaalsContact C-N 3.32Å; L676-L678 PolarHBondContact O-N 3.44Å; L678-L681 PolarHBondContact O-N 3.15Å; L678-L682 PolarHBondContact O-N 2.6Å
679	F	71.1	Confident	66.5	Low	142 Å²	142	103.5 Å²	103.5	62%	0.623	55%	0.553	S	S	*	*	H	α-helix	trans	-68.4	-40.8	177.1	-162.1	-95.5	0	0	0	111.9	L675 L676 L682 L683	L675-F679 PolarHBondContact O-N 2.88Å; L676-F679 PolarHBondContact O-N 2.87Å; F679-L682 PolarHBondContact O-N 3.17Å; F679-L683 WeakPolarHBondContact O-CB 3.43Å; F679-L683 PolarHBondContact O-N 2.81Å
680	L	74.1	Confident	66.2	Low	99 Å²	99	101.3 Å²	101.3	52%	0.518	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-39.1	173.2	-80.6	164.1	0	0	0	112.5	L676 P677 L683 L684	L676-L680 HydrophobicContact CG-CD1 4.29Å; L676-L680 PolarHBondContact O-N 3.43Å; P677-L680 PolarHBondContact O-N 2.86Å; L680-L683 PolarHBondContact O-N 2.92Å; L680-L684 WeakPolarHBondContact O-CB 2.96Å; L680-L684 PolarHBondContact O-N 3.33Å
681	L	72.9	Confident	65.7	Low	108 Å²	108	106.2 Å²	106.2	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-66.5	-39.9	175.9	-158.7	81.7	0	0	0	111.4	P677 L678 L684 C685	P677-L681 WeakPolarHBondContact O-CB 3.38Å; P677-L681 PolarHBondContact O-N 2.9Å; L678-L681 PolarHBondContact O-N 3.15Å; L681-L684 PolarHBondContact O-N 3.11Å; L681-C685 PolarHBondContact O-N 2.85Å; L681-C685 PolarHBondContact O-SG 2.05Å; L681-C685 VanDerWaalsContact O-SG 3.36Å
682	L	72.8	Confident	64.5	Low	108 Å²	108	107 Å²	107	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-61.8	-43.4	173.5	-162.3	89.9	0	0	0	111.4	L678 F679 L684 C685 L686	L678-L682 PolarHBondContact O-N 2.6Å; F679-L682 PolarHBondContact O-N 3.17Å; L682-L684 VanDerWaalsContact C-N 3.35Å; L682-C685 PolarHBondContact O-N 2.97Å; L682-L686 WeakPolarHBondContact O-CG 3.33Å; L682-L686 PolarHBondContact O-N 3.28Å
683	L	70.8	Confident	63.7	Low	86 Å²	86	107.4 Å²	107.4	45%	0.45	60%	0.597	S	S	.	*	H	α-helix	trans	-63	-41.2	176.1	-155.4	84.4	0	0	0	111.6	F679 L680 L686 L687	F679-L683 WeakPolarHBondContact O-CB 3.43Å; F679-L683 PolarHBondContact O-N 2.81Å; L680-L683 PolarHBondContact O-N 2.92Å; L683-L686 PolarHBondContact O-N 3.34Å; L683-L687 WeakPolarHBondContact O-CG 3.5Å; L683-L687 PolarHBondContact O-N 3.18Å
684	L	69.3	Low	62.4	Low	93 Å²	93	108.7 Å²	108.7	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-64.6	-43.7	177	-166.1	74.6	0	0	0	111.4	L680 L681 L682 L686 L687 L688	L680-L684 WeakPolarHBondContact O-CB 2.96Å; L680-L684 PolarHBondContact O-N 3.33Å; L681-L684 PolarHBondContact O-N 3.11Å; L682-L684 VanDerWaalsContact C-N 3.35Å; L684-L686 VanDerWaalsContact C-N 3.34Å; L684-L686 PolarHBondContact O-N 3.07Å; L684-L687 PolarHBondContact O-N 3.05Å; L684-L688 HydrophobicContact CD2-CD1 4.41Å; L684-L688 HydrophobicContact CG-CD1 4Å; L684-L688 WeakPolarHBondContact O-CB 3.41Å; L684-L688 VanDerWaalsContact O-CG 3.26Å; L684-L688 WeakPolarHBondContact O-CG 3.49Å; L684-L688 PolarHBondContact O-N 3.46Å
685	C	66.1	Low	61.1	Low	69 Å²	69	112.3 Å²	112.3	47%	0.466	62%	0.615	S	S	.	*	H	α-helix	trans	-63.5	-36.7	175.2	-71.9	0	0	0	0	112.7	L681 L682 L689	L681-C685 PolarHBondContact O-N 2.85Å; L681-C685 PolarHBondContact O-SG 2.05Å; L681-C685 VanDerWaalsContact O-SG 3.36Å; L682-C685 PolarHBondContact O-N 2.97Å; C685-L689 WeakPolarHBondContact O-CG 3.3Å; C685-L689 PolarHBondContact O-N 3.26Å
686	L	64.3	Low	59.6	Low	104 Å²	104	113.4 Å²	113.4	55%	0.545	63%	0.629	S	S	.	*	H	α-helix	trans	-67.7	-39.3	174	-76.8	163	0	0	0	112.4	L682 L683 L684 S690	L682-L686 WeakPolarHBondContact O-CG 3.33Å; L682-L686 PolarHBondContact O-N 3.28Å; L683-L686 PolarHBondContact O-N 3.34Å; L684-L686 VanDerWaalsContact C-N 3.34Å; L684-L686 PolarHBondContact O-N 3.07Å; L686-S690 PolarHBondContact O-OG 3.15Å
687	L	60.8	Low	57.7	Low	110 Å²	110	115.8 Å²	115.8	58%	0.576	64%	0.637	S	S	*	*	H	α-helix	trans	-65.9	-43	174.1	-75.6	162.5	0	0	0	111.8	L683 L684 L689 S690	L683-L687 WeakPolarHBondContact O-CG 3.5Å; L683-L687 PolarHBondContact O-N 3.18Å; L684-L687 PolarHBondContact O-N 3.05Å; L687-L689 VanDerWaalsContact C-N 3.27Å; L687-L689 PolarHBondContact O-N 3.15Å; L687-S690 WeakPolarHBondContact O-CB 3.35Å; L687-S690 PolarHBondContact O-N 3.18Å; L687-S690 VanDerWaalsContact O-N 3.08Å
688	L	56.7	Low	56	Low	123 Å²	123	119.4 Å²	119.4	64%	0.644	65%	0.645	S	S	*	*	H	α-helix	trans	-68.8	-20.5	-179.8	-72.4	168.9	0	0	0	114	L684 S690	L684-L688 HydrophobicContact CD2-CD1 4.41Å; L684-L688 HydrophobicContact CG-CD1 4Å; L684-L688 WeakPolarHBondContact O-CB 3.41Å; L684-L688 VanDerWaalsContact O-CG 3.26Å; L684-L688 WeakPolarHBondContact O-CG 3.49Å; L684-L688 PolarHBondContact O-N 3.46Å; L688-S690 VanDerWaalsContact C-N 3.26Å; L688-S690 PolarHBondContact O-N 2.83Å
689	L	56	Low	54.1	Low	149 Å²	149	120.7 Å²	120.7	78%	0.78	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-7.2	171.9	-77	166.8	0	0	0	113.8	C685 L687	C685-L689 WeakPolarHBondContact O-CG 3.3Å; C685-L689 PolarHBondContact O-N 3.26Å; L687-L689 VanDerWaalsContact C-N 3.27Å; L687-L689 PolarHBondContact O-N 3.15Å
690	S	54.7	Low	52.9	Low	91 Å²	91	118.6 Å²	118.6	64%	0.636	65%	0.651	S	S	*	*	S	Bend	trans	-103.3	-12.1	-166.7	-59.6	0	0	0	0	115.7	L686 L687 L688	L686-S690 PolarHBondContact O-OG 3.15Å; L687-S690 WeakPolarHBondContact O-CB 3.35Å; L687-S690 PolarHBondContact O-N 3.18Å; L687-S690 VanDerWaalsContact O-N 3.08Å; L688-S690 VanDerWaalsContact C-N 3.26Å; L688-S690 PolarHBondContact O-N 2.83Å
691	T	51.1	Low	50.8	Low	119 Å²	119	121.9 Å²	121.9	73%	0.73	67%	0.669	S	S	*	*			trans	-138	85.5	-176.9	56.7	0	0	0	0	113.6
692	C	38	Very low	48.7	Very low	117 Å²	117	119.5 Å²	119.5	79%	0.791	67%	0.67	S	S	*	*			trans	-79.6	-177.6	161.9	-84.8	0	0	0	0	112.3
693	T	43.4	Very low	46.7	Very low	126 Å²	126	122.5 Å²	122.5	77%	0.773	69%	0.687	S	S	*	*			trans	71.3	65.4	167.1	62.4	0	0	0	0	119.4
694	T	38.8	Very low	44.8	Very low	117 Å²	117	122.4 Å²	122.4	72%	0.718	71%	0.707	S	S	*	*				52.8	120.6	114.9	58.3	0	0	0	0	123.4
695	K	37.6	Very low	42.9	Very low	191 Å²	191	125.2 Å²	125.2	83%	0.83	72%	0.717	S	S	*	*			trans	72.2	140	135.5	-63.9	-178.3	178	-177.6	0	119.3
696	P	39.1	Very low	41.4	Very low	126 Å²	126	131.2 Å²	131.2	82%	0.818	73%	0.731	S	S	*	*				-124.5	-172	98.9	1.3	20.6	0	0	0	116
697	E	34.2	Very low	39.8	Very low	153 Å²	153	131 Å²	131	72%	0.715	74%	0.739	S	S	*	*			trans	-54.8	176.8	170.7	-62	-176.5	105.9	0	0	115.8
698	K	30.8	Very low	38.2	Very low	151 Å²	151	135.6 Å²	135.6	66%	0.657	75%	0.754	S	S	*	*			cis	177.3	148.1	-27.2	-95.3	175.8	-176.9	151.4	0	105.9
699	I	34	Very low	36.9	Very low	152 Å²	152	133 Å²	133	78%	0.779	76%	0.758	S	S	*	*			trans	66.1	142.5	145	-71.2	169.7	0	0	0	117.7
700	P	45.8	Very low	35.8	Very low	98 Å²	98	133.3 Å²	133.3	64%	0.636	76%	0.758	S	S	*	*			cis	-139.4	-163.6	-25.5	38.3	-17	0	0	0	113.9
701	L	28.5	Very low	34.5	Very low	169 Å²	169	135.4 Å²	135.4	89%	0.885	76%	0.762	S	S	*	*			trans	70.1	147.7	163.6	-59.3	160.7	0	0	0	116.6
702	G	29.9	Very low	33.4	Very low	57 Å²	57	136.8 Å²	136.8	59%	0.588	76%	0.763	S	S	*	*			cis	178.3	152.6	-7.4	0	0	0	0	0	111.7
703	D	31	Very low	33.3	Very low	172 Å²	172	136.3 Å²	136.3	92%	0.92	76%	0.758	S	S	*	*			trans	52.9	138.9	162	-47	-26.4	0	0	0	121
704	G	30	Very low	32.6	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	76%	0.758	S	S	*	*			trans	153.2	105.5	174.7	0	0	0	0	0	113.4
705	E	30.8	Very low	32	Very low	151 Å²	151	136.2 Å²	136.2	71%	0.706	76%	0.757	S	S	*	*			trans	-113.8	155.9	-167.2	-147.3	-177.3	170.1	0	0	113.1
706	Y	33.1	Very low	31.7	Very low	196 Å²	196	133.8 Å²	133.8	77%	0.769	76%	0.759	S	S	*	*			trans	64.7	128.7	172.3	-56.9	-74.8	0	0	0	120.3
707	S	31.4	Very low	31.2	Very low	100 Å²	100	136 Å²	136	70%	0.699	76%	0.758	S	S	*	*				167.3	132.3	92.8	-166.3	0	0	0	0	115.7
708	K	28	Very low	30.9	Very low	205 Å²	205	133.1 Å²	133.1	89%	0.891	76%	0.76	S	S	*	*			trans	29.2	133.3	148.2	-60.6	176.4	-179.9	177.5	0	123.4
709	G	29.3	Very low	31.3	Very low	70 Å²	70	131.8 Å²	131.8	72%	0.722	77%	0.767	S	S	*	*			trans	152.9	123.6	143.2	0	0	0	0	0	113.6
710	I	31.5	Very low	30.9	Very low	154 Å²	154	128 Å²	128	79%	0.79	77%	0.766	S	S	*	*			cis	77.1	121.7	48	-65.1	176.4	0	0	0	112.3
711	L	28.8	Very low	30.1	Very low	136 Å²	136	129.7 Å²	129.7	71%	0.712	77%	0.77	S	S	*	*			cis	-167.1	141.2	-8.1	-95.4	178.9	0	0	0	110.2
712	I	26.3	Very low	30.1	Very low	147 Å²	147	130.2 Å²	130.2	75%	0.754	77%	0.768	S	S	*	*			trans	61.3	170.1	138.6	-68.3	179.4	0	0	0	117.2
713	P	37	Very low	29.9	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	78%	0.776	S	S	*	*			cis	-127.8	166.7	-2.7	17.1	9.1	0	0	0	119.4
714	S	28.5	Very low	29.7	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	77%	0.767	S	S	*	*			trans	48.9	154.8	135	-75.8	0	0	0	0	124.3
715	N	27.2	Very low	29.7	Very low	130 Å²	130	132.1 Å²	132.1	70%	0.695	76%	0.755	S	S	*	*			cis	-167.4	155.3	-8.5	49	-34.4	0	0	0	112
716	T	30.1	Very low	29.6	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	76%	0.763	S	S	*	*			trans	-169.3	145.2	134.4	24.7	0	0	0	0	111.3
717	E	28.7	Very low	29.3	Very low	173 Å²	173	128.6 Å²	128.6	81%	0.808	76%	0.756	S	S	*	*			trans	-70.8	152.2	177.2	-73.7	137.5	117.7	0	0	113.2
718	A	27.4	Very low	29	Very low	92 Å²	92	132.7 Å²	132.7	76%	0.76	76%	0.762	S	S	*	*			cis	78.5	155.2	43.2	0	0	0	0	0	113.3
719	P	40.6	Very low	28.8	Very low	124 Å²	124	130.7 Å²	130.7	81%	0.805	76%	0.756	S	S	*	*			cis	-122.3	-175.5	11.6	42.8	-28.6	0	0	0	115.8
720	G	25.6	Very low	28.5	Very low	73 Å²	73	133.1 Å²	133.1	75%	0.753	76%	0.761	S	S	*	*			trans	168.4	14.2	-177.6	0	0	0	0	0	117.9
721	D	28.4	Very low	28.1	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	76%	0.763	S	S	*	*			trans	50.4	98	155.2	-48.6	-0.1	0	0	0	121.1
722	E	28.1	Very low	27.8	Very low	180 Å²	180	131.2 Å²	131.2	84%	0.841	77%	0.768	S	S	*	*				56.7	118.5	126.9	-63.8	175.9	-170	0	0	121.1
723	V	26.8	Very low	27.8	Very low	125 Å²	125	131.1 Å²	131.1	76%	0.758	77%	0.768	S	S	*	*			cis	71.1	125.4	6.2	-166.5	0	0	0	0	114.4
724	D	27.3	Very low	27.5	Very low	138 Å²	138	133 Å²	133	74%	0.738	77%	0.767	S	S	*	*			cis	-149.4	150.5	6.9	-125.3	-8.1	0	0	0	111.4
725	S	28.7	Very low	27.7	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	77%	0.768	S	S	*	*				73	135.4	87.1	-65.9	0	0	0	0	120.8
726	F	28.1	Very low	27.5	Very low	197 Å²	197	132.6 Å²	132.6	86%	0.864	77%	0.766	S	S	*	*			trans	55.6	97.9	151.4	-85.4	-96.7	0	0	0	123.8
727	A	27.5	Very low	27.4	Very low	76 Å²	76	132.1 Å²	132.1	63%	0.628	76%	0.762	S	S	*	*				66.6	128.6	112.9	0	0	0	0	0	125
728	F	24.7	Very low	27.3	Very low	186 Å²	186	132.2 Å²	132.2	82%	0.816	76%	0.76	S	S	*	*			trans	99.5	127.7	148.3	-80.7	-68.2	0	0	0	123.3
729	H	23.6	Very low	27.2	Very low	164 Å²	164	133.9 Å²	133.9	76%	0.759	76%	0.756	S	S	*	*			trans	60.7	91.3	158.8	-75.8	-68.4	0	0	0	121.6
730	S	23.9	Very low	26.5	Very low	121 Å²	121	132.9 Å²	132.9	85%	0.846	75%	0.752	S	S	*	*				-147.2	150.4	120.3	68	0	0	0	0	110.3
731	T	23.9	Very low	26.7	Very low	135 Å²	135	138 Å²	138	83%	0.828	76%	0.758	S	S	*	*			trans	-106.2	118.6	-174.4	47.9	0	0	0	0	112.7
732	S	22.6	Very low	26.7	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	77%	0.767	S	S	*	*			trans	-151.9	157.9	150.7	66.1	0	0	0	0	110.9
733	L	26.3	Very low	26.6	Very low	144 Å²	144	136.5 Å²	136.5	75%	0.754	76%	0.764	S	S	*	*			trans	-53.7	160.1	162.9	-89.6	57.7	0	0	0	110.2
734	E	29.3	Very low	26.7	Very low	147 Å²	147	135.7 Å²	135.7	69%	0.687	76%	0.764	S	S	*	*			cis	-149.4	-158.8	24.9	-134	161.4	-121.4	0	0	108.3
735	Q	32.2	Very low	26.6	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	77%	0.767	S	S	*	*			cis	-168.9	162.2	27.6	-150.3	153.5	59.3	0	0	114.3
736	G	24.5	Very low	26.6	Very low	62 Å²	62	137.2 Å²	137.2	64%	0.639	77%	0.774	S	S	*	*			trans	-168.3	135.2	153.7	0	0	0	0	0	108.7
737	V	26.8	Very low	26.6	Very low	130 Å²	130	134.5 Å²	134.5	79%	0.788	77%	0.768	S	S	*	*			cis	-155.8	151	16.5	160.1	0	0	0	0	110.3
738	K	26.5	Very low	26.6	Very low	175 Å²	175	136.6 Å²	136.6	76%	0.761	77%	0.774	S	S	*	*			trans	88.3	132.4	157.4	-89.6	176.4	173.9	-172.3	0	123.6
739	D	26.5	Very low	26.8	Very low	128 Å²	128	131.4 Å²	131.4	68%	0.684	77%	0.772	S	S	*	*			trans	67.6	94.5	133	-56.2	-17.9	0	0	0	122.8
740	S	25.6	Very low	27	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	78%	0.779	S	S	*	*				61.9	108	112.8	-164.1	0	0	0	0	120.6
741	M	30	Very low	27.2	Very low	180 Å²	180	136 Å²	136	89%	0.887	78%	0.775	S	S	*	*				-177.4	167.8	110.2	-90.5	-97	178.7	0	0	112.8
742	K	27.2	Very low	27.4	Very low	207 Å²	207	133.2 Å²	133.2	90%	0.9	77%	0.773	S	S	*	*			trans	-79.9	153.6	-168.4	-59.2	167.5	176.6	174.5	0	115
743	G	27.1	Very low	27.8	Very low	75 Å²	75	134.7 Å²	134.7	77%	0.773	77%	0.772	S	S	*	*			trans	125.1	106.4	153.6	0	0	0	0	0	113.7
744	S	27.7	Very low	28	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	77%	0.774	S	S	*	*			cis	97.5	95.3	40	-179.6	0	0	0	0	114.2
745	V	26.6	Very low	28	Very low	131 Å²	131	133.6 Å²	133.6	79%	0.794	77%	0.77	S	S	*	*			trans	70.6	133.9	144.2	175.5	0	0	0	0	115.1
746	V	28.8	Very low	27.9	Very low	128 Å²	128	132 Å²	132	78%	0.776	77%	0.772	S	S	*	*			cis	-144.4	167.8	34.8	-165.6	0	0	0	0	112.2
747	N	26.4	Very low	28.2	Very low	140 Å²	140	134 Å²	134	75%	0.749	78%	0.776	S	S	*	*			trans	-36.7	169.2	146.8	-110.1	-18.2	0	0	0	115.4
748	T	29.3	Very low	28.2	Very low	120 Å²	120	133.9 Å²	133.9	74%	0.736	78%	0.776	S	S	*	*			cis	-168.4	148.4	21.3	-6	0	0	0	0	111.5
749	G	28	Very low	28.3	Very low	77 Å²	77	133.6 Å²	133.6	79%	0.794	78%	0.781	S	S	*	*			trans	64	-179.6	145.6	0	0	0	0	0	120.4
750	W	27.4	Very low	28.4	Very low	234 Å²	234	131 Å²	131	89%	0.886	79%	0.785	S	S	*	*			cis	-167.3	149.4	-26.2	-166.8	46.7	0	0	0	110.6
751	L	28.9	Very low	28.5	Very low	148 Å²	148	129.8 Å²	129.8	78%	0.775	79%	0.788	S	S	*	*			trans	63.2	163.1	172.8	-109.5	74.7	0	0	0	119.3
752	G	28	Very low	28.4	Very low	76 Å²	76	129.8 Å²	129.8	78%	0.784	79%	0.785	S	S	*	*			trans	168.7	-18	171.2	0	0	0	0	0	121.8
753	N	30.8	Very low	28.4	Very low	146 Å²	146	124.6 Å²	124.6	78%	0.781	78%	0.775	S	S	*	*			trans	-1.3	148.3	173.7	-151.5	-0.7	0	0	0	123.2
754	K	30	Very low	28.4	Very low	182 Å²	182	127.3 Å²	127.3	79%	0.791	78%	0.777	S	S	*	*			trans	80.1	156.6	165.2	-64	-175.7	179.4	-178.7	0	119.5
755	S	30.6	Very low	28.4	Very low	86 Å²	86	130.4 Å²	130.4	60%	0.601	78%	0.779	S	S	*	*			cis	179.6	138.9	-36.4	55.5	0	0	0	0	111.1
756	T	29.1	Very low	28.4	Very low	138 Å²	138	131.6 Å²	131.6	85%	0.847	78%	0.776	S	S	*	*			trans	56.7	147.1	156.2	56	0	0	0	0	118.5
757	S	30.7	Very low	28.3	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	78%	0.778	S	S	*	*			cis	-168	138.7	27.3	49.4	0	0	0	0	113.5
758	T	27.2	Very low	28.4	Very low	128 Å²	128	129 Å²	129	79%	0.785	77%	0.771	S	S	*	*			trans	40.2	145.4	137.5	-3.3	0	0	0	0	125.7
759	I	28.8	Very low	28.3	Very low	169 Å²	169	132.2 Å²	132.2	87%	0.867	77%	0.771	S	S	*	*			trans	87.5	119.9	154.1	-62.5	166.5	0	0	0	119.5
760	G	28.2	Very low	28.4	Very low	75 Å²	75	135.3 Å²	135.3	77%	0.773	77%	0.765	S	S	*	*				126.7	107.8	128.4	0	0	0	0	0	120.7
761	G	27.6	Very low	28.4	Very low	76 Å²	76	132.1 Å²	132.1	78%	0.784	76%	0.76	S	S	*	*			trans	87.3	92.5	130.1	0	0	0	0	0	122
762	H	28.1	Very low	28.2	Very low	179 Å²	179	129.8 Å²	129.8	83%	0.829	76%	0.756	S	S	*	*			trans	26	110.3	141	-80	-85.4	0	0	0	122.8
763	S	27.4	Very low	28.3	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	76%	0.758	S	S	*	*				86.1	153.6	115.2	76.2	0	0	0	0	123.4
764	V	27.8	Very low	28.2	Very low	132 Å²	132	129.8 Å²	129.8	80%	0.8	75%	0.752	S	S	*	*			trans	85.4	146.9	166.9	-169.3	0	0	0	0	117.1
765	H	26.3	Very low	28.1	Very low	172 Å²	172	128.7 Å²	128.7	80%	0.796	75%	0.754	S	S	*	*			trans	-40.9	164.8	178.8	-76.8	-112.5	0	0	0	115.8
766	E	26.2	Very low	28	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.734	76%	0.763	S	S	*	*			cis	-165.1	174.8	47.2	-161.6	162.1	-146.3	0	0	115.3
767	N	28.2	Very low	27.8	Very low	152 Å²	152	129 Å²	129	81%	0.813	76%	0.755	S	S	*	*			trans	114.9	125.7	164.9	-62.6	-55	0	0	0	115.6
768	G	27.3	Very low	27.5	Very low	60 Å²	60	132.4 Å²	132.4	62%	0.619	76%	0.761	S	S	*	*			cis	168.9	149.4	-11.5	0	0	0	0	0	115.8
769	Y	28.1	Very low	27.5	Very low	188 Å²	188	132.9 Å²	132.9	74%	0.737	76%	0.759	S	S	*	*			trans	63.4	109.7	154.5	-73.5	-99.5	0	0	0	118.9
770	Q	29.4	Very low	27.4	Very low	143 Å²	143	131.8 Å²	131.8	67%	0.668	76%	0.761	S	S	*	*				83.3	149	85.9	-78.9	-169.5	10.7	0	0	113.5
771	Q	27.9	Very low	27.4	Very low	167 Å²	167	137.6 Å²	137.6	78%	0.78	77%	0.767	S	S	*	*			cis	-149.5	176.8	16.8	-139.4	167.8	39.1	0	0	112.9
772	S	25.3	Very low	27.5	Very low	99 Å²	99	139 Å²	139	69%	0.692	77%	0.765	S	S	*	*			trans	-86.4	172.3	177.9	45.1	0	0	0	0	113
773	I	29.3	Very low	27.3	Very low	159 Å²	159	139.4 Å²	139.4	82%	0.815	77%	0.769	S	S	*	*				-175.6	150.9	72.8	-74.3	163	0	0	0	106.6
774	G	27.8	Very low	27.3	Very low	63 Å²	63	140.6 Å²	140.6	65%	0.649	78%	0.778	S	S	*	*			cis	156	172.4	-3.8	0	0	0	0	0	112.1
775	L	29.4	Very low	27.3	Very low	159 Å²	159	139.6 Å²	139.6	83%	0.832	78%	0.776	S	S	*	*			trans	69.2	139.3	165.3	-59.8	173.5	0	0	0	118
776	N	27.3	Very low	27.3	Very low	150 Å²	150	143.3 Å²	143.3	80%	0.802	78%	0.784	S	S	*	*			cis	-161.7	174.8	-11.1	-147	-3.4	0	0	0	112.8
777	A	25.7	Very low	27.3	Very low	81 Å²	81	144 Å²	144	67%	0.669	78%	0.784	S	S	*	*			trans	90.6	103.8	156.1	0	0	0	0	0	122.7
778	M	25.2	Very low	27.2	Very low	173 Å²	173	145 Å²	145	85%	0.852	78%	0.781	S	S	*	*			trans	77.2	119.4	135.1	-65.4	-169.2	174.2	0	0	124.3
779	N	25.6	Very low	27.3	Very low	138 Å²	138	148 Å²	148	74%	0.738	78%	0.784	S	S	*	*			trans	59.3	109.9	138.4	-62.5	-5.2	0	0	0	121.5
780	T	27.7	Very low	27.2	Very low	146 Å²	146	146.1 Å²	146.1	90%	0.896	78%	0.781	S	S	*	*				-163.2	156.9	92.2	17.7	0	0	0	0	110.9
781	H	28.7	Very low	27.2	Very low	197 Å²	197	149.5 Å²	149.5	91%	0.912	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-85.9	151.8	-176.5	-102.6	-81.6	0	0	0	113.4
782	S	28.5	Very low	27.1	Very low	105 Å²	105	145.1 Å²	145.1	73%	0.734	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.4	151.4	-172	46.4	0	0	0	0	114.7
783	M	25.2	Very low	27.3	Very low	188 Å²	188	149.3 Å²	149.3	93%	0.926	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.6	143.5	153.3	-77.3	-174.3	158.1	0	0	110.6
784	S	26.8	Very low	27.2	Very low	124 Å²	124	150.8 Å²	150.8	87%	0.867	80%	0.8	S	S	*	*			trans	-175.9	158.8	131.6	38	0	0	0	0	111
785	S	27.1	Very low	27.2	Very low	110 Å²	110	156.7 Å²	156.7	77%	0.769	81%	0.808	S	S	*	*			trans	-98.8	156	-171.9	58.5	0	0	0	0	113.8
786	R	26.8	Very low	27	Very low	251 Å²	251	156.1 Å²	156.1	95%	0.947	81%	0.806	S	S	*	*			trans	-157.2	169.4	137	-109.9	159.7	-169.4	-169.1	1.3	111.8
787	K	25.6	Very low	27	Very low	172 Å²	172	154.2 Å²	154.2	75%	0.748	80%	0.8	S	S	*	*			trans	-111.7	164.6	-166.3	-66.6	-179.4	167.7	-174.1	0	112.8
788	F	27.3	Very low	27.1	Very low	172 Å²	172	159.4 Å²	159.4	75%	0.754	81%	0.813	S	S	*	*			trans	67.4	144.5	161.7	-62.2	-61.1	0	0	0	114.9
789	D	28.5	Very low	27.2	Very low	124 Å²	124	154.8 Å²	154.8	66%	0.663	81%	0.81	S	S	*	*			cis	-156.5	176.4	5.6	-126.3	-25.4	0	0	0	108.8
790	H	26.7	Very low	27.4	Very low	147 Å²	147	152.7 Å²	152.7	68%	0.681	81%	0.805	S	S	*	*			cis	-151.4	-164.1	9.1	-158.1	48.2	0	0	0	113
791	Y	28	Very low	27.4	Very low	215 Å²	215	154.1 Å²	154.1	84%	0.843	80%	0.802	S	S	*	*			trans	-59.6	156.7	177.4	-96.3	-105.5	0	0	0	116.8
792	G	27.2	Very low	27.4	Very low	74 Å²	74	155 Å²	155	76%	0.763	80%	0.797	S	S	*	*			trans	131.1	97.3	138.1	0	0	0	0	0	117.1
793	Q	28.3	Very low	27.4	Very low	187 Å²	187	156.7 Å²	156.7	87%	0.874	80%	0.797	S	S	*	*			trans	-98.8	134.7	152.5	-79.2	-168.3	0.2	0	0	109.6
794	H	27	Very low	27.5	Very low	190 Å²	190	154.2 Å²	154.2	88%	0.88	79%	0.788	S	S	*	*			trans	-146.7	138	152.6	-126.8	-86.4	0	0	0	109.3
795	F	28.1	Very low	27.6	Very low	188 Å²	188	155.1 Å²	155.1	83%	0.825	78%	0.78	S	S	*	*			trans	-76.3	138.8	165.1	-93.7	-114	0	0	0	108.9
796	D	26.7	Very low	27.7	Very low	146 Å²	146	156.4 Å²	156.4	78%	0.781	78%	0.778	S	S	*	*				-161.5	137.3	125	-121.9	-39.1	0	0	0	116.3
797	T	27.2	Very low	27.7	Very low	111 Å²	111	147.6 Å²	147.6	68%	0.681	77%	0.766	S	S	*	*			trans	36.3	117.6	140.7	-61.6	0	0	0	0	123.3
798	M	27.6	Very low	27.9	Very low	190 Å²	190	147.7 Å²	147.7	94%	0.936	77%	0.771	S	S	*	*			trans	40.3	121.6	144.3	-61.3	-173.5	179.3	0	0	121.9
799	G	27.1	Very low	28.1	Very low	76 Å²	76	145.7 Å²	145.7	78%	0.784	77%	0.768	S	S	*	*			trans	-167.8	70.3	170.6	0	0	0	0	0	118.4
800	S	28.9	Very low	28.1	Very low	93 Å²	93	148.8 Å²	148.8	65%	0.65	77%	0.772	S	S	*	*			trans	31.9	129.3	141.9	168.9	0	0	0	0	122.3
801	Q	28.4	Very low	28.4	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	77%	0.767	S	S	*	*			trans	73.4	154	151.4	-72.8	171.6	57	0	0	118.9
802	R	28.7	Very low	28.4	Very low	216 Å²	216	143 Å²	143	82%	0.815	76%	0.756	S	S	*	*			cis	-170.8	166.5	-32.4	-139.6	-178.8	-168.9	-169.1	2.9	108.8
803	L	27.3	Very low	28.5	Very low	140 Å²	140	149.7 Å²	149.7	73%	0.733	76%	0.76	S	S	*	*			trans	72.7	120.5	166	-63.5	165.8	0	0	0	114.8
804	N	27.8	Very low	28.6	Very low	136 Å²	136	146.5 Å²	146.5	73%	0.727	75%	0.753	S	S	*	*				76.1	135	78.4	-84	18.6	0	0	0	113.4
805	M	28.5	Very low	28.9	Very low	143 Å²	143	146 Å²	146	70%	0.704	75%	0.754	S	S	*	*			cis	-167.3	167	4.1	-135.8	-179.9	161.4	0	0	113.9
806	N	30.1	Very low	29.1	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	74%	0.744	S	S	*	*			trans	77.1	146.5	149.2	-63.3	-23.6	0	0	0	122.7
807	G	26.9	Very low	29.7	Very low	66 Å²	66	142.1 Å²	142.1	68%	0.68	74%	0.741	S	S	*	*			trans	102.7	79.1	169.8	0	0	0	0	0	113.8
808	M	30.3	Very low	30.2	Very low	175 Å²	175	142.1 Å²	142.1	86%	0.862	74%	0.737	S	S	*	*				57.3	132.7	56.8	-67.7	-161	-48.8	0	0	114.9
809	D	31.7	Very low	30.8	Very low	129 Å²	129	139.5 Å²	139.5	69%	0.69	73%	0.727	S	S	*	*			cis	-170.1	179	-14.9	-162.4	5	0	0	0	109.4
810	Y	28.3	Very low	31.4	Very low	189 Å²	189	139.1 Å²	139.1	74%	0.741	72%	0.716	S	S	*	*			trans	70.6	135.6	170.4	-79.5	-104.8	0	0	0	117.9
811	D	31.5	Very low	31.9	Very low	108 Å²	108	144.4 Å²	144.4	58%	0.578	72%	0.721	S	S	*	*			cis	-155.6	146.8	-12.6	-145.7	5.6	0	0	0	115.1
812	Q	28.4	Very low	32.4	Very low	134 Å²	134	139 Å²	139	63%	0.626	70%	0.701	S	S	*	*			trans	42.4	115.3	136.9	-170.1	171.8	118	0	0	122.4
813	Y	29.4	Very low	32.7	Very low	213 Å²	213	138.3 Å²	138.3	84%	0.835	70%	0.698	S	S	*	*				-154	147.4	107.2	-117.8	-80.8	0	0	0	111.6
814	T	30.6	Very low	33.3	Very low	120 Å²	120	139.4 Å²	139.4	74%	0.736	70%	0.697	S	S	*	*			trans	-113.2	173.9	-175.8	36.9	0	0	0	0	112.8
815	M	32.4	Very low	33.9	Very low	180 Å²	180	137 Å²	137	89%	0.887	69%	0.687	S	S	*	*			trans	81.7	139.1	179.3	-64.2	-172.6	162.3	0	0	116
816	D	34.1	Very low	34.4	Very low	118 Å²	118	135.8 Å²	135.8	63%	0.631	68%	0.68	S	S	*	*			cis	-143.5	141.8	-10.6	-154.7	-32.3	0	0	0	110.7	N818	D816-N818 PolarHBondContact OD1-ND2 3.06Å
817	N	38.4	Very low	34.6	Very low	134 Å²	134	132.9 Å²	132.9	72%	0.717	66%	0.664	S	S	*	*			trans	-107.6	22.6	-168.9	-150.5	-10.2	0	0	0	113.4
818	N	38.6	Very low	35.3	Very low	112 Å²	112	135.4 Å²	135.4	60%	0.599	66%	0.661	S	S	*	*	S	Bend	trans	-92.1	-17	-173	-80.5	-63	0	0	0	115.1	D816	D816-N818 PolarHBondContact OD1-ND2 3.06Å
819	L	39.6	Very low	35.7	Very low	135 Å²	135	134.8 Å²	134.8	71%	0.707	65%	0.65	S	S	*	*	H	α-helix	trans	-78.1	-35.3	178.9	-139.1	78.5	0	0	0	113.2	R821 T822	L819-R821 VanDerWaalsContact C-N 3.28Å; L819-R821 PolarHBondContact O-N 3.23Å; L819-T822 PolarHBondContact O-OG1 2.79Å; L819-T822 VanDerWaalsContact O-OG1 3.1Å
820	A	39.2	Very low	36	Very low	67 Å²	67	133.6 Å²	133.6	55%	0.554	64%	0.644	S	S	*	*	H	α-helix	trans	-70.9	-21.2	-176.9	0	0	0	0	0	113.7
821	R	40	Very low	36.4	Very low	205 Å²	205	130.3 Å²	130.3	77%	0.774	63%	0.633	S	S	*	*	H	α-helix	trans	-84.5	-31.8	-177.8	-123.8	-179.7	-176	-160.3	0.2	113.4	L819 T825	L819-R821 VanDerWaalsContact C-N 3.28Å; L819-R821 PolarHBondContact O-N 3.23Å; R821-T825 PolarHBondContact O-OG1 3.36Å
822	T	39	Very low	36.7	Very low	63 Å²	63	131.6 Å²	131.6	39%	0.387	64%	0.636	S	S	.	*	H	α-helix	trans	-75.8	-30.2	178.8	47.5	0	0	0	0	112.9	L819 T825 H826	L819-T822 PolarHBondContact O-OG1 2.79Å; L819-T822 VanDerWaalsContact O-OG1 3.1Å; T822-T825 PolarHBondContact O-OG1 2.81Å; T822-T825 VanDerWaalsContact O-OG1 3.11Å; T822-H826 PolarHBondContact O-N 2.85Å; T822-H826 PolarHBondContact O-ND1 3.45Å
823	W	35.1	Very low	37	Very low	201 Å²	201	131.9 Å²	131.9	76%	0.761	64%	0.635	S	S	*	*	H	α-helix	trans	-69.5	-38.9	177.9	-78.9	38.9	0	0	0	112.1	T825 D827	W823-T825 PolarHBondContact O-N 2.89Å; W823-D827 WeakPolarHBondContact O-CB 3.21Å; W823-D827 PolarHBondContact O-N 3.31Å; W823-D827 VanDerWaalsContact O-N 3.13Å
824	K	39.4	Very low	37.4	Very low	163 Å²	163	127.5 Å²	127.5	71%	0.709	63%	0.625	S	S	*	*	H	α-helix	trans	-70.5	-27.2	176.4	-86.1	-170.9	172.1	-177.6	0	114.5	L828	K824-L828 PolarHBondContact O-N 3.37Å
825	T	41.4	Very low	37.6	Very low	86 Å²	86	125.4 Å²	125.4	53%	0.528	62%	0.621	S	S	.	*	H	α-helix	trans	-79.7	-37.4	176.4	51	0	0	0	0	112.7	R821 T822 W823 Y829	R821-T825 PolarHBondContact O-OG1 3.36Å; T822-T825 PolarHBondContact O-OG1 2.81Å; T822-T825 VanDerWaalsContact O-OG1 3.11Å; W823-T825 PolarHBondContact O-N 2.89Å; T825-Y829 WeakPolarHBondContact O-CB 3.47Å; T825-Y829 PolarHBondContact O-N 2.75Å
826	H	37.2	Very low	37.8	Very low	117 Å²	117	124 Å²	124	54%	0.542	62%	0.616	S	S	.	*	H	α-helix	trans	-70.4	-37.5	175.5	-69.8	96.9	0	0	0	112.5	T822 L828 Y829 L830	T822-H826 PolarHBondContact O-N 2.85Å; T822-H826 PolarHBondContact O-ND1 3.45Å; H826-L828 PolarHBondContact O-N 3.36Å; H826-Y829 PolarHBondContact O-N 2.8Å; H826-L830 WeakPolarHBondContact O-CB 3.31Å; H826-L830 WeakPolarHBondContact O-CD1 3.39Å; H826-L830 PolarHBondContact O-N 3.34Å
827	D	34.9	Very low	38	Very low	76 Å²	76	126.2 Å²	126.2	41%	0.406	62%	0.624	S	S	.	*	H	α-helix	trans	-59.8	-44.3	173.5	-178.7	58	0	0	0	111.9	W823 K831	W823-D827 WeakPolarHBondContact O-CB 3.21Å; W823-D827 PolarHBondContact O-N 3.31Å; W823-D827 VanDerWaalsContact O-N 3.13Å; D827-K831 VanDerWaalsContact O-CB 3.31Å; D827-K831 WeakPolarHBondContact O-CB 3.46Å; D827-K831 VanDerWaalsContact O-CG 3.28Å; D827-K831 WeakPolarHBondContact O-CG 3.37Å; D827-K831 PolarHBondContact O-N 3.14Å; D827-K831 WeakPolarHBondContact OD1-CE 3.45Å; D827-K831 IonicContact OD1-NZ 2.68Å; D827-K831 PolarHBondContact OD1-NZ 2.81Å; D827-K831 IonicContact OD2-NZ 2.72Å; D827-K831 PolarHBondContact OD2-NZ 3.03Å
828	L	42	Very low	37.9	Very low	119 Å²	119	123.1 Å²	123.1	62%	0.623	62%	0.624	S	S	*	*	H	α-helix	trans	-65	-41.1	174.1	-86.9	164.4	0	0	0	112.9	K824 H826 K831 Q832	K824-L828 PolarHBondContact O-N 3.37Å; H826-L828 PolarHBondContact O-N 3.36Å; L828-K831 PolarHBondContact O-N 2.92Å; L828-Q832 VanDerWaalsContact O-CB 3.28Å; L828-Q832 WeakPolarHBondContact O-CB 3.01Å; L828-Q832 PolarHBondContact O-N 2.81Å
829	Y	38.4	Very low	37.7	Very low	161 Å²	161	121 Å²	121	63%	0.631	63%	0.629	S	S	*	*	H	α-helix	trans	-70.9	-36.4	179.7	-161.2	-105.7	0	0	0	112.6	T825 H826 K833	T825-Y829 WeakPolarHBondContact O-CB 3.47Å; T825-Y829 PolarHBondContact O-N 2.75Å; H826-Y829 PolarHBondContact O-N 2.8Å; Y829-K833 WeakPolarHBondContact O-CB 3.33Å; Y829-K833 PolarHBondContact O-N 2.87Å
830	L	38.7	Very low	37.5	Very low	105 Å²	105	123.2 Å²	123.2	55%	0.55	64%	0.636	S	S	.	*	H	α-helix	trans	-64.9	-47.4	170	-97	76.3	0	0	0	111	H826 Q832 K833 L834	H826-L830 WeakPolarHBondContact O-CB 3.31Å; H826-L830 WeakPolarHBondContact O-CD1 3.39Å; H826-L830 PolarHBondContact O-N 3.34Å; L830-Q832 VanDerWaalsContact C-N 3.34Å; L830-Q832 PolarHBondContact O-N 2.86Å; L830-K833 CarbonylContact O-C 3.56Å; L830-K833 PolarHBondContact O-N 2.87Å; L830-K833 VanDerWaalsContact O-N 3.11Å; L830-L834 VanDerWaalsContact O-CD1 3.26Å; L830-L834 WeakPolarHBondContact O-CD1 3.5Å; L830-L834 PolarHBondContact O-N 2.8Å
831	K	36.5	Very low	37.5	Very low	119 Å²	119	130.3 Å²	130.3	52%	0.517	65%	0.648	S	S	.	*	H	α-helix	trans	-64.1	-37.3	179.7	-75.6	169.4	178.7	162.7	0	112.7	D827 L828 K833 L834 A835	D827-K831 VanDerWaalsContact O-CB 3.31Å; D827-K831 WeakPolarHBondContact O-CB 3.46Å; D827-K831 VanDerWaalsContact O-CG 3.28Å; D827-K831 WeakPolarHBondContact O-CG 3.37Å; D827-K831 PolarHBondContact O-N 3.14Å; D827-K831 WeakPolarHBondContact OD1-CE 3.45Å; D827-K831 IonicContact OD1-NZ 2.68Å; D827-K831 PolarHBondContact OD1-NZ 2.81Å; D827-K831 IonicContact OD2-NZ 2.72Å; D827-K831 PolarHBondContact OD2-NZ 3.03Å; L828-K831 PolarHBondContact O-N 2.92Å; K831-K833 VanDerWaalsContact C-N 3.33Å; K831-L834 PolarHBondContact O-N 2.89Å; K831-A835 WeakPolarHBondContact O-CB 3.37Å; K831-A835 PolarHBondContact O-N 2.76Å
832	Q	38	Very low	37.2	Very low	135 Å²	135	125.2 Å²	125.2	63%	0.631	64%	0.636	S	S	*	*	H	α-helix	trans	-68.9	-32.4	173.9	-164.9	168.7	22.7	0	0	111.9	L828 L830 L836	L828-Q832 VanDerWaalsContact O-CB 3.28Å; L828-Q832 WeakPolarHBondContact O-CB 3.01Å; L828-Q832 PolarHBondContact O-N 2.81Å; L830-Q832 VanDerWaalsContact C-N 3.34Å; L830-Q832 PolarHBondContact O-N 2.86Å; Q832-L836 WeakPolarHBondContact O-CB 3.36Å; Q832-L836 PolarHBondContact O-N 2.74Å
833	K	34.9	Very low	37	Very low	140 Å²	140	128.5 Å²	128.5	61%	0.609	65%	0.647	S	S	*	*	H	α-helix	trans	-77.5	-29.7	174.3	-157.9	173.4	-174.3	-176.5	0	113.3	Y829 L830 K831	Y829-K833 WeakPolarHBondContact O-CB 3.33Å; Y829-K833 PolarHBondContact O-N 2.87Å; L830-K833 CarbonylContact O-C 3.56Å; L830-K833 PolarHBondContact O-N 2.87Å; L830-K833 VanDerWaalsContact O-N 3.11Å; K831-K833 VanDerWaalsContact C-N 3.33Å
834	L	37.5	Very low	36.9	Very low	121 Å²	121	126 Å²	126	63%	0.634	64%	0.638	S	S	*	*	H	α-helix	trans	-69.7	-43.8	168	-96.1	83.1	0	0	0	111.5	L830 K831 L836 M837 G838	L830-L834 VanDerWaalsContact O-CD1 3.26Å; L830-L834 WeakPolarHBondContact O-CD1 3.5Å; L830-L834 PolarHBondContact O-N 2.8Å; K831-L834 PolarHBondContact O-N 2.89Å; L834-L836 PolarHBondContact O-N 2.68Å; L834-M837 CarbonylContact O-C 3.6Å; L834-M837 WeakPolarHBondContact O-CA 3.48Å; L834-M837 PolarHBondContact O-N 2.71Å; L834-G838 PolarHBondContact O-N 2.91Å
835	A	35.2	Very low	36.7	Very low	77 Å²	77	128.3 Å²	128.3	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-59.6	-29.7	176.8	0	0	0	0	0	112.3	K831 M837	K831-A835 WeakPolarHBondContact O-CB 3.37Å; K831-A835 PolarHBondContact O-N 2.76Å; A835-M837 VanDerWaalsContact C-N 3.27Å; A835-M837 PolarHBondContact O-N 3.02Å
836	L	36.4	Very low	36.3	Very low	151 Å²	151	125.4 Å²	125.4	79%	0.791	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-0.5	176.7	-150	160.7	0	0	0	113.1	Q832 L834	Q832-L836 WeakPolarHBondContact O-CB 3.36Å; Q832-L836 PolarHBondContact O-N 2.74Å; L834-L836 PolarHBondContact O-N 2.68Å
837	M	37.1	Very low	36.1	Very low	163 Å²	163	121.9 Å²	121.9	80%	0.803	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	5.6	168.4	-53.1	-144	-45.7	0	0	113.3	L834 A835 G839	L834-M837 CarbonylContact O-C 3.6Å; L834-M837 WeakPolarHBondContact O-CA 3.48Å; L834-M837 PolarHBondContact O-N 2.71Å; A835-M837 VanDerWaalsContact C-N 3.27Å; A835-M837 PolarHBondContact O-N 3.02Å; M837-G839 VanDerWaalsContact C-N 3.3Å; M837-G839 PolarHBondContact O-N 2.9Å
838	G	36.8	Very low	35.9	Very low	70 Å²	70	122.1 Å²	122.1	72%	0.722	63%	0.625	S	S	*	*			trans	-95	31.9	178.6	0	0	0	0	0	113.1	L834	L834-G838 PolarHBondContact O-N 2.91Å
839	G	34.9	Very low	35.4	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	63%	0.625	S	S	*	*	S	Bend	trans	-118.6	8.2	-164.4	0	0	0	0	0	116.1	M837	M837-G839 VanDerWaalsContact C-N 3.3Å; M837-G839 PolarHBondContact O-N 2.9Å
840	E	35.1	Very low	35	Very low	181 Å²	181	121.7 Å²	121.7	85%	0.846	63%	0.63	S	S	*	*			trans	-154.2	128.7	173.2	-107.3	156.2	-159.4	0	0	108.5	D842	E840-D842 PolarHBondContact O-N 2.89Å
841	R	39.1	Very low	34.7	Very low	216 Å²	216	123.4 Å²	123.4	82%	0.815	64%	0.635	S	S	*	*			trans	-85.8	84.7	177.7	-75.2	-175	179.6	-179.2	-4.4	109.7
842	D	34.2	Very low	34.4	Very low	98 Å²	98	122 Å²	122	52%	0.524	64%	0.64	S	S	.	*			trans	-122.8	67.3	-179.1	-152.6	30.1	0	0	0	110.2	E840 R844	E840-D842 PolarHBondContact O-N 2.89Å; D842-R844 PolarHBondContact O-N 3.22Å; D842-R844 IonicContact OD1-CZ 2.99Å; D842-R844 IonicContact OD1-NE 3.98Å; D842-R844 PolarHBondContact OD1-NE 3.3Å; D842-R844 VanDerWaalsContact OD1-NE 3.16Å; D842-R844 IonicContact OD1-NH2 3.54Å; D842-R844 PolarHBondContact OD1-NH2 2.7Å; D842-R844 IonicContact OD2-CZ 3.85Å; D842-R844 VanDerWaalsContact OD2-CZ 3.26Å; D842-R844 IonicContact OD2-NE 2.76Å; D842-R844 PolarHBondContact OD2-NE 3.36Å; D842-R844 IonicContact OD2-NH2 2.64Å; D842-R844 PolarHBondContact OD2-NH2 3.39Å
843	E	35	Very low	34.1	Very low	132 Å²	132	120.4 Å²	120.4	62%	0.617	63%	0.629	S	S	*	*			trans	-73.4	64	-176.1	-68.3	-160.7	149.4	0	0	113.3	Y845	E843-Y845 PolarHBondContact O-N 2.94Å
844	R	32	Very low	33.8	Very low	147 Å²	147	119.3 Å²	119.3	56%	0.555	63%	0.63	S	S	*	*			trans	-80	49.5	177.2	-52.7	-163.4	-163.8	-125.9	-8.1	112.7	P130 D842 A846	P130-R844 HydrophobicContact CB-CB 3.91Å; P130-R844 HydrophobicContact CB-CG 3.64Å; D842-R844 PolarHBondContact O-N 3.22Å; D842-R844 IonicContact OD1-CZ 2.99Å; D842-R844 IonicContact OD1-NE 3.98Å; D842-R844 PolarHBondContact OD1-NE 3.3Å; D842-R844 VanDerWaalsContact OD1-NE 3.16Å; D842-R844 IonicContact OD1-NH2 3.54Å; D842-R844 PolarHBondContact OD1-NH2 2.7Å; D842-R844 IonicContact OD2-CZ 3.85Å; D842-R844 VanDerWaalsContact OD2-CZ 3.26Å; D842-R844 IonicContact OD2-NE 2.76Å; D842-R844 PolarHBondContact OD2-NE 3.36Å; D842-R844 IonicContact OD2-NH2 2.64Å; D842-R844 PolarHBondContact OD2-NH2 3.39Å; R844-A846 PolarHBondContact O-N 3.13Å; R844-A846 VanDerWaalsContact O-N 3.07Å
845	Y	35.2	Very low	33.6	Very low	212 Å²	212	121.8 Å²	121.8	83%	0.831	63%	0.631	S	S	*	*			trans	-82.4	85.4	178.5	-74.8	-64.6	0	0	0	112.2	E843 G847	E843-Y845 PolarHBondContact O-N 2.94Å; Y845-G847 PolarHBondContact O-N 2.96Å
846	A	33.4	Very low	33.7	Very low	26 Å²	26	124.9 Å²	124.9	22%	0.215	63%	0.633	C	S	.	*			trans	-61.5	117.2	169.8	0	0	0	0	0	112	W127 S128 R844	W127-A846 HydrophobicContact CB-CB 3.69Å; W127-A846 HydrophobicContact CD2-CB 4.31Å; W127-A846 HydrophobicContact CE3-CB 3.72Å; W127-A846 HydrophobicContact CG-CB 4.37Å; S128-A846 WeakPolarHBondContact O-CB 3.32Å; S128-A846 WeakPolarHBondContact OG-CA 3.33Å; R844-A846 PolarHBondContact O-N 3.13Å; R844-A846 VanDerWaalsContact O-N 3.07Å
847	G	32.4	Very low	33.7	Very low	42 Å²	42	120.3 Å²	120.3	43%	0.433	62%	0.622	S	S	.	*			trans	-68.5	136.5	169.5	0	0	0	0	0	112.2	S128 Y845	S128-G847 PolarHBondContact OG-N 2.03Å; S128-G847 PolarHBondContact OG-O 2.96Å; Y845-G847 PolarHBondContact O-N 2.96Å
848	D	30.3	Very low	33.5	Very low	82 Å²	82	120.9 Å²	120.9	44%	0.439	63%	0.628	S	S	.	*	B	Isolated β-bridge	trans	-86.7	106.7	-177	-159.4	-8.6	0	0	0	110.1	R125	R125-D848 IonicContact CZ-OD2 2.81Å; R125-D848 IonicContact NH1-OD2 3.96Å; R125-D848 PolarHBondContact NH1-OD2 3.47Å
849	I	33.1	Very low	33.4	Very low	122 Å²	122	126.1 Å²	126.1	63%	0.626	63%	0.634	S	S	*	*			trans	-122.1	115.7	175.5	-58.4	179.4	0	0	0	108.5
850	M	29.7	Very low	33.5	Very low	149 Å²	149	125.8 Å²	125.8	73%	0.734	62%	0.621	S	S	*	*			trans	-85	120.9	175.9	-70.6	-162.3	-173.5	0	0	111.9
851	H	32.9	Very low	33.5	Very low	140 Å²	140	123.1 Å²	123.1	65%	0.648	62%	0.617	S	S	*	*			trans	-133.9	159.1	159.8	-84	-78.4	0	0	0	110.7	L216	L216-H851 HydrophobicContact CD1-CB 3.34Å
852	S	28.5	Very low	33.3	Very low	89 Å²	89	120.8 Å²	120.8	62%	0.622	62%	0.615	S	S	*	*			trans	-115.6	143.9	-171.5	55.4	0	0	0	0	112.9
853	Y	32.3	Very low	33.5	Very low	103 Å²	103	119.5 Å²	119.5	40%	0.404	63%	0.625	S	S	.	*			trans	-118.4	174.1	167.7	-58.1	-93	0	0	0	110.3	R126 L216	R126-Y853 PolarHBondContact NH1-OH 3.23Å; L216-Y853 HydrophobicContact CB-CE1 4.4Å; L216-Y853 WeakPolarHBondContact CB-OH 3.42Å; L216-Y853 HydrophobicContact CD1-CE1 4.08Å; L216-Y853 HydrophobicContact CD1-CE2 3.96Å; L216-Y853 HydrophobicContact CG-CE1 3.76Å; L216-Y853 HydrophobicContact CG-CE2 4.48Å; L216-Y853 WeakPolarHBondContact CG-OH 3.01Å; L216-Y853 PolarHBondContact N-OH 2.9Å
854	D	28.2	Very low	33.4	Very low	117 Å²	117	118 Å²	118	63%	0.626	63%	0.629	S	S	*	*			trans	-120.3	146.9	-173.7	-76.6	-44.1	0	0	0	113.8	K121	K121-D854 IonicContact NZ-OD1 2.92Å; K121-D854 PolarHBondContact NZ-OD1 3.45Å
855	Y	34.7	Very low	33.6	Very low	172 Å²	172	115.9 Å²	115.9	68%	0.675	63%	0.632	S	S	*	*			trans	35.1	98	170.3	-58.2	-76.3	0	0	0	119.5	E111	E111-Y855 PolarHBondContact OE2-OH 3.32Å
856	E	37.2	Very low	33.6	Very low	142 Å²	142	108.6 Å²	108.6	66%	0.664	62%	0.622	S	S	*	*			trans	-78.2	143.1	151	-86.8	-169.4	104.9	0	0	111.3	S860	E856-S860 WeakPolarHBondContact OE1-CB 3.49Å; E856-S860 PolarHBondContact OE1-OG 2.93Å
857	G	34.9	Very low	33.6	Very low	55 Å²	55	111 Å²	111	57%	0.567	64%	0.636	S	S	*	*			trans	-80.9	167.6	172.8	0	0	0	0	0	114.1	E859	G857-E859 PolarHBondContact O-N 3.01Å
858	N	33.2	Very low	33.8	Very low	175 Å²	175	114.9 Å²	114.9	94%	0.936	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	20.5	-169.1	-163.9	62.3	0	0	0	115.9
859	E	36.3	Very low	34	Very low	180 Å²	180	116 Å²	116	84%	0.841	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	10.4	-175.2	-61.2	-166.8	161.9	0	0	113.9	G857 V861	G857-E859 PolarHBondContact O-N 3.01Å; E859-V861 WeakPolarHBondContact O-CG2 3.05Å; E859-V861 PolarHBondContact O-N 3.47Å; E859-V861 VanDerWaalsContact O-N 3.15Å
860	S	35.5	Very low	34.2	Very low	61 Å²	61	117.6 Å²	117.6	43%	0.427	67%	0.674	S	S	.	*			trans	-68.9	110	178.5	-166.7	0	0	0	0	112.3	E856 H862	E856-S860 WeakPolarHBondContact OE1-CB 3.49Å; E856-S860 PolarHBondContact OE1-OG 2.93Å; S860-H862 VanDerWaalsContact C-N 3.3Å; S860-H862 PolarHBondContact O-N 2.88Å
861	V	35.8	Very low	34.3	Very low	126 Å²	126	120.6 Å²	120.6	76%	0.764	68%	0.679	S	S	*	*			trans	-80.7	-2.6	-169.1	-149.5	0	0	0	0	114	E859	E859-V861 WeakPolarHBondContact O-CG2 3.05Å; E859-V861 PolarHBondContact O-N 3.47Å; E859-V861 VanDerWaalsContact O-N 3.15Å
862	H	34.9	Very low	34.5	Very low	166 Å²	166	117 Å²	117	77%	0.769	68%	0.679	S	S	*	*			trans	-123.3	65	-164.8	-68.3	98.2	0	0	0	114.2	S860 S864	S860-H862 VanDerWaalsContact C-N 3.3Å; S860-H862 PolarHBondContact O-N 2.88Å; H862-S864 PolarHBondContact O-N 2.86Å; H862-S864 VanDerWaalsContact O-N 3.11Å
863	G	37.2	Very low	34.8	Very low	71 Å²	71	120.2 Å²	120.2	73%	0.732	69%	0.689	S	S	*	*			trans	-69.6	101.1	176.2	0	0	0	0	0	114.1
864	S	34.2	Very low	35.3	Very low	100 Å²	100	125 Å²	125	70%	0.699	71%	0.712	S	S	*	*			trans	-75.3	122.1	172.7	62.1	0	0	0	0	112.2	H862	H862-S864 PolarHBondContact O-N 2.86Å; H862-S864 VanDerWaalsContact O-N 3.11Å
865	V	35.7	Very low	36.1	Very low	104 Å²	104	128.6 Å²	128.6	63%	0.63	73%	0.725	S	S	*	*			trans	-96.6	111.3	177.5	-176.7	0	0	0	0	110.6
866	G	35.3	Very low	36.6	Very low	59 Å²	59	126 Å²	126	61%	0.608	72%	0.723	S	S	*	*			trans	-97.5	131	168.6	0	0	0	0	0	111.6	C868	G866-C868 PolarHBondContact O-N 2.83Å
867	C	32.8	Very low	37.4	Very low	76 Å²	76	124.6 Å²	124.6	51%	0.514	72%	0.719	S	S	.	*	S	Bend	trans	-75.6	62.7	178.7	-71.8	0	0	0	0	113.3	C894	C867-C894 HydrophobicContact CB-CB 4.01Å; C867-C894 WeakPolarHBondContact CB-SG 3.3Å; C867-C894 WeakPolarHBondContact SG-CB 3.27Å; C867-C894 CovalentContact SG-SG 2.05Å; C867-C894 PolarHBondContact SG-SG 3.19Å
868	C	37	Very low	38.2	Very low	124 Å²	124	127.4 Å²	127.4	84%	0.838	72%	0.722	S	S	*	*			trans	-144.2	46.6	168.3	-86.1	0	0	0	0	111.7	G866	G866-C868 PolarHBondContact O-N 2.83Å
869	S	35.1	Very low	39.2	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	70%	0.704	S	S	*	*			trans	-96.3	87	171.4	58.7	0	0	0	0	110.9	Y871	S869-Y871 VanDerWaalsContact C-N 3.3Å; S869-Y871 PolarHBondContact O-N 3.31Å
870	E	36.3	Very low	39.9	Very low	156 Å²	156	119 Å²	119	73%	0.729	68%	0.676	S	S	*	*			trans	-72.2	82.3	172.1	-72.9	-165.4	168.3	0	0	111.6	R82	R82-E870 PolarHBondContact NH2-O 2.88Å
871	Y	33.3	Very low	40.7	Very low	213 Å²	213	121.1 Å²	121.1	84%	0.835	68%	0.683	S	S	*	*			trans	-105.3	119	154.5	-100.2	-94.9	0	0	0	108.9	S869	S869-Y871 VanDerWaalsContact C-N 3.3Å; S869-Y871 PolarHBondContact O-N 3.31Å
872	G	35.5	Very low	41.4	Very low	63 Å²	63	120.7 Å²	120.7	65%	0.649	68%	0.681	S	S	*	*			trans	-82.7	111.5	167.6	0	0	0	0	0	109.1
873	D	34.9	Very low	42.1	Very low	157 Å²	157	115.8 Å²	115.8	84%	0.84	66%	0.659	S	S	*	*			trans	-163.6	128.1	133.4	-93.7	-29.4	0	0	0	107.8	E875	D873-E875 PolarHBondContact O-N 3.09Å
874	K	43.2	Very low	42.7	Very low	205 Å²	205	114.2 Å²	114.2	89%	0.891	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	2.2	-157.2	-126.5	-179.4	-176.3	-177.7	0	115.5
875	E	44.3	Very low	43.5	Very low	192 Å²	192	115.3 Å²	115.3	90%	0.897	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	19.2	-165.8	-60.1	-164.2	155.3	0	0	115.1	D873	D873-E875 PolarHBondContact O-N 3.09Å
876	N	46.1	Very low	43.9	Very low	118 Å²	118	119.2 Å²	119.2	63%	0.631	66%	0.657	S	S	*	*			trans	-135.3	99.8	166.9	-161.9	-27.3	0	0	0	112.6	D878	N876-D878 PolarHBondContact OD1-N 3.06Å
877	L	54.7	Low	44.4	Very low	111 Å²	111	121.7 Å²	121.7	58%	0.581	65%	0.651	S	S	*	*			trans	-113.7	8.3	179.4	-67.6	175.9	0	0	0	113	F879 L880	L877-F879 PolarHBondContact O-N 3.2Å; L877-F879 VanDerWaalsContact O-N 3.13Å; L877-L880 PolarHBondContact O-N 3.02Å; L877-L880 HydrophobicContact CD2-CD1 4.15Å; L877-L880 WeakPolarHBondContact O-CB 3.31Å; L877-L880 HydrophobicContact CB-CD1 4.36Å
878	D	51.7	Low	45.1	Very low	115 Å²	115	122.5 Å²	122.5	62%	0.615	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-62.3	-26.4	-173	-77.3	-27.2	0	0	0	113.4	N876 L880 N881	N876-D878 PolarHBondContact OD1-N 3.06Å; D878-L880 PolarHBondContact O-N 3.21Å; D878-N881 WeakPolarHBondContact O-CB 3.4Å; D878-N881 PolarHBondContact O-N 2.93Å
879	F	53.3	Low	45.7	Very low	129 Å²	129	120.5 Å²	120.5	57%	0.566	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-54.7	-31.4	170.8	137.7	-102.2	0	0	0	113.1	L877 N881 T882 L883	L877-F879 PolarHBondContact O-N 3.2Å; L877-F879 VanDerWaalsContact O-N 3.13Å; F879-N881 PolarHBondContact O-N 2.95Å; F879-N881 VanDerWaalsContact O-N 3.15Å; F879-T882 PolarHBondContact O-N 3.27Å; F879-T882 VanDerWaalsContact O-N 3.09Å; F879-T882 PolarHBondContact O-OG1 3.15Å; F879-L883 HydrophobicContact CE2-CD1 4.06Å; F879-L883 HydrophobicContact CE2-CD2 4.03Å; F879-L883 HydrophobicContact CE2-CG 4.07Å; F879-L883 HydrophobicContact CZ-CD1 3.91Å; F879-L883 HydrophobicContact CZ-CG 4.44Å
880	L	50.8	Low	46.1	Very low	48 Å²	48	119.3 Å²	119.3	25%	0.251	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-66.2	-16.4	177.2	-63.4	179.7	0	0	0	113.1	L877 D878 L883	L877-L880 PolarHBondContact O-N 3.02Å; L877-L880 HydrophobicContact CD2-CD1 4.15Å; L877-L880 WeakPolarHBondContact O-CB 3.31Å; L877-L880 HydrophobicContact CB-CD1 4.36Å; D878-L880 PolarHBondContact O-N 3.21Å; L880-L883 HydrophobicContact CD2-CD1 4Å
881	N	51.6	Low	46.7	Very low	107 Å²	107	112.9 Å²	112.9	57%	0.572	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-86.4	-11.3	175.4	-64.7	-53	0	0	0	113.7	D878 F879 K888	D878-N881 WeakPolarHBondContact O-CB 3.4Å; D878-N881 PolarHBondContact O-N 2.93Å; F879-N881 PolarHBondContact O-N 2.95Å; F879-N881 VanDerWaalsContact O-N 3.15Å; N881-K888 PolarHBondContact OD1-NZ 3.45Å
882	T	51.7	Low	47.5	Very low	117 Å²	117	107.3 Å²	107.3	72%	0.718	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-12.8	171.6	65.9	0	0	0	0	112.8	F879	F879-T882 PolarHBondContact O-N 3.27Å; F879-T882 VanDerWaalsContact O-N 3.09Å; F879-T882 PolarHBondContact O-OG1 3.15Å
883	L	49.8	Very low	48.1	Very low	62 Å²	62	109 Å²	109	33%	0.325	57%	0.57	S	S	.	*	S	Bend	trans	-75.3	122.9	172.6	-63.2	179.6	0	0	0	110.9	F879 L880 F887	F879-L883 HydrophobicContact CE2-CD1 4.06Å; F879-L883 HydrophobicContact CE2-CD2 4.03Å; F879-L883 HydrophobicContact CE2-CG 4.07Å; F879-L883 HydrophobicContact CZ-CD1 3.91Å; F879-L883 HydrophobicContact CZ-CG 4.44Å; L880-L883 HydrophobicContact CD2-CD1 4Å; L883-F887 HydrophobicContact CB-CB 4.17Å
884	G	49.8	Very low	48.5	Very low	38 Å²	38	104.9 Å²	104.9	39%	0.392	55%	0.552	S	S	.	*			trans	-59.2	159.1	-179.9	0	0	0	0	0	113.7	K886 F887	G884-K886 PolarHBondContact O-N 3.09Å; G884-F887 PolarHBondContact O-N 3.26Å
885	P	51.4	Low	48.6	Very low	123 Å²	123	99.7 Å²	99.7	80%	0.799	54%	0.538	S	S	*	.	H	α-helix	trans	-59.6	-18.2	-162.1	19.9	-33	0	0	0	116.3	F887	P885-F887 VanDerWaalsContact C-N 3.34Å
886	K	43	Very low	48.5	Very low	186 Å²	186	99 Å²	99	81%	0.809	53%	0.532	S	S	*	.	H	α-helix	trans	-69.1	-24.2	172.2	-91.6	-170.3	172.1	-174.9	0	114.5	G884 T889	G884-K886 PolarHBondContact O-N 3.09Å; K886-T889 PolarHBondContact O-OG1 2.88Å
887	F	45.3	Very low	48.1	Very low	111 Å²	111	108.6 Å²	108.6	49%	0.487	56%	0.559	S	S	.	*	H	α-helix	trans	-99.5	-18.2	-174.7	-68.4	-76.8	0	0	0	113.6	L883 G884 P885 T889 L890 G891	L883-F887 HydrophobicContact CB-CB 4.17Å; G884-F887 PolarHBondContact O-N 3.26Å; P885-F887 VanDerWaalsContact C-N 3.34Å; F887-T889 VanDerWaalsContact C-N 3.29Å; F887-T889 PolarHBondContact O-N 3.12Å; F887-L890 WeakPolarHBondContact O-CB 3.42Å; F887-L890 PolarHBondContact O-N 3.44Å; F887-L890 VanDerWaalsContact O-N 3.07Å; F887-G891 PolarHBondContact O-N 2.77Å
888	K	47.7	Very low	47.7	Very low	93 Å²	93	108.5 Å²	108.5	40%	0.404	56%	0.558	S	S	.	*	H	α-helix	trans	-61.3	-38.2	-179.6	-163.6	164.2	-174.3	156.2	0	112.3	N881 L890 G891 E892	N881-K888 PolarHBondContact OD1-NZ 3.45Å; K888-L890 VanDerWaalsContact C-N 3.29Å; K888-L890 PolarHBondContact O-N 3.44Å; K888-G891 PolarHBondContact O-N 2.98Å; K888-E892 PolarHBondContact O-N 3.31Å; K888-E892 WeakPolarHBondContact O-CG 3.47Å
889	T	51	Low	47.5	Very low	83 Å²	83	108.1 Å²	108.1	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-60.8	-31.8	173.8	46.8	0	0	0	0	113.7	K886 F887 V893	K886-T889 PolarHBondContact O-OG1 2.88Å; F887-T889 VanDerWaalsContact C-N 3.29Å; F887-T889 PolarHBondContact O-N 3.12Å; T889-V893 WeakPolarHBondContact O-CG2 3.24Å; T889-V893 PolarHBondContact O-N 2.85Å
890	L	41.8	Very low	47.2	Very low	79 Å²	79	106.9 Å²	106.9	41%	0.414	55%	0.554	S	S	.	*	H	α-helix	trans	-74.7	-38.4	176.8	-159.9	73.5	0	0	0	111.3	F887 K888 V893 C894	F887-L890 WeakPolarHBondContact O-CB 3.42Å; F887-L890 PolarHBondContact O-N 3.44Å; F887-L890 VanDerWaalsContact O-N 3.07Å; K888-L890 VanDerWaalsContact C-N 3.29Å; K888-L890 PolarHBondContact O-N 3.44Å; L890-V893 PolarHBondContact O-N 2.59Å; L890-C894 PolarHBondContact O-N 3.39Å
891	G	49.4	Very low	47	Very low	21 Å²	21	110.4 Å²	110.4	22%	0.216	57%	0.572	C	S	.	*	H	α-helix	trans	-63.1	-39.4	170.9	0	0	0	0	0	112.8	F887 K888 V893 C894 T895	F887-G891 PolarHBondContact O-N 2.77Å; K888-G891 PolarHBondContact O-N 2.98Å; G891-V893 VanDerWaalsContact C-N 3.26Å; G891-V893 PolarHBondContact O-N 2.96Å; G891-C894 PolarHBondContact O-N 3.01Å; G891-T895 WeakPolarHBondContact O-CB 3.39Å; G891-T895 PolarHBondContact O-OG1 3.46Å; G891-T895 VanDerWaalsContact O-N 3.13Å; G891-T895 PolarHBondContact O-N 2.99Å; G891-T895 WeakPolarHBondContact O-CG2 3.42Å
892	E	50.2	Low	46.7	Very low	96 Å²	96	110.6 Å²	110.6	45%	0.449	57%	0.572	S	S	.	*	H	α-helix	trans	-69	-19.7	175.2	-72.9	171.1	-170.2	0	0	113.8	K888 T895	K888-E892 PolarHBondContact O-N 3.31Å; K888-E892 WeakPolarHBondContact O-CG 3.47Å; E892-T895 WeakPolarHBondContact CA-OG1 3.42Å
893	V	47.6	Very low	46.4	Very low	99 Å²	99	110.2 Å²	110.2	60%	0.6	56%	0.562	S	S	*	*	H	α-helix	trans	-82.2	-51.2	170.7	167.4	0	0	0	0	110.8	T889 L890 G891 T895 K896	T889-V893 WeakPolarHBondContact O-CG2 3.24Å; T889-V893 PolarHBondContact O-N 2.85Å; L890-V893 PolarHBondContact O-N 2.59Å; G891-V893 VanDerWaalsContact C-N 3.26Å; G891-V893 PolarHBondContact O-N 2.96Å; V893-T895 PolarHBondContact O-N 3.13Å; V893-T895 VanDerWaalsContact O-N 3.15Å; V893-K896 PolarHBondContact O-N 3.37Å
894	C	43.9	Very low	46.1	Very low	70 Å²	70	113.6 Å²	113.6	47%	0.473	58%	0.579	S	S	.	*	H	α-helix	trans	-73.7	-2.3	-177.7	-63.5	0	0	0	0	114.2	C867 L890 G891	C867-C894 HydrophobicContact CB-CB 4.01Å; C867-C894 WeakPolarHBondContact CB-SG 3.3Å; C867-C894 WeakPolarHBondContact SG-CB 3.27Å; C867-C894 CovalentContact SG-SG 2.05Å; C867-C894 PolarHBondContact SG-SG 3.19Å; L890-C894 PolarHBondContact O-N 3.39Å; G891-C894 PolarHBondContact O-N 3.01Å
895	T	44.5	Very low	45.8	Very low	95 Å²	95	119.5 Å²	119.5	58%	0.583	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-6.3	171.1	46.4	0	0	0	0	114.5	G891 E892 V893	G891-T895 WeakPolarHBondContact O-CB 3.39Å; G891-T895 PolarHBondContact O-OG1 3.46Å; G891-T895 VanDerWaalsContact O-N 3.13Å; G891-T895 PolarHBondContact O-N 2.99Å; G891-T895 WeakPolarHBondContact O-CG2 3.42Å; E892-T895 WeakPolarHBondContact CA-OG1 3.42Å; V893-T895 PolarHBondContact O-N 3.13Å; V893-T895 VanDerWaalsContact O-N 3.15Å
896	K	43.5	Very low	45.4	Very low	177 Å²	177	119.2 Å²	119.2	77%	0.77	58%	0.577	S	S	*	*			trans	-94.4	98.5	176.1	-77.2	178.4	179.8	170.8	0	111.8	V893	V893-K896 PolarHBondContact O-N 3.37Å
897	R	36.4	Very low	45.6	Very low	320 Å²	320	113.1 Å²	113.1	100%	1.208	56%	0.556	S	S	*	*			trans	-134.3	0	158.9	-101.3	-171.1	174	-171.9	-0.3	109.3

Retrieved 897 of 897 residues in 814.6 ms (Link to these results)

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