A0A3Q0KSR3_SCHMA Loading...

Putative granulin

AlphaFold DB , UniProt , Accession A0A3Q0KSR3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 920 aa.

						>A0A3Q0KSR3_SCHMA|A0A3Q0KSR3
MLFVIYVLFLCRTGIVYSNLCPRQCLPGSCCEVEENDFRCCPYANGVCCSDGKNCCPQGTKCDMELGQCRSSNGAVLLSKHMSEKVIGDLKTSALDVVLRRLSANYIMCPDRLSVCQDNTTCCPMSGEIWGCCQHANAICCPDGEHCCPHGSVCDMVNHSCKPAKSNEIPEMKESFPTLHLVSASAPARLNPNVKPSKASRRKNIHQPSAKYLLAYSGVVCPDPLYECPDNTTCCSSSDEKWACCPIPQTVSFLGVSDKALHKSLEQLHSNKNSSYSVANFNLTWVRLSILNGTQLCPDAKSRCSDEQTCCKLKTGEWGCCPVKNAVCCSDGEHCCPNGYTCDLSVGECIKNSHSSNESKKFSSNTILSSLPIKIGSNALCPDSDVYCSDNSTCCEHDKKWGCCLFPNAVCCSDGIHCCPQNTICDVQEEMCISKSGDMITKLQLKSTPKLHSFKSNSRINICSDMKSVCINGTCCSNVNDPLSTLCCPYENAVCCSDGKHCCPKGTTCDMINGGCIISQEGLSKSNSIPLLTKIRALHVTSKNNTQSIVFTQICPGGKAKCPDSSTCCKLSSGKYACCPIPNAICCADDIHCCPPGTSCDYKTLSCVKANNDHSIGSPSANELLRNPKLLFTGVRDHVCPGHQSTCSDDQTCCRLPDKSWGCCPLKNGVCCGDHFHCCPAGSVCDLDTKQCILQLELNQSTTKIVYDGFTMHIANRKSSDRLYSQPVKSISTIDASVQAKWCGACGDTWACCPDATFNSWSCCPYVGGECCIGQNICCPPGSRCLNNGKCEKISKNIMKSFAPTLIPSISKNNNLQKSYFIQQNNVKENFHIEMSNIAKPAQRNILLLVRHYRRLKRQLHTICPDSLHYCGKSEQCCLSNKFGYTCTPNKSICCGSNMDTYCPIYKDCSLDGKFCIDKY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.6	Very low	54.5	Low	189 Å²	189	117.6 Å²	117.6	93%	0.931	59%	0.592	S	S	*	*				0	-63.7	0	-80.5	-61.8	-157.4	0	0	111.7	F3 V4 I5	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 2.74Å; M1-V4 PolarHBondContact O-N 2.96Å; M1-I5 WeakPolarHBondContact O-CG1 3.49Å; M1-I5 PolarHBondContact O-N 2.9Å
2	L	49.1	Very low	54.2	Low	153 Å²	153	127.3 Å²	127.3	80%	0.801	62%	0.616	S	S	*	*	H	α-helix	trans	-54.1	-38.8	178.5	-79.2	153.2	0	0	0	114.2	I5 Y6	L2-I5 PolarHBondContact O-N 2.64Å; L2-Y6 VanDerWaalsContact O-CB 3.23Å; L2-Y6 WeakPolarHBondContact O-CB 2.91Å; L2-Y6 PolarHBondContact O-N 3.11Å
3	F	49	Very low	53.7	Low	160 Å²	160	122.9 Å²	122.9	70%	0.702	60%	0.602	S	S	*	*	H	α-helix	trans	-69.7	-32	177.4	-153.9	-96.4	0	0	0	113.7	M1 V7	M1-F3 VanDerWaalsContact C-N 3.28Å; M1-F3 PolarHBondContact O-N 2.74Å; F3-V7 HydrophobicContact CD1-CG2 4.24Å; F3-V7 HydrophobicContact CE1-CG2 4.25Å; F3-V7 WeakPolarHBondContact O-CB 3.2Å; F3-V7 WeakPolarHBondContact O-CG2 3.32Å; F3-V7 PolarHBondContact O-N 2.99Å
4	V	56	Low	53	Low	86 Å²	86	116.9 Å²	116.9	52%	0.521	59%	0.587	S	S	.	*	H	α-helix	trans	-78.4	-37.9	177.9	178.7	0	0	0	0	110.2	M1 Y6 V7 L8	M1-V4 PolarHBondContact O-N 2.96Å; V4-Y6 VanDerWaalsContact C-N 3.31Å; V4-V7 PolarHBondContact O-N 3.4Å; V4-L8 HydrophobicContact CG1-CD1 3.99Å; V4-L8 HydrophobicContact CG1-CG 4.47Å; V4-L8 VanDerWaalsContact O-CB 3.32Å; V4-L8 WeakPolarHBondContact O-CB 2.87Å; V4-L8 WeakPolarHBondContact O-CG 3.32Å; V4-L8 PolarHBondContact O-N 3.44Å
5	I	68.6	Low	52.5	Low	97 Å²	97	116.3 Å²	116.3	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-62.8	-42.1	171.2	-64.1	168.7	0	0	0	109.6	M1 L2 L8 F9	M1-I5 WeakPolarHBondContact O-CG1 3.49Å; M1-I5 PolarHBondContact O-N 2.9Å; L2-I5 PolarHBondContact O-N 2.64Å; I5-L8 PolarHBondContact O-N 2.98Å; I5-F9 WeakPolarHBondContact O-CB 3.31Å; I5-F9 PolarHBondContact O-N 3.1Å
6	Y	64.4	Low	51.9	Low	145 Å²	145	114.3 Å²	114.3	57%	0.569	58%	0.58	S	S	*	*	H	α-helix	trans	-62.9	-44.8	176.1	-172.5	-105.9	0	0	0	112.7	L2 V4 F9 L10	L2-Y6 VanDerWaalsContact O-CB 3.23Å; L2-Y6 WeakPolarHBondContact O-CB 2.91Å; L2-Y6 PolarHBondContact O-N 3.11Å; V4-Y6 VanDerWaalsContact C-N 3.31Å; Y6-F9 WeakPolarHBondContact O-CB 3.42Å; Y6-F9 PolarHBondContact O-N 3.47Å; Y6-L10 HydrophobicContact CD1-CD1 3.77Å; Y6-L10 HydrophobicContact CE1-CD1 3.45Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.45Å; Y6-L10 HydrophobicContact CE1-CG 4.35Å; Y6-L10 VanDerWaalsContact O-CG 3.29Å; Y6-L10 WeakPolarHBondContact O-CG 3.25Å; Y6-L10 PolarHBondContact O-N 3.46Å
7	V	56.3	Low	51.5	Low	66 Å²	66	115.8 Å²	115.8	40%	0.4	58%	0.578	S	S	.	*	H	α-helix	trans	-68	-36.7	176.5	171.9	0	0	0	0	112	F3 V4 L10 C11	F3-V7 HydrophobicContact CD1-CG2 4.24Å; F3-V7 HydrophobicContact CE1-CG2 4.25Å; F3-V7 WeakPolarHBondContact O-CB 3.2Å; F3-V7 WeakPolarHBondContact O-CG2 3.32Å; F3-V7 PolarHBondContact O-N 2.99Å; V4-V7 PolarHBondContact O-N 3.4Å; V7-L10 PolarHBondContact O-N 2.04Å; V7-C11 WeakPolarHBondContact O-CB 3.48Å; V7-C11 PolarHBondContact O-N 3.36Å; V7-C11 PolarHBondContact O-SG 3.48Å
8	L	54.6	Low	51.1	Low	108 Å²	108	114.2 Å²	114.2	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-70.7	-32.1	173.5	-71.7	169.8	0	0	0	112.4	V4 I5 R12	V4-L8 HydrophobicContact CG1-CD1 3.99Å; V4-L8 HydrophobicContact CG1-CG 4.47Å; V4-L8 VanDerWaalsContact O-CB 3.32Å; V4-L8 WeakPolarHBondContact O-CB 2.87Å; V4-L8 WeakPolarHBondContact O-CG 3.32Å; V4-L8 PolarHBondContact O-N 3.44Å; I5-L8 PolarHBondContact O-N 2.98Å; L8-R12 PolarHBondContact O-N 3.2Å; L8-R12 VanDerWaalsContact O-N 3.09Å
9	F	59.5	Low	51.1	Low	144 Å²	144	114.5 Å²	114.5	63%	0.632	58%	0.584	S	S	*	*	H	α-helix	trans	-65.7	-45.7	171.9	-135.2	-94	0	0	0	110.4	I5 Y6 C11 R12 T13	I5-F9 WeakPolarHBondContact O-CB 3.31Å; I5-F9 PolarHBondContact O-N 3.1Å; Y6-F9 WeakPolarHBondContact O-CB 3.42Å; Y6-F9 PolarHBondContact O-N 3.47Å; F9-C11 VanDerWaalsContact C-N 3.33Å; F9-C11 PolarHBondContact O-N 3.28Å; F9-R12 PolarHBondContact O-N 2.95Å; F9-T13 HydrophobicContact CD1-CG2 4.41Å; F9-T13 WeakPolarHBondContact O-CG2 3.47Å; F9-T13 PolarHBondContact O-N 2.74Å; F9-T13 VanDerWaalsContact O-N 3.13Å; F9-T13 PolarHBondContact O-OG1 3.28Å
10	L	49.2	Very low	51.2	Low	62 Å²	62	113.8 Å²	113.8	33%	0.325	58%	0.58	S	S	.	*	H	α-helix	trans	-67	-30.3	176.8	-69.4	174.1	0	0	0	113.4	Y6 V7 T13	Y6-L10 HydrophobicContact CD1-CD1 3.77Å; Y6-L10 HydrophobicContact CE1-CD1 3.45Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.45Å; Y6-L10 HydrophobicContact CE1-CG 4.35Å; Y6-L10 VanDerWaalsContact O-CG 3.29Å; Y6-L10 WeakPolarHBondContact O-CG 3.25Å; Y6-L10 PolarHBondContact O-N 3.46Å; V7-L10 PolarHBondContact O-N 2.04Å; L10-T13 WeakPolarHBondContact CA-OG1 3.29Å; L10-T13 PolarHBondContact O-OG1 2.77Å
11	C	48	Very low	51.8	Low	84 Å²	84	108.8 Å²	108.8	57%	0.568	56%	0.556	S	S	*	*	H	α-helix	trans	-75.8	-25.6	173.4	-68.1	0	0	0	0	112.7	V7 F9	V7-C11 WeakPolarHBondContact O-CB 3.48Å; V7-C11 PolarHBondContact O-N 3.36Å; V7-C11 PolarHBondContact O-SG 3.48Å; F9-C11 VanDerWaalsContact C-N 3.33Å; F9-C11 PolarHBondContact O-N 3.28Å
12	R	50.7	Low	52.5	Low	234 Å²	234	103.2 Å²	103.2	88%	0.883	53%	0.534	S	S	*	.	H	α-helix	trans	-83.2	-20.9	175.8	-85.2	-168.6	171.5	-168.1	-1.9	113.7	L8 F9 G14	L8-R12 PolarHBondContact O-N 3.2Å; L8-R12 VanDerWaalsContact O-N 3.09Å; F9-R12 PolarHBondContact O-N 2.95Å; R12-G14 VanDerWaalsContact C-N 3.34Å
13	T	48.7	Very low	53.1	Low	70 Å²	70	106 Å²	106	43%	0.429	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	4.6	-178.5	52.3	0	0	0	0	114.2	F9 L10 I15	F9-T13 HydrophobicContact CD1-CG2 4.41Å; F9-T13 WeakPolarHBondContact O-CG2 3.47Å; F9-T13 PolarHBondContact O-N 2.74Å; F9-T13 VanDerWaalsContact O-N 3.13Å; F9-T13 PolarHBondContact O-OG1 3.28Å; L10-T13 WeakPolarHBondContact CA-OG1 3.29Å; L10-T13 PolarHBondContact O-OG1 2.77Å; T13-I15 WeakPolarHBondContact O-CG1 3.02Å; T13-I15 PolarHBondContact O-N 3.12Å; T13-I15 VanDerWaalsContact O-N 3.12Å; T13-I15 WeakPolarHBondContact OG1-CD1 3.02Å; T13-I15 WeakPolarHBondContact OG1-CG1 3.21Å
14	G	43.3	Very low	53.9	Low	39 Å²	39	103.5 Å²	103.5	40%	0.402	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	6.6	175	0	0	0	0	0	115.1	R12 V16	R12-G14 VanDerWaalsContact C-N 3.34Å; G14-V16 PolarHBondContact O-N 3.28Å; G14-V16 VanDerWaalsContact O-N 3.11Å
15	I	45.8	Very low	54.7	Low	107 Å²	107	99.9 Å²	99.9	55%	0.549	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.5	-172.2	-56.6	177	0	0	0	112.6	T13	T13-I15 WeakPolarHBondContact O-CG1 3.02Å; T13-I15 PolarHBondContact O-N 3.12Å; T13-I15 VanDerWaalsContact O-N 3.12Å; T13-I15 WeakPolarHBondContact OG1-CD1 3.02Å; T13-I15 WeakPolarHBondContact OG1-CG1 3.21Å
16	V	42.2	Very low	54.6	Low	84 Å²	84	101.3 Å²	101.3	51%	0.509	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-5.2	-172.4	-169.8	0	0	0	0	113.7	G14	G14-V16 PolarHBondContact O-N 3.28Å; G14-V16 VanDerWaalsContact O-N 3.11Å
17	Y	45.2	Very low	54.6	Low	140 Å²	140	97.9 Å²	97.9	55%	0.549	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-17.2	-175.3	-76.2	-81.7	0	0	0	114.7
18	S	44.5	Very low	55.4	Low	88 Å²	88	95.4 Å²	95.4	62%	0.615	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.7	-167.4	-11.4	0	0	0	0	115.6
19	N	50.6	Low	56.6	Low	120 Å²	120	91.2 Å²	91.2	64%	0.642	47%	0.473	S	S	*	.	S	Bend	trans	-109.8	-6.8	-170.6	-73	-55.1	0	0	0	115.5
20	L	54.5	Low	57.8	Low	99 Å²	99	86.2 Å²	86.2	52%	0.518	46%	0.456	S	S	.	.	S	Bend	trans	-85.5	-41.7	-178.7	-99.2	79.9	0	0	0	113	R23 Q24	L20-R23 PolarHBondContact O-N 2.92Å; L20-Q24 PolarHBondContact O-N 2.76Å
21	C	62.4	Low	59.5	Low	10 Å²	10	83.3 Å²	83.3	7%	0.068	44%	0.441	C	S	.	.	H	α-helix	trans	-62.1	-40.4	-174.5	-159	0	0	0	0	114.5	R23 Q24 C25 C30 F38	C21-R23 PolarHBondContact O-N 3.23Å; C21-R23 VanDerWaalsContact O-N 3.14Å; C21-Q24 PolarHBondContact O-N 3.42Å; C21-C25 PolarHBondContact O-N 2.84Å; C21-C25 VanDerWaalsContact O-N 3.15Å; C21-C30 HydrophobicContact CB-CB 3.72Å; C21-C30 WeakPolarHBondContact CB-SG 3.4Å; C21-C30 WeakPolarHBondContact SG-CB 3.05Å; C21-C30 CovalentContact SG-SG 1.99Å; C21-C30 PolarHBondContact SG-SG 3.25Å; C21-F38 HydrophobicContact CB-CG 4.45Å; C21-F38 VanDerWaalsContact SG-CB 3.6Å
22	P	59.8	Low	61.1	Low	72 Å²	72	85.1 Å²	85.1	47%	0.468	44%	0.441	S	S	.	.	H	α-helix	trans	-62.6	-21.9	175.2	-20.9	32.5	0	0	0	113.6	L26	P22-L26 WeakPolarHBondContact O-CD1 3.49Å; P22-L26 WeakPolarHBondContact O-CG 3.46Å
23	R	61.3	Low	62.4	Low	212 Å²	212	76.2 Å²	76.2	80%	0.8	41%	0.412	S	S	*	.	H	α-helix	trans	-89.1	-25.5	178	-74.6	-159.8	168.5	-168.2	-2.2	113.7	L20 C21	L20-R23 PolarHBondContact O-N 2.92Å; C21-R23 PolarHBondContact O-N 3.23Å; C21-R23 VanDerWaalsContact O-N 3.14Å
24	Q	66.2	Low	63.5	Low	107 Å²	107	79.5 Å²	79.5	50%	0.5	42%	0.423	S	S	.	.	H	α-helix	trans	-87.9	-20.9	-179.9	-73.3	175.4	-42.9	0	0	112.9	L20 C21 V86	L20-Q24 PolarHBondContact O-N 2.76Å; C21-Q24 PolarHBondContact O-N 3.42Å; Q24-V86 HydrophobicContact CB-CG1 4.11Å
25	C	73.7	Confident	65	Low	9 Å²	9	86.1 Å²	86.1	6%	0.061	44%	0.443	C	S	.	.	S	Bend	trans	-98.9	1.7	-178.9	-60.9	0	0	0	0	115	C21 G28 C40	C21-C25 PolarHBondContact O-N 2.84Å; C21-C25 VanDerWaalsContact O-N 3.15Å; C25-G28 CarbonylContact O-C 3.59Å; C25-G28 VanDerWaalsContact O-C 3.29Å; C25-G28 WeakPolarHBondContact O-CA 3.35Å; C25-G28 PolarHBondContact O-N 3.49Å; C25-G28 VanDerWaalsContact O-O 3.13Å; C25-C40 WeakPolarHBondContact CA-SG 3.41Å; C25-C40 HydrophobicContact CB-CB 3.64Å; C25-C40 WeakPolarHBondContact CB-SG 3.06Å; C25-C40 WeakPolarHBondContact SG-CA 2.99Å; C25-C40 WeakPolarHBondContact SG-CB 3.03Å; C25-C40 CovalentContact SG-SG 2.05Å; C25-C40 PolarHBondContact SG-SG 3.09Å
26	L	66.7	Low	65.9	Low	128 Å²	128	85.3 Å²	85.3	67%	0.67	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	129.7	-178.5	-81.2	150.9	0	0	0	112.3	P22	P22-L26 WeakPolarHBondContact O-CD1 3.49Å; P22-L26 WeakPolarHBondContact O-CG 3.46Å
27	P	63.5	Low	67.5	Low	72 Å²	72	81.8 Å²	81.8	47%	0.468	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.2	6.8	12.4	34.5	-33.6	0	0	0	116.3	A44 I129	P27-A44 VanDerWaalsContact O-CA 3.28Å; P27-A44 WeakPolarHBondContact O-CA 3.17Å; P27-A44 VanDerWaalsContact O-CB 3.25Å; P27-A44 WeakPolarHBondContact O-CB 3.49Å; P27-I129 HydrophobicContact CG-CD1 3.4Å; P27-I129 VanDerWaalsContact CG-CD1 3.4Å; P27-I129 HydrophobicContact CG-CG1 4.02Å
28	G	72.2	Confident	69.2	Low	14 Å²	14	77 Å²	77	14%	0.144	40%	0.4	C	S	.	.	S	Bend	trans	-82.6	176.7	177.4	0	0	0	0	0	116.5	C25 C41	C25-G28 CarbonylContact O-C 3.59Å; C25-G28 VanDerWaalsContact O-C 3.29Å; C25-G28 WeakPolarHBondContact O-CA 3.35Å; C25-G28 PolarHBondContact O-N 3.49Å; C25-G28 VanDerWaalsContact O-O 3.13Å; G28-C41 CarbonylContact C-O 3.52Å; G28-C41 WeakPolarHBondContact CA-O 3.45Å
29	S	80.8	Confident	71.2	Confident	20 Å²	20	75.7 Å²	75.7	14%	0.14	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	150.5	176.6	49.5	0	0	0	0	112.7	C41 Y43 G46	S29-C41 PolarHBondContact N-O 3.31Å; S29-C41 VanDerWaalsContact N-O 3.1Å; S29-C41 WeakPolarHBondContact O-CB 3.31Å; S29-C41 PolarHBondContact O-N 2.96Å; S29-C41 WeakPolarHBondContact OG-CB 3.48Å; S29-Y43 PolarHBondContact N-O 2.66Å; S29-Y43 VanDerWaalsContact N-O 3.13Å; S29-Y43 PolarHBondContact OG-O 3.24Å; S29-G46 WeakPolarHBondContact OG-CA 3.48Å; S29-G46 PolarHBondContact OG-N 2.04Å; S29-G46 PolarHBondContact OG-O 2.89Å
30	C	84.8	Confident	72.9	Confident	40 Å²	40	71 Å²	71	27%	0.27	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.9	173.5	179.6	0	0	0	0	110.3	C21 F38	C21-C30 HydrophobicContact CB-CB 3.72Å; C21-C30 WeakPolarHBondContact CB-SG 3.4Å; C21-C30 WeakPolarHBondContact SG-CB 3.05Å; C21-C30 CovalentContact SG-SG 1.99Å; C21-C30 PolarHBondContact SG-SG 3.25Å; C30-F38 WeakPolarHBondContact SG-CD1 3.38Å
31	C	84.9	Confident	74.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.007	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.5	177.8	-73	0	0	0	0	110.6	F38 R39 C48 M82	C31-F38 CarbonylContact O-C 3.46Å; C31-F38 WeakPolarHBondContact O-CA 3.41Å; C31-R39 PolarHBondContact N-O 3.06Å; C31-R39 PolarHBondContact O-N 3.38Å; C31-C48 WeakPolarHBondContact CA-SG 3.46Å; C31-C48 HydrophobicContact CB-CB 3.66Å; C31-C48 WeakPolarHBondContact CB-SG 3.27Å; C31-C48 VanDerWaalsContact SG-CA 3.58Å; C31-C48 WeakPolarHBondContact SG-CB 3.08Å; C31-C48 CovalentContact SG-SG 2.02Å; C31-C48 PolarHBondContact SG-SG 3.23Å; C31-M82 HydrophobicContact CB-CE 3.03Å
32	E	82.1	Confident	75.4	Confident	122 Å²	122	69 Å²	69	57%	0.57	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.3	172.4	-170.3	171.7	-171.1	0	0	108.8	E34 F38	E32-E34 WeakPolarHBondContact CG-O 3.4Å; E32-F38 HydrophobicContact CB-CD1 4.01Å; E32-F38 HydrophobicContact CB-CE1 3.87Å; E32-F38 HydrophobicContact CG-CD1 4.29Å; E32-F38 HydrophobicContact CG-CE1 3.9Å; E32-F38 HydrophobicContact CG-CZ 4.46Å
33	V	77.7	Confident	76.7	Confident	46 Å²	46	67.8 Å²	67.8	28%	0.279	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-42.3	-179.2	178.1	0	0	0	0	110.8	D37 R39 G52 M82	V33-D37 PolarHBondContact N-O 2.99Å; V33-R39 HydrophobicContact CG2-CB 4.34Å; V33-R39 HydrophobicContact CG2-CG 3.98Å; V33-G52 VanDerWaalsContact CG1-CA 3.42Å; V33-M82 HydrophobicContact CG2-CE 3.98Å
34	E	72.2	Confident	77.4	Confident	139 Å²	139	60.7 Å²	60.7	65%	0.65	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143	169.9	175.2	-67.8	-179.3	172.4	0	0	108.5	E32 N36 D37	E32-E34 WeakPolarHBondContact CG-O 3.4Å; E34-N36 PolarHBondContact O-N 3.47Å; E34-D37 HydrophobicContact CB-CB 3.99Å; E34-D37 PolarHBondContact O-N 3.41Å
35	E	73.3	Confident	78	Confident	178 Å²	178	60.8 Å²	60.8	83%	0.832	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	112.9	177.7	-167.1	176	-172.3	0	0	110.4	D37	E35-D37 VanDerWaalsContact C-N 3.3Å; E35-D37 PolarHBondContact O-N 3.22Å
36	N	65.2	Low	78.5	Confident	91 Å²	91	60.9 Å²	60.9	49%	0.487	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	17.6	-172.7	-52.6	-54.5	0	0	0	116.4	E34	E34-N36 PolarHBondContact O-N 3.47Å
37	D	76.4	Confident	79.5	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	97.1	166.2	-170	18.2	0	0	0	110.6	V33 E34 E35 R39 K85	V33-D37 PolarHBondContact N-O 2.99Å; E34-D37 HydrophobicContact CB-CB 3.99Å; E34-D37 PolarHBondContact O-N 3.41Å; E35-D37 VanDerWaalsContact C-N 3.3Å; E35-D37 PolarHBondContact O-N 3.22Å; D37-R39 IonicContact OD1-NE 3.96Å; D37-R39 IonicContact OD2-CZ 3.71Å; D37-R39 IonicContact OD2-NE 3.4Å; D37-R39 PolarHBondContact OD2-NE 3.04Å; D37-R39 IonicContact OD2-NH2 3.11Å; D37-R39 PolarHBondContact OD2-NH2 2.68Å; D37-R39 VanDerWaalsContact OD2-NH2 3.11Å; D37-K85 WeakPolarHBondContact OD1-CD 2.91Å; D37-K85 VanDerWaalsContact OD1-CE 3.3Å; D37-K85 WeakPolarHBondContact OD1-CE 3.48Å; D37-K85 WeakPolarHBondContact OD1-CG 3.34Å; D37-K85 IonicContact OD1-NZ 3.67Å
38	F	81.1	Confident	80.7	Confident	39 Å²	39	56.6 Å²	56.6	17%	0.171	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138.9	177.4	-62.5	-77	0	0	0	110.9	C21 C30 C31 E32 V86	C21-F38 HydrophobicContact CB-CG 4.45Å; C21-F38 VanDerWaalsContact SG-CB 3.6Å; C30-F38 WeakPolarHBondContact SG-CD1 3.38Å; C31-F38 CarbonylContact O-C 3.46Å; C31-F38 WeakPolarHBondContact O-CA 3.41Å; E32-F38 HydrophobicContact CB-CD1 4.01Å; E32-F38 HydrophobicContact CB-CE1 3.87Å; E32-F38 HydrophobicContact CG-CD1 4.29Å; E32-F38 HydrophobicContact CG-CE1 3.9Å; E32-F38 HydrophobicContact CG-CZ 4.46Å; F38-V86 HydrophobicContact CB-CB 4.15Å; F38-V86 VanDerWaalsContact O-CB 3.32Å; F38-V86 WeakPolarHBondContact O-CB 3.16Å; F38-V86 WeakPolarHBondContact O-CG2 3.35Å; F38-V86 PolarHBondContact O-N 3.02Å
39	R	85.2	Confident	81.5	Confident	62 Å²	62	56.6 Å²	56.6	23%	0.234	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.4	176.2	-61.1	-173	-169.3	-166.6	-4.4	110.2	C31 V33 D37 G52 M82	C31-R39 PolarHBondContact N-O 3.06Å; C31-R39 PolarHBondContact O-N 3.38Å; V33-R39 HydrophobicContact CG2-CB 4.34Å; V33-R39 HydrophobicContact CG2-CG 3.98Å; D37-R39 IonicContact OD1-NE 3.96Å; D37-R39 IonicContact OD2-CZ 3.71Å; D37-R39 IonicContact OD2-NE 3.4Å; D37-R39 PolarHBondContact OD2-NE 3.04Å; D37-R39 IonicContact OD2-NH2 3.11Å; D37-R39 PolarHBondContact OD2-NH2 2.68Å; D37-R39 VanDerWaalsContact OD2-NH2 3.11Å; R39-G52 PolarHBondContact NH1-O 2.78Å; R39-M82 HydrophobicContact CB-CB 4.1Å; R39-M82 HydrophobicContact CB-CE 3.9Å
40	C	87	Confident	81.6	Confident	21 Å²	21	60.9 Å²	60.9	14%	0.142	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.2	179.4	-59.9	0	0	0	0	110.9	C25 M82 S83 V86	C25-C40 WeakPolarHBondContact CA-SG 3.41Å; C25-C40 HydrophobicContact CB-CB 3.64Å; C25-C40 WeakPolarHBondContact CB-SG 3.06Å; C25-C40 WeakPolarHBondContact SG-CA 2.99Å; C25-C40 WeakPolarHBondContact SG-CB 3.03Å; C25-C40 CovalentContact SG-SG 2.05Å; C25-C40 PolarHBondContact SG-SG 3.09Å; C40-M82 WeakPolarHBondContact O-CA 3.46Å; C40-S83 VanDerWaalsContact CB-OG 3.29Å; C40-S83 WeakPolarHBondContact CB-OG 3.35Å; C40-S83 PolarHBondContact N-OG 3.15Å; C40-S83 PolarHBondContact O-N 2.02Å; C40-V86 VanDerWaalsContact SG-CG2 3.5Å
41	C	86.9	Confident	81.5	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	129.9	166.4	177	0	0	0	0	109.7	G28 S29 Y43 C55	G28-C41 CarbonylContact C-O 3.52Å; G28-C41 WeakPolarHBondContact CA-O 3.45Å; S29-C41 PolarHBondContact N-O 3.31Å; S29-C41 VanDerWaalsContact N-O 3.1Å; S29-C41 WeakPolarHBondContact O-CB 3.31Å; S29-C41 PolarHBondContact O-N 2.96Å; S29-C41 WeakPolarHBondContact OG-CB 3.48Å; C41-Y43 PolarHBondContact O-N 3.27Å; C41-C55 WeakPolarHBondContact CA-SG 3.1Å; C41-C55 HydrophobicContact CB-CB 3.64Å; C41-C55 WeakPolarHBondContact CB-SG 3.22Å; C41-C55 WeakPolarHBondContact SG-CB 3.21Å; C41-C55 CovalentContact SG-SG 2.02Å; C41-C55 PolarHBondContact SG-SG 2.72Å
42	P	82.7	Confident	81.1	Confident	66 Å²	66	61.6 Å²	61.6	43%	0.429	34%	0.34	S	S	.	.	S	Bend	trans	-67	-16	-179	-20.5	33.2	0	0	0	114.6	C55 K80	P42-C55 WeakPolarHBondContact CD-SG 3.22Å; P42-K80 HydrophobicContact CB-CD 3.91Å; P42-K80 HydrophobicContact CG-CB 4.04Å; P42-K80 HydrophobicContact CG-CD 4.12Å
43	Y	86.1	Confident	81.1	Confident	46 Å²	46	61.6 Å²	61.6	18%	0.18	34%	0.338	C	S	.	.	S	Bend	trans	-83.9	128	178.2	-64.2	-65.7	0	0	0	110.4	S29 C41 N45 G46 C56 P57 L78 K80	S29-Y43 PolarHBondContact N-O 2.66Å; S29-Y43 VanDerWaalsContact N-O 3.13Å; S29-Y43 PolarHBondContact OG-O 3.24Å; C41-Y43 PolarHBondContact O-N 3.27Å; Y43-N45 PolarHBondContact O-N 2.9Å; Y43-G46 PolarHBondContact O-N 3.39Å; Y43-C56 VanDerWaalsContact CD2-C 3.5Å; Y43-P57 HydrophobicContact CD1-CB 3.92Å; Y43-P57 HydrophobicContact CD2-CB 4.39Å; Y43-P57 HydrophobicContact CE1-CB 4.01Å; Y43-P57 HydrophobicContact CE1-CG 4.44Å; Y43-P57 HydrophobicContact CE2-CB 4.46Å; Y43-P57 HydrophobicContact CG-CB 4.11Å; Y43-L78 PolarHBondContact OH-O 2.93Å; Y43-K80 HydrophobicContact CD2-CD 4.46Å; Y43-K80 HydrophobicContact CE1-CD 3.96Å; Y43-K80 HydrophobicContact CE2-CB 3.84Å; Y43-K80 HydrophobicContact CE2-CD 3.83Å; Y43-K80 HydrophobicContact CE2-CG 3.74Å; Y43-K80 WeakPolarHBondContact OH-CG 3.41Å
44	A	77.2	Confident	81.5	Confident	63 Å²	63	61.1 Å²	61.1	52%	0.521	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	122.3	165.1	0	0	0	0	0	108.7	P27 G46	P27-A44 VanDerWaalsContact O-CA 3.28Å; P27-A44 WeakPolarHBondContact O-CA 3.17Å; P27-A44 VanDerWaalsContact O-CB 3.25Å; P27-A44 WeakPolarHBondContact O-CB 3.49Å; A44-G46 PolarHBondContact O-N 2.75Å
45	N	77.2	Confident	82.4	Confident	110 Å²	110	54.5 Å²	54.5	59%	0.588	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	32.9	-173.1	-52.5	-36.2	0	0	0	114.6	Y43 Q58	Y43-N45 PolarHBondContact O-N 2.9Å; N45-Q58 HydrophobicContact CB-CB 4.29Å; N45-Q58 HydrophobicContact CB-CG 4.21Å; N45-Q58 PolarHBondContact ND2-OE1 2.93Å; N45-Q58 WeakPolarHBondContact O-CB 3.49Å
46	G	85	Confident	83.3	Confident	10 Å²	10	46 Å²	46	10%	0.103	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-62.3	148.3	175.7	0	0	0	0	0	113.9	S29 Y43 A44 C56	S29-G46 WeakPolarHBondContact OG-CA 3.48Å; S29-G46 PolarHBondContact OG-N 2.04Å; S29-G46 PolarHBondContact OG-O 2.89Å; Y43-G46 PolarHBondContact O-N 3.39Å; A44-G46 PolarHBondContact O-N 2.75Å; G46-C56 CarbonylContact C-O 3.53Å; G46-C56 WeakPolarHBondContact CA-O 3.35Å
47	V	88.6	Confident	84.3	Confident	55 Å²	55	42.8 Å²	42.8	33%	0.333	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120	175.5	-179.1	0	0	0	0	109	C55 C56	V47-C55 CarbonylContact O-C 3.46Å; V47-C55 WeakPolarHBondContact O-CA 3.43Å; V47-C55 WeakPolarHBondContact O-CB 3.15Å; V47-C56 HydrophobicContact CB-CB 4.27Å; V47-C56 PolarHBondContact N-O 2.02Å; V47-C56 PolarHBondContact O-N 2.85Å
48	C	88.7	Confident	84.8	Confident	56 Å²	56	48.9 Å²	48.9	38%	0.378	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.5	179.8	-47.7	0	0	0	0	110.4	C31	C31-C48 WeakPolarHBondContact CA-SG 3.46Å; C31-C48 HydrophobicContact CB-CB 3.66Å; C31-C48 WeakPolarHBondContact CB-SG 3.27Å; C31-C48 VanDerWaalsContact SG-CA 3.58Å; C31-C48 WeakPolarHBondContact SG-CB 3.08Å; C31-C48 CovalentContact SG-SG 2.02Å; C31-C48 PolarHBondContact SG-SG 3.23Å
49	C	88.7	Confident	84.9	Confident	13 Å²	13	49.8 Å²	49.8	9%	0.088	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-81.6	149.8	174.1	-55.8	0	0	0	0	110.6	D51 G52 N54 C62	C49-D51 PolarHBondContact O-N 2.66Å; C49-D51 VanDerWaalsContact O-N 3.17Å; C49-G52 PolarHBondContact O-N 3.35Å; C49-N54 HydrophobicContact CB-CB 4.34Å; C49-N54 WeakPolarHBondContact CB-O 3.45Å; C49-N54 PolarHBondContact N-O 3Å; C49-N54 PolarHBondContact SG-O 3.03Å; C49-C62 WeakPolarHBondContact CA-SG 3.01Å; C49-C62 HydrophobicContact CB-CB 3.74Å; C49-C62 WeakPolarHBondContact CB-SG 3.45Å; C49-C62 WeakPolarHBondContact SG-CB 3.33Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 2.82Å
50	S	83.3	Confident	85	Confident	110 Å²	110	47.3 Å²	47.3	77%	0.769	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-7	-178.5	16.4	0	0	0	0	114	G52	S50-G52 VanDerWaalsContact C-N 3.29Å
51	D	81.8	Confident	85	Confident	53 Å²	53	54.2 Å²	54.2	28%	0.283	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.6	174.9	65.6	6.9	0	0	0	113.7	C49 K53 N54 M64	C49-D51 PolarHBondContact O-N 2.66Å; C49-D51 VanDerWaalsContact O-N 3.17Å; D51-K53 PolarHBondContact O-N 2.98Å; D51-K53 VanDerWaalsContact O-N 3.13Å; D51-K53 PolarHBondContact OD1-N 3.28Å; D51-N54 PolarHBondContact OD1-N 3.32Å; D51-N54 WeakPolarHBondContact OD2-CB 3.2Å; D51-N54 PolarHBondContact OD2-ND2 2.85Å; D51-M64 HydrophobicContact CB-CE 3.83Å; D51-M64 HydrophobicContact CB-SD 4.07Å
52	G	77.2	Confident	85	Confident	4 Å²	4	55.9 Å²	55.9	4%	0.041	33%	0.326	C	S	.	.	S	Bend	trans	67.6	7	-179	0	0	0	0	0	115.3	V33 R39 C49 S50 M82	V33-G52 VanDerWaalsContact CG1-CA 3.42Å; R39-G52 PolarHBondContact NH1-O 2.78Å; C49-G52 PolarHBondContact O-N 3.35Å; S50-G52 VanDerWaalsContact C-N 3.29Å; G52-M82 VanDerWaalsContact C-SD 3.52Å
53	K	82	Confident	85.2	Confident	122 Å²	122	53.8 Å²	53.8	53%	0.53	31%	0.311	S	S	.	.	S	Bend	trans	-118.6	-30.7	-175.5	-67.9	178.2	-175.6	177.4	0	111.6	D51 H81 M82	D51-K53 PolarHBondContact O-N 2.98Å; D51-K53 VanDerWaalsContact O-N 3.13Å; D51-K53 PolarHBondContact OD1-N 3.28Å; K53-H81 CarbonylContact O-C 3.54Å; K53-H81 WeakPolarHBondContact O-CA 3Å; K53-M82 VanDerWaalsContact C-SD 3.57Å; K53-M82 WeakPolarHBondContact O-CG 2.94Å; K53-M82 PolarHBondContact O-N 3.07Å
54	N	86.6	Confident	84.4	Confident	36 Å²	36	56.7 Å²	56.7	19%	0.193	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.8	-172.7	-66.5	-47.8	0	0	0	111.8	C49 D51 K80 M82	C49-N54 HydrophobicContact CB-CB 4.34Å; C49-N54 WeakPolarHBondContact CB-O 3.45Å; C49-N54 PolarHBondContact N-O 3Å; C49-N54 PolarHBondContact SG-O 3.03Å; D51-N54 PolarHBondContact OD1-N 3.32Å; D51-N54 WeakPolarHBondContact OD2-CB 3.2Å; D51-N54 PolarHBondContact OD2-ND2 2.85Å; N54-K80 WeakPolarHBondContact CA-O 3.45Å; N54-M82 VanDerWaalsContact O-SD 3.36Å
55	C	91.2	Very high	84.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.8	167.5	73.4	0	0	0	0	111.3	C41 P42 V47 K80 M82	C41-C55 WeakPolarHBondContact CA-SG 3.1Å; C41-C55 HydrophobicContact CB-CB 3.64Å; C41-C55 WeakPolarHBondContact CB-SG 3.22Å; C41-C55 WeakPolarHBondContact SG-CB 3.21Å; C41-C55 CovalentContact SG-SG 2.02Å; C41-C55 PolarHBondContact SG-SG 2.72Å; P42-C55 WeakPolarHBondContact CD-SG 3.22Å; V47-C55 CarbonylContact O-C 3.46Å; V47-C55 WeakPolarHBondContact O-CA 3.43Å; V47-C55 WeakPolarHBondContact O-CB 3.15Å; C55-K80 PolarHBondContact N-O 3.07Å; C55-K80 PolarHBondContact O-N 2.97Å; C55-M82 HydrophobicContact CB-CG 4.12Å
56	C	91	Very high	83.7	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.2	-175	-76.8	0	0	0	0	111.2	Y43 G46 V47 T60 C69	Y43-C56 VanDerWaalsContact CD2-C 3.5Å; G46-C56 CarbonylContact C-O 3.53Å; G46-C56 WeakPolarHBondContact CA-O 3.35Å; V47-C56 HydrophobicContact CB-CB 4.27Å; V47-C56 PolarHBondContact N-O 2.02Å; V47-C56 PolarHBondContact O-N 2.85Å; C56-T60 WeakPolarHBondContact CB-OG1 3.15Å; C56-C69 WeakPolarHBondContact CA-SG 3.49Å; C56-C69 HydrophobicContact CB-CB 3.75Å; C56-C69 WeakPolarHBondContact CB-SG 3.48Å; C56-C69 WeakPolarHBondContact SG-CB 3.43Å; C56-C69 CovalentContact SG-SG 2.02Å; C56-C69 PolarHBondContact SG-SG 3.38Å
57	P	87.1	Confident	83	Confident	23 Å²	23	63.3 Å²	63.3	15%	0.149	36%	0.355	C	S	.	.			trans	-65.7	155.6	175	26	-31.7	0	0	0	111.7	Y43 G59 T60 L77	Y43-P57 HydrophobicContact CD1-CB 3.92Å; Y43-P57 HydrophobicContact CD2-CB 4.39Å; Y43-P57 HydrophobicContact CE1-CB 4.01Å; Y43-P57 HydrophobicContact CE1-CG 4.44Å; Y43-P57 HydrophobicContact CE2-CB 4.46Å; Y43-P57 HydrophobicContact CG-CB 4.11Å; P57-G59 PolarHBondContact O-N 2.78Å; P57-T60 WeakPolarHBondContact CD-OG1 3.34Å; P57-T60 HydrophobicContact CG-CG2 4.21Å; P57-T60 PolarHBondContact O-N 3.46Å; P57-T60 PolarHBondContact O-OG1 3.18Å; P57-L77 HydrophobicContact CG-CB 4.47Å; P57-L77 HydrophobicContact CG-CD1 3.64Å
58	Q	86.1	Confident	82.8	Confident	136 Å²	136	63.8 Å²	63.8	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	130.3	177.6	-168.7	177.7	3.3	0	0	111.1	N45	N45-Q58 HydrophobicContact CB-CB 4.29Å; N45-Q58 HydrophobicContact CB-CG 4.21Å; N45-Q58 PolarHBondContact ND2-OE1 2.93Å; N45-Q58 WeakPolarHBondContact O-CB 3.49Å
59	G	83	Confident	82.7	Confident	58 Å²	58	61.1 Å²	61.1	60%	0.598	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	6.2	178.2	0	0	0	0	0	115.9	P57	P57-G59 PolarHBondContact O-N 2.78Å
60	T	88.6	Confident	82.6	Confident	10 Å²	10	66.8 Å²	66.8	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	156.1	174.6	59.8	0	0	0	0	112.9	C56 P57 C69 R70 L77	C56-T60 WeakPolarHBondContact CB-OG1 3.15Å; P57-T60 WeakPolarHBondContact CD-OG1 3.34Å; P57-T60 HydrophobicContact CG-CG2 4.21Å; P57-T60 PolarHBondContact O-N 3.46Å; P57-T60 PolarHBondContact O-OG1 3.18Å; T60-C69 HydrophobicContact CG2-CB 4.49Å; T60-R70 CarbonylContact C-O 3.48Å; T60-R70 VanDerWaalsContact CA-O 3.31Å; T60-R70 WeakPolarHBondContact CA-O 3.48Å; T60-R70 WeakPolarHBondContact CB-O 3.38Å; T60-L77 HydrophobicContact CG2-CD1 3.83Å
61	K	86.5	Confident	82.5	Confident	167 Å²	167	63 Å²	63	73%	0.726	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.4	174.1	-74.1	-175	177.4	-178.6	0	110.4	D63 C69 R70	K61-D63 PolarHBondContact O-N 2.89Å; K61-C69 CarbonylContact O-C 3.54Å; K61-C69 WeakPolarHBondContact O-CA 3.08Å; K61-R70 PolarHBondContact N-O 3.19Å; K61-R70 PolarHBondContact O-N 2.8Å
62	C	87.6	Confident	82.2	Confident	36 Å²	36	66.4 Å²	66.4	24%	0.243	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	126.1	173.9	-58.5	0	0	0	0	110.7	C49	C49-C62 WeakPolarHBondContact CA-SG 3.01Å; C49-C62 HydrophobicContact CB-CB 3.74Å; C49-C62 WeakPolarHBondContact CB-SG 3.45Å; C49-C62 WeakPolarHBondContact SG-CB 3.33Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 2.82Å
63	D	85.1	Confident	82.3	Confident	22 Å²	22	72.1 Å²	72.1	12%	0.118	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	99.4	169.7	-171.6	-21.2	0	0	0	108.5	K61 E65 L66 G67 Q68 R70	K61-D63 PolarHBondContact O-N 2.89Å; D63-E65 VanDerWaalsContact C-N 3.27Å; D63-E65 PolarHBondContact O-N 3.38Å; D63-E65 PolarHBondContact OD1-N 2.93Å; D63-L66 PolarHBondContact O-N 2.85Å; D63-G67 PolarHBondContact O-N 2.99Å; D63-Q68 WeakPolarHBondContact CA-O 3.02Å; D63-Q68 HydrophobicContact CB-CB 4.47Å; D63-Q68 WeakPolarHBondContact CB-O 3.46Å; D63-Q68 PolarHBondContact N-O 2.95Å; D63-Q68 PolarHBondContact O-N 3.31Å; D63-R70 HydrophobicContact CB-CG 4.46Å; D63-R70 IonicContact OD2-CZ 3.09Å; D63-R70 IonicContact OD2-NE 2.78Å; D63-R70 PolarHBondContact OD2-NE 3Å; D63-R70 IonicContact OD2-NH2 2.68Å; D63-R70 PolarHBondContact OD2-NH2 3.27Å
64	M	69.7	Low	82	Confident	107 Å²	107	69 Å²	69	53%	0.527	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-22.3	-174.3	-63.2	-80.3	-72.3	0	0	112.7	D51	D51-M64 HydrophobicContact CB-CE 3.83Å; D51-M64 HydrophobicContact CB-SD 4.07Å
65	E	71.6	Confident	81.5	Confident	183 Å²	183	69.4 Å²	69.4	86%	0.855	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-30.5	-179.4	-67.7	-173.4	163.6	0	0	111.9	D63	D63-E65 VanDerWaalsContact C-N 3.27Å; D63-E65 PolarHBondContact O-N 3.38Å; D63-E65 PolarHBondContact OD1-N 2.93Å
66	L	68.6	Low	81.1	Confident	100 Å²	100	73.2 Å²	73.2	52%	0.524	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-6.3	-174.9	-65.2	172.8	0	0	0	113.9	D63 Q68	D63-L66 PolarHBondContact O-N 2.85Å; L66-Q68 HydrophobicContact CB-CB 4.19Å; L66-Q68 HydrophobicContact CB-CG 4.1Å; L66-Q68 WeakPolarHBondContact O-CG 3.4Å; L66-Q68 PolarHBondContact O-N 2.94Å
67	G	70.7	Confident	80.3	Confident	38 Å²	38	76.8 Å²	76.8	39%	0.392	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	26.8	-174.9	0	0	0	0	0	113	D63 S79	D63-G67 PolarHBondContact O-N 2.99Å; G67-S79 PolarHBondContact O-OG 2.93Å
68	Q	82.9	Confident	79.7	Confident	66 Å²	66	82.7 Å²	82.7	31%	0.308	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	163.3	-168.8	-75.7	171.9	8.8	0	0	111.7	D63 L66 V76	D63-Q68 WeakPolarHBondContact CA-O 3.02Å; D63-Q68 HydrophobicContact CB-CB 4.47Å; D63-Q68 WeakPolarHBondContact CB-O 3.46Å; D63-Q68 PolarHBondContact N-O 2.95Å; D63-Q68 PolarHBondContact O-N 3.31Å; L66-Q68 HydrophobicContact CB-CB 4.19Å; L66-Q68 HydrophobicContact CB-CG 4.1Å; L66-Q68 WeakPolarHBondContact O-CG 3.4Å; L66-Q68 PolarHBondContact O-N 2.94Å; Q68-V76 HydrophobicContact CB-CG1 3.93Å; Q68-V76 VanDerWaalsContact CD-CG1 3.41Å; Q68-V76 HydrophobicContact CG-CG1 3.77Å
69	C	87.9	Confident	79.4	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.1	175	-53.8	0	0	0	0	109.1	C56 T60 K61 V76 L77	C56-C69 WeakPolarHBondContact CA-SG 3.49Å; C56-C69 HydrophobicContact CB-CB 3.75Å; C56-C69 WeakPolarHBondContact CB-SG 3.48Å; C56-C69 WeakPolarHBondContact SG-CB 3.43Å; C56-C69 CovalentContact SG-SG 2.02Å; C56-C69 PolarHBondContact SG-SG 3.38Å; T60-C69 HydrophobicContact CG2-CB 4.49Å; K61-C69 CarbonylContact O-C 3.54Å; K61-C69 WeakPolarHBondContact O-CA 3.08Å; C69-V76 WeakPolarHBondContact O-CA 3.37Å; C69-L77 HydrophobicContact CB-CB 4.11Å; C69-L77 WeakPolarHBondContact CB-O 3.39Å; C69-L77 PolarHBondContact N-O 3.3Å; C69-L77 PolarHBondContact O-N 2.71Å
70	R	85.7	Confident	79.3	Confident	131 Å²	131	79.2 Å²	79.2	49%	0.494	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.6	176.1	-68.9	-170.8	-162.6	-172.6	5.5	111.3	T60 K61 D63	T60-R70 CarbonylContact C-O 3.48Å; T60-R70 VanDerWaalsContact CA-O 3.31Å; T60-R70 WeakPolarHBondContact CA-O 3.48Å; T60-R70 WeakPolarHBondContact CB-O 3.38Å; K61-R70 PolarHBondContact N-O 3.19Å; K61-R70 PolarHBondContact O-N 2.8Å; D63-R70 HydrophobicContact CB-CG 4.46Å; D63-R70 IonicContact OD2-CZ 3.09Å; D63-R70 IonicContact OD2-NE 2.78Å; D63-R70 PolarHBondContact OD2-NE 3Å; D63-R70 IonicContact OD2-NH2 2.68Å; D63-R70 PolarHBondContact OD2-NH2 3.27Å
71	S	82.5	Confident	79.1	Confident	30 Å²	30	85 Å²	85	21%	0.21	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	164.6	170.8	179.6	0	0	0	0	111.8	N73 G74 A75	S71-N73 WeakPolarHBondContact CB-OD1 3.41Å; S71-N73 PolarHBondContact O-N 3.47Å; S71-N73 PolarHBondContact OG-OD1 2.99Å; S71-G74 PolarHBondContact O-N 3.04Å; S71-A75 PolarHBondContact N-O 3.04Å
72	S	75.3	Confident	78.6	Confident	126 Å²	126	77.2 Å²	77.2	88%	0.881	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	176.6	55.2	0	0	0	0	113.9
73	N	78.1	Confident	77.9	Confident	123 Å²	123	77.8 Å²	77.8	66%	0.658	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	9	176.2	64.2	-1.4	0	0	0	113.7	S71 A75	S71-N73 WeakPolarHBondContact CB-OD1 3.41Å; S71-N73 PolarHBondContact O-N 3.47Å; S71-N73 PolarHBondContact OG-OD1 2.99Å; N73-A75 VanDerWaalsContact C-N 3.25Å; N73-A75 PolarHBondContact O-N 2.85Å; N73-A75 WeakPolarHBondContact OD1-CB 3.42Å; N73-A75 PolarHBondContact OD1-N 3.12Å
74	G	75.5	Confident	77	Confident	58 Å²	58	85.3 Å²	85.3	60%	0.598	47%	0.469	S	S	*	.	S	Bend	trans	77.8	2.3	-177.3	0	0	0	0	0	114.8	S71 V76	S71-G74 PolarHBondContact O-N 3.04Å; G74-V76 PolarHBondContact O-N 3.48Å
75	A	77.9	Confident	77	Confident	43 Å²	43	85.7 Å²	85.7	36%	0.355	47%	0.468	S	S	.	.			trans	-66.9	133.7	174.5	0	0	0	0	0	110.9	S71 N73	S71-A75 PolarHBondContact N-O 3.04Å; N73-A75 VanDerWaalsContact C-N 3.25Å; N73-A75 PolarHBondContact O-N 2.85Å; N73-A75 WeakPolarHBondContact OD1-CB 3.42Å; N73-A75 PolarHBondContact OD1-N 3.12Å
76	V	81.7	Confident	76.6	Confident	80 Å²	80	77.9 Å²	77.9	49%	0.485	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.6	175.9	175.8	0	0	0	0	108.5	Q68 C69 G74	Q68-V76 HydrophobicContact CB-CG1 3.93Å; Q68-V76 VanDerWaalsContact CD-CG1 3.41Å; Q68-V76 HydrophobicContact CG-CG1 3.77Å; C69-V76 WeakPolarHBondContact O-CA 3.37Å; G74-V76 PolarHBondContact O-N 3.48Å
77	L	75.2	Confident	76	Confident	76 Å²	76	78.8 Å²	78.8	40%	0.398	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	150.5	174.8	-63.1	174.9	0	0	0	109.9	P57 T60 C69	P57-L77 HydrophobicContact CG-CB 4.47Å; P57-L77 HydrophobicContact CG-CD1 3.64Å; T60-L77 HydrophobicContact CG2-CD1 3.83Å; C69-L77 HydrophobicContact CB-CB 4.11Å; C69-L77 WeakPolarHBondContact CB-O 3.39Å; C69-L77 PolarHBondContact N-O 3.3Å; C69-L77 PolarHBondContact O-N 2.71Å
78	L	74.4	Confident	74.6	Confident	147 Å²	147	79.2 Å²	79.2	77%	0.77	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	133.4	174.3	-85.5	96.2	0	0	0	111	Y43	Y43-L78 PolarHBondContact OH-O 2.93Å
79	S	79.6	Confident	72.3	Confident	26 Å²	26	82.1 Å²	82.1	18%	0.182	46%	0.458	C	S	.	.			trans	-67.2	151.7	164.4	64.1	0	0	0	0	110.3	G67	G67-S79 PolarHBondContact O-OG 2.93Å
80	K	81.2	Confident	69.6	Low	95 Å²	95	90.2 Å²	90.2	41%	0.413	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.8	172.4	-76.6	-175.8	-178.1	-171.7	0	110	P42 Y43 N54 C55	P42-K80 HydrophobicContact CB-CD 3.91Å; P42-K80 HydrophobicContact CG-CB 4.04Å; P42-K80 HydrophobicContact CG-CD 4.12Å; Y43-K80 HydrophobicContact CD2-CD 4.46Å; Y43-K80 HydrophobicContact CE1-CD 3.96Å; Y43-K80 HydrophobicContact CE2-CB 3.84Å; Y43-K80 HydrophobicContact CE2-CD 3.83Å; Y43-K80 HydrophobicContact CE2-CG 3.74Å; Y43-K80 WeakPolarHBondContact OH-CG 3.41Å; N54-K80 WeakPolarHBondContact CA-O 3.45Å; C55-K80 PolarHBondContact N-O 3.07Å; C55-K80 PolarHBondContact O-N 2.97Å
81	H	83.1	Confident	67.1	Low	131 Å²	131	93.6 Å²	93.6	61%	0.606	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.7	174.2	-159	-80.2	0	0	0	110.1	K53	K53-H81 CarbonylContact O-C 3.54Å; K53-H81 WeakPolarHBondContact O-CA 3Å
82	M	77.2	Confident	64.7	Low	4 Å²	4	96.5 Å²	96.5	2%	0.02	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-73.5	151.6	175.1	-58.1	166	82.1	0	0	109.7	C31 V33 R39 C40 G52 K53 N54 C55	C31-M82 HydrophobicContact CB-CE 3.03Å; V33-M82 HydrophobicContact CG2-CE 3.98Å; R39-M82 HydrophobicContact CB-CB 4.1Å; R39-M82 HydrophobicContact CB-CE 3.9Å; C40-M82 WeakPolarHBondContact O-CA 3.46Å; G52-M82 VanDerWaalsContact C-SD 3.52Å; K53-M82 VanDerWaalsContact C-SD 3.57Å; K53-M82 WeakPolarHBondContact O-CG 2.94Å; K53-M82 PolarHBondContact O-N 3.07Å; N54-M82 VanDerWaalsContact O-SD 3.36Å; C55-M82 HydrophobicContact CB-CG 4.12Å
83	S	72.4	Confident	62.9	Low	47 Å²	47	93.6 Å²	93.6	33%	0.329	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-63.5	169.5	177.9	74	0	0	0	0	112.5	C40	C40-S83 VanDerWaalsContact CB-OG 3.29Å; C40-S83 WeakPolarHBondContact CB-OG 3.35Å; C40-S83 PolarHBondContact N-OG 3.15Å; C40-S83 PolarHBondContact O-N 2.02Å
84	E	65.4	Low	61	Low	180 Å²	180	91.6 Å²	91.6	84%	0.841	52%	0.516	S	S	*	.	S	Bend	trans	-56.7	157	162.6	-67.5	-177.3	169.6	0	0	111.5	V86	E84-V86 PolarHBondContact O-N 2.01Å
85	K	70.1	Confident	59.2	Low	116 Å²	116	92.6 Å²	92.6	50%	0.504	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-48.3	124.5	-178.7	176.6	163.2	-167.3	164.8	0	112.1	D37 I87	D37-K85 WeakPolarHBondContact OD1-CD 2.91Å; D37-K85 VanDerWaalsContact OD1-CE 3.3Å; D37-K85 WeakPolarHBondContact OD1-CE 3.48Å; D37-K85 WeakPolarHBondContact OD1-CG 3.34Å; D37-K85 IonicContact OD1-NZ 3.67Å; K85-I87 PolarHBondContact O-N 2.94Å
86	V	63.7	Low	57.2	Low	18 Å²	18	94.1 Å²	94.1	11%	0.109	51%	0.509	C	S	.	.	B	Isolated β-bridge	trans	-75.3	107	172	-175.9	0	0	0	0	107.4	Q24 F38 C40 E84 G88	Q24-V86 HydrophobicContact CB-CG1 4.11Å; F38-V86 HydrophobicContact CB-CB 4.15Å; F38-V86 VanDerWaalsContact O-CB 3.32Å; F38-V86 WeakPolarHBondContact O-CB 3.16Å; F38-V86 WeakPolarHBondContact O-CG2 3.35Å; F38-V86 PolarHBondContact O-N 3.02Å; C40-V86 VanDerWaalsContact SG-CG2 3.5Å; E84-V86 PolarHBondContact O-N 2.01Å; V86-G88 PolarHBondContact O-N 2.8Å; V86-G88 VanDerWaalsContact O-N 3.16Å
87	I	55.5	Low	55.2	Low	120 Å²	120	94.1 Å²	94.1	62%	0.615	51%	0.509	S	S	*	.			trans	-66	113.6	-172.9	-61.5	169.8	0	0	0	110.5	K85 D89	K85-I87 PolarHBondContact O-N 2.94Å; I87-D89 VanDerWaalsContact C-N 3.33Å; I87-D89 HydrophobicContact CG2-CB 3.93Å
88	G	41.7	Very low	53.5	Low	46 Å²	46	93.6 Å²	93.6	47%	0.474	51%	0.509	S	S	.	.			trans	-83.8	9.2	174.2	0	0	0	0	0	115.6	V86	V86-G88 PolarHBondContact O-N 2.8Å; V86-G88 VanDerWaalsContact O-N 3.16Å
89	D	33.9	Very low	51.8	Low	127 Å²	127	91 Å²	91	68%	0.679	50%	0.496	S	S	*	.			trans	-89.6	113.5	-172.7	-92.9	-39.5	0	0	0	114.6	I87 K91	I87-D89 VanDerWaalsContact C-N 3.33Å; I87-D89 HydrophobicContact CG2-CB 3.93Å; D89-K91 PolarHBondContact O-N 3.03Å
90	L	31.3	Very low	49.8	Very low	171 Å²	171	98.3 Å²	98.3	90%	0.895	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	61.6	169.5	-153.6	84.4	0	0	0	111.3
91	K	34.5	Very low	48	Very low	201 Å²	201	101.1 Å²	101.1	87%	0.874	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	-1.8	167.4	-102.5	-174.5	-174.5	175.2	0	115.6	D89 S93	D89-K91 PolarHBondContact O-N 3.03Å; K91-S93 PolarHBondContact O-N 2.84Å
92	T	32	Very low	46	Very low	91 Å²	91	101.2 Å²	101.2	56%	0.558	53%	0.531	S	S	*	.	S	Bend	trans	-92	101.4	166.7	49.1	0	0	0	0	108.3
93	S	35.7	Very low	44.3	Very low	66 Å²	66	103.1 Å²	103.1	46%	0.462	55%	0.545	S	S	.	.			trans	-52.7	152.7	175.2	70.8	0	0	0	0	110.1	K91 L95 D96	K91-S93 PolarHBondContact O-N 2.84Å; S93-L95 CarbonylContact O-C 3.49Å; S93-L95 PolarHBondContact O-N 2.02Å; S93-L95 WeakPolarHBondContact OG-CB 3.07Å; S93-L95 PolarHBondContact OG-N 3.49Å; S93-D96 PolarHBondContact O-N 3.07Å
94	A	39.1	Very low	43.2	Very low	81 Å²	81	105.1 Å²	105.1	67%	0.669	57%	0.565	S	S	*	*	H	α-helix	trans	-49.2	-13	166.4	0	0	0	0	0	113	V98	A94-V98 WeakPolarHBondContact O-CB 3.32Å; A94-V98 WeakPolarHBondContact O-CG2 3.45Å; A94-V98 PolarHBondContact O-N 2.88Å
95	L	38.1	Very low	43.1	Very low	78 Å²	78	101.2 Å²	101.2	41%	0.408	55%	0.55	S	S	.	.	H	α-helix	trans	-67.7	-28.8	169	-140.8	81.3	0	0	0	114.2	S93 V98 L99	S93-L95 CarbonylContact O-C 3.49Å; S93-L95 PolarHBondContact O-N 2.02Å; S93-L95 WeakPolarHBondContact OG-CB 3.07Å; S93-L95 PolarHBondContact OG-N 3.49Å; L95-V98 CarbonylContact O-C 3.59Å; L95-V98 PolarHBondContact O-N 2.94Å; L95-L99 HydrophobicContact CB-CD1 4.32Å; L95-L99 HydrophobicContact CD2-CD1 3.76Å; L95-L99 HydrophobicContact CG-CD1 3.82Å; L95-L99 WeakPolarHBondContact O-CA 3.42Å; L95-L99 WeakPolarHBondContact O-CB 2.89Å; L95-L99 VanDerWaalsContact O-CD1 3.3Å; L95-L99 WeakPolarHBondContact O-CD1 3.5Å; L95-L99 WeakPolarHBondContact O-CG 2.98Å; L95-L99 PolarHBondContact O-N 3.13Å
96	D	36.2	Very low	43	Very low	75 Å²	75	100.2 Å²	100.2	40%	0.401	54%	0.543	S	S	.	.	H	α-helix	trans	-79	-35	178	-89.1	-38.2	0	0	0	112.5	S93 L99 R100	S93-D96 PolarHBondContact O-N 3.07Å; D96-L99 PolarHBondContact O-N 3.3Å; D96-R100 WeakPolarHBondContact O-CB 3.02Å; D96-R100 VanDerWaalsContact O-CG 3.31Å; D96-R100 WeakPolarHBondContact O-CG 3.13Å; D96-R100 PolarHBondContact O-N 3.26Å
97	V	39.6	Very low	43.6	Very low	81 Å²	81	102.6 Å²	102.6	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-69.9	-27.9	168.5	179	0	0	0	0	110.4	R101	V97-R101 VanDerWaalsContact O-CB 3.31Å; V97-R101 WeakPolarHBondContact O-CB 3.5Å; V97-R101 VanDerWaalsContact O-CD 3.23Å; V97-R101 WeakPolarHBondContact O-CD 2.99Å; V97-R101 WeakPolarHBondContact O-CG 3.19Å; V97-R101 PolarHBondContact O-N 3.32Å
98	V	38.9	Very low	44.8	Very low	64 Å²	64	101.4 Å²	101.4	39%	0.388	55%	0.548	S	S	.	.	H	α-helix	trans	-85.6	-27.3	174.4	170.5	0	0	0	0	112.5	A94 L95 R101 L102	A94-V98 WeakPolarHBondContact O-CB 3.32Å; A94-V98 WeakPolarHBondContact O-CG2 3.45Å; A94-V98 PolarHBondContact O-N 2.88Å; L95-V98 CarbonylContact O-C 3.59Å; L95-V98 PolarHBondContact O-N 2.94Å; V98-R101 CarbonylContact O-C 3.42Å; V98-R101 VanDerWaalsContact O-C 3.3Å; V98-R101 WeakPolarHBondContact O-CA 3.02Å; V98-R101 PolarHBondContact O-N 2.74Å; V98-L102 HydrophobicContact CG1-CD1 3.7Å; V98-L102 HydrophobicContact CG1-CG 4.28Å; V98-L102 VanDerWaalsContact O-CB 3.32Å; V98-L102 WeakPolarHBondContact O-CB 2.99Å; V98-L102 WeakPolarHBondContact O-CD1 3.45Å; V98-L102 WeakPolarHBondContact O-CG 3.48Å; V98-L102 PolarHBondContact O-N 3.17Å
99	L	38.5	Very low	46.8	Very low	94 Å²	94	99.4 Å²	99.4	49%	0.492	53%	0.526	S	S	.	.	H	α-helix	trans	-79.2	-35.9	175.8	-95.9	143.4	0	0	0	111	L95 D96 R101 L102 S103	L95-L99 HydrophobicContact CB-CD1 4.32Å; L95-L99 HydrophobicContact CD2-CD1 3.76Å; L95-L99 HydrophobicContact CG-CD1 3.82Å; L95-L99 WeakPolarHBondContact O-CA 3.42Å; L95-L99 WeakPolarHBondContact O-CB 2.89Å; L95-L99 VanDerWaalsContact O-CD1 3.3Å; L95-L99 WeakPolarHBondContact O-CD1 3.5Å; L95-L99 WeakPolarHBondContact O-CG 2.98Å; L95-L99 PolarHBondContact O-N 3.13Å; D96-L99 PolarHBondContact O-N 3.3Å; L99-R101 PolarHBondContact O-N 2.04Å; L99-L102 PolarHBondContact O-N 2.78Å; L99-S103 PolarHBondContact O-N 3.33Å
100	R	37.8	Very low	49	Very low	179 Å²	179	97.8 Å²	97.8	68%	0.675	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.1	163.6	-68.7	-177.3	-174.2	-168.1	1.8	112.3	D96 S103 Y106	D96-R100 WeakPolarHBondContact O-CB 3.02Å; D96-R100 VanDerWaalsContact O-CG 3.31Å; D96-R100 WeakPolarHBondContact O-CG 3.13Å; D96-R100 PolarHBondContact O-N 3.26Å; R100-S103 PolarHBondContact O-OG 3.47Å; R100-Y106 WeakPolarHBondContact O-CD2 3.49Å; R100-Y106 WeakPolarHBondContact O-CE2 3.31Å
101	R	43.6	Very low	51.2	Low	153 Å²	153	91.7 Å²	91.7	58%	0.577	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.1	173.9	-72.2	176.7	-173.7	-135.5	1	114.4	V97 V98 L99	V97-R101 VanDerWaalsContact O-CB 3.31Å; V97-R101 WeakPolarHBondContact O-CB 3.5Å; V97-R101 VanDerWaalsContact O-CD 3.23Å; V97-R101 WeakPolarHBondContact O-CD 2.99Å; V97-R101 WeakPolarHBondContact O-CG 3.19Å; V97-R101 PolarHBondContact O-N 3.32Å; V98-R101 CarbonylContact O-C 3.42Å; V98-R101 VanDerWaalsContact O-C 3.3Å; V98-R101 WeakPolarHBondContact O-CA 3.02Å; V98-R101 PolarHBondContact O-N 2.74Å; L99-R101 PolarHBondContact O-N 2.04Å
102	L	40.7	Very low	53.1	Low	133 Å²	133	92.7 Å²	92.7	70%	0.696	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-4	178.3	-77.1	167.6	0	0	0	113	V98 L99	V98-L102 HydrophobicContact CG1-CD1 3.7Å; V98-L102 HydrophobicContact CG1-CG 4.28Å; V98-L102 VanDerWaalsContact O-CB 3.32Å; V98-L102 WeakPolarHBondContact O-CB 2.99Å; V98-L102 WeakPolarHBondContact O-CD1 3.45Å; V98-L102 WeakPolarHBondContact O-CG 3.48Å; V98-L102 PolarHBondContact O-N 3.17Å; L99-L102 PolarHBondContact O-N 2.78Å
103	S	40.9	Very low	55.1	Low	44 Å²	44	95.4 Å²	95.4	31%	0.308	50%	0.5	S	S	.	.	S	Bend	trans	-72.8	127.6	159	51.4	0	0	0	0	108.3	L99 R100 N105 Y106	L99-S103 PolarHBondContact O-N 3.33Å; R100-S103 PolarHBondContact O-OG 3.47Å; S103-N105 PolarHBondContact O-N 3.36Å; S103-Y106 VanDerWaalsContact OG-CE2 3.27Å; S103-Y106 WeakPolarHBondContact OG-CE2 3.26Å
104	A	49.9	Very low	57.2	Low	89 Å²	89	93.5 Å²	93.5	74%	0.736	49%	0.486	S	S	*	.	S	Bend	trans	-68.5	51.3	173.3	0	0	0	0	0	111.3
105	N	63	Low	59.2	Low	99 Å²	99	92.2 Å²	92.2	53%	0.529	47%	0.47	S	S	.	.			trans	-140.7	23.7	-169.1	-73.4	-14.4	0	0	0	112.2	S103 Q117 D118	S103-N105 PolarHBondContact O-N 3.36Å; N105-Q117 CarbonylContact O-C 3.54Å; N105-Q117 WeakPolarHBondContact O-CA 3.24Å; N105-D118 VanDerWaalsContact C-CB 3.43Å; N105-D118 VanDerWaalsContact CA-CB 3.47Å; N105-D118 WeakPolarHBondContact CA-OD2 2.98Å; N105-D118 HydrophobicContact CB-CB 4.42Å; N105-D118 PolarHBondContact N-OD2 3.07Å; N105-D118 PolarHBondContact O-N 2.01Å
106	Y	68.5	Low	61.5	Low	94 Å²	94	88.6 Å²	88.6	37%	0.369	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	139.1	177.9	-65.1	-87.5	0	0	0	113.6	R100 S103 V115 C116 Q117 D118	R100-Y106 WeakPolarHBondContact O-CD2 3.49Å; R100-Y106 WeakPolarHBondContact O-CE2 3.31Å; S103-Y106 VanDerWaalsContact OG-CE2 3.27Å; S103-Y106 WeakPolarHBondContact OG-CE2 3.26Å; Y106-V115 HydrophobicContact CD1-CG1 3.96Å; Y106-V115 HydrophobicContact CG-CG1 4.23Å; Y106-C116 CarbonylContact C-O 3.37Å; Y106-C116 WeakPolarHBondContact CA-O 3.41Å; Y106-C116 WeakPolarHBondContact CB-O 3.1Å; Y106-C116 WeakPolarHBondContact CD1-O 3.29Å; Y106-Q117 HydrophobicContact CD1-CG 4.19Å; Y106-Q117 HydrophobicContact CE1-CG 3.79Å; Y106-D118 WeakPolarHBondContact CA-OD1 3.49Å; Y106-D118 VanDerWaalsContact N-CG 3.27Å; Y106-D118 PolarHBondContact N-OD1 3.48Å
107	I	75.6	Confident	63.7	Low	69 Å²	69	90.8 Å²	90.8	35%	0.354	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.9	175.9	-59	166	0	0	0	109.2	C116 D118 T120	I107-C116 PolarHBondContact N-O 2.92Å; I107-C116 PolarHBondContact O-N 3.43Å; I107-D118 WeakPolarHBondContact CG1-OD1 3.46Å; I107-T120 WeakPolarHBondContact CD1-O 2.96Å
108	M	80.3	Confident	64.9	Low	95 Å²	95	90.1 Å²	90.1	47%	0.468	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.3	173.4	-78.4	-87.2	166.7	0	0	110.4	V115	M108-V115 HydrophobicContact CE-CG1 4.44Å; M108-V115 HydrophobicContact CE-CG2 3.52Å; M108-V115 HydrophobicContact SD-CG2 3.72Å
109	C	84.9	Confident	66.6	Low	3 Å²	3	93.2 Å²	93.2	2%	0.02	47%	0.467	C	S	.	.			trans	-77.8	157.8	176.2	-56.9	0	0	0	0	111.9	D111 R112 S114 C116 C122 W130	C109-D111 PolarHBondContact O-N 3.42Å; C109-D111 VanDerWaalsContact O-N 3.11Å; C109-R112 PolarHBondContact O-N 3.41Å; C109-S114 WeakPolarHBondContact CB-O 3.28Å; C109-S114 PolarHBondContact N-O 3.34Å; C109-C116 PolarHBondContact SG-SG 3.28Å; C109-C122 WeakPolarHBondContact CA-SG 3.33Å; C109-C122 HydrophobicContact CB-CB 3.75Å; C109-C122 WeakPolarHBondContact CB-SG 3.29Å; C109-C122 PolarHBondContact N-SG 2.48Å; C109-C122 WeakPolarHBondContact SG-CB 3.23Å; C109-C122 CovalentContact SG-SG 2.05Å; C109-C122 PolarHBondContact SG-SG 3.31Å; C109-W130 HydrophobicContact CB-CB 3.66Å; C109-W130 HydrophobicContact CB-CD2 4.05Å; C109-W130 HydrophobicContact CB-CE3 4.08Å; C109-W130 HydrophobicContact CB-CG 3.91Å
110	P	80.1	Confident	68.8	Low	93 Å²	93	89.7 Å²	89.7	60%	0.604	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.9	-176.8	-31.5	39.9	0	0	0	116.7	R112 W130	P110-R112 PolarHBondContact O-N 3.48Å; P110-W130 HydrophobicContact CB-CH2 3.91Å; P110-W130 HydrophobicContact CB-CZ2 3.49Å; P110-W130 VanDerWaalsContact CB-CZ2 3.49Å; P110-W130 VanDerWaalsContact CD-CZ3 3.42Å; P110-W130 HydrophobicContact CG-CD2 4.42Å; P110-W130 HydrophobicContact CG-CE3 4.3Å; P110-W130 HydrophobicContact CG-CH2 3.32Å; P110-W130 HydrophobicContact CG-CZ2 3.48Å; P110-W130 VanDerWaalsContact CG-CZ2 3.48Å; P110-W130 HydrophobicContact CG-CZ3 3.76Å
111	D	77.7	Confident	71.3	Confident	43 Å²	43	82.5 Å²	82.5	23%	0.23	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.1	171.9	62	4.9	0	0	0	114.1	C109 L113 S114 W130	C109-D111 PolarHBondContact O-N 3.42Å; C109-D111 VanDerWaalsContact O-N 3.11Å; D111-L113 HydrophobicContact CB-CB 4.4Å; D111-L113 PolarHBondContact O-N 3.27Å; D111-L113 VanDerWaalsContact O-N 3.12Å; D111-L113 PolarHBondContact OD1-N 3.36Å; D111-S114 PolarHBondContact OD1-N 3.49Å; D111-S114 PolarHBondContact OD2-OG 2.87Å; D111-W130 HydrophobicContact CB-CG 4.25Å; D111-W130 WeakPolarHBondContact OD2-CB 3.09Å; D111-W130 VanDerWaalsContact OD2-CD1 3.24Å
112	R	73.7	Confident	73.5	Confident	222 Å²	222	76.1 Å²	76.1	84%	0.838	40%	0.404	S	S	*	.	S	Bend	trans	58.3	13.1	-171.4	-52.2	-176.1	176.3	-160.2	-2.4	114.1	C109 P110	C109-R112 PolarHBondContact O-N 3.41Å; P110-R112 PolarHBondContact O-N 3.48Å
113	L	73.3	Confident	75.9	Confident	149 Å²	149	70 Å²	70	78%	0.78	37%	0.372	S	S	*	.	S	Bend	trans	-107.4	-39.3	179.1	-65.5	174.2	0	0	0	110.6	D111	D111-L113 HydrophobicContact CB-CB 4.4Å; D111-L113 PolarHBondContact O-N 3.27Å; D111-L113 VanDerWaalsContact O-N 3.12Å; D111-L113 PolarHBondContact OD1-N 3.36Å
114	S	80	Confident	78.1	Confident	25 Å²	25	70.6 Å²	70.6	18%	0.175	38%	0.375	C	S	.	.			trans	-93.4	141.5	179	-67.1	0	0	0	0	112.4	C109 D111 W130	C109-S114 WeakPolarHBondContact CB-O 3.28Å; C109-S114 PolarHBondContact N-O 3.34Å; D111-S114 PolarHBondContact OD1-N 3.49Å; D111-S114 PolarHBondContact OD2-OG 2.87Å; S114-W130 VanDerWaalsContact CB-O 3.29Å; S114-W130 WeakPolarHBondContact CB-O 3.41Å; S114-W130 PolarHBondContact OG-O 3.14Å
115	V	82.2	Confident	79.4	Confident	55 Å²	55	70.5 Å²	70.5	33%	0.333	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128	179.6	-175	0	0	0	0	108.7	Y106 M108 C132	Y106-V115 HydrophobicContact CD1-CG1 3.96Å; Y106-V115 HydrophobicContact CG-CG1 4.23Å; M108-V115 HydrophobicContact CE-CG1 4.44Å; M108-V115 HydrophobicContact CE-CG2 3.52Å; M108-V115 HydrophobicContact SD-CG2 3.72Å; V115-C132 PolarHBondContact O-SG 3.48Å
116	C	86	Confident	79.8	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	156	-179.9	-61.8	0	0	0	0	110.7	Y106 I107 C109 T120 C132	Y106-C116 CarbonylContact C-O 3.37Å; Y106-C116 WeakPolarHBondContact CA-O 3.41Å; Y106-C116 WeakPolarHBondContact CB-O 3.1Å; Y106-C116 WeakPolarHBondContact CD1-O 3.29Å; I107-C116 PolarHBondContact N-O 2.92Å; I107-C116 PolarHBondContact O-N 3.43Å; C109-C116 PolarHBondContact SG-SG 3.28Å; C116-T120 VanDerWaalsContact CB-OG1 3.24Å; C116-T120 WeakPolarHBondContact CB-OG1 3.46Å; C116-C132 WeakPolarHBondContact CA-SG 3.1Å; C116-C132 HydrophobicContact CB-CB 3.68Å; C116-C132 WeakPolarHBondContact CB-SG 2.99Å; C116-C132 WeakPolarHBondContact SG-CA 3.3Å; C116-C132 WeakPolarHBondContact SG-CB 3.11Å; C116-C132 CovalentContact SG-SG 2.03Å; C116-C132 PolarHBondContact SG-SG 3.37Å
117	Q	81.4	Confident	79.7	Confident	121 Å²	121	68.1 Å²	68.1	57%	0.565	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	153.5	176	-70.4	177	-13.7	0	0	110.3	N105 Y106 N119 T120	N105-Q117 CarbonylContact O-C 3.54Å; N105-Q117 WeakPolarHBondContact O-CA 3.24Å; Y106-Q117 HydrophobicContact CD1-CG 4.19Å; Y106-Q117 HydrophobicContact CE1-CG 3.79Å; Q117-N119 PolarHBondContact O-N 2.04Å; Q117-T120 HydrophobicContact CB-CG2 4.12Å; Q117-T120 PolarHBondContact N-OG1 3.06Å; Q117-T120 VanDerWaalsContact N-OG1 3.12Å; Q117-T120 WeakPolarHBondContact O-CB 3.47Å; Q117-T120 PolarHBondContact O-N 3.42Å; Q117-T120 VanDerWaalsContact O-N 3.09Å; Q117-T120 PolarHBondContact O-OG1 2.8Å
118	D	65.2	Low	79.1	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	143.3	166.6	-85.3	5.5	0	0	0	108	N105 Y106 I107 T120	N105-D118 VanDerWaalsContact C-CB 3.43Å; N105-D118 VanDerWaalsContact CA-CB 3.47Å; N105-D118 WeakPolarHBondContact CA-OD2 2.98Å; N105-D118 HydrophobicContact CB-CB 4.42Å; N105-D118 PolarHBondContact N-OD2 3.07Å; N105-D118 PolarHBondContact O-N 2.01Å; Y106-D118 WeakPolarHBondContact CA-OD1 3.49Å; Y106-D118 VanDerWaalsContact N-CG 3.27Å; Y106-D118 PolarHBondContact N-OD1 3.48Å; I107-D118 WeakPolarHBondContact CG1-OD1 3.46Å; D118-T120 VanDerWaalsContact C-N 3.33Å
119	N	74.3	Confident	78.8	Confident	129 Å²	129	71.8 Å²	71.8	69%	0.69	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	14.3	-170.7	-126.7	30.9	0	0	0	115.6	Q117 H135 A136	Q117-N119 PolarHBondContact O-N 2.04Å; N119-H135 CarbonylContact O-C 3.55Å; N119-A136 HydrophobicContact CB-CB 4.48Å; N119-A136 WeakPolarHBondContact O-CA 3.42Å; N119-A136 WeakPolarHBondContact O-CB 3.47Å; N119-A136 PolarHBondContact O-N 3.3Å; N119-A136 WeakPolarHBondContact OD1-CB 3.03Å
120	T	86.6	Confident	78.9	Confident	19 Å²	19	74.8 Å²	74.8	12%	0.117	40%	0.403	C	S	.	.			trans	-117.3	164.5	167.1	65.4	0	0	0	0	110.8	I107 C116 Q117 D118 C133	I107-T120 WeakPolarHBondContact CD1-O 2.96Å; C116-T120 VanDerWaalsContact CB-OG1 3.24Å; C116-T120 WeakPolarHBondContact CB-OG1 3.46Å; Q117-T120 HydrophobicContact CB-CG2 4.12Å; Q117-T120 PolarHBondContact N-OG1 3.06Å; Q117-T120 VanDerWaalsContact N-OG1 3.12Å; Q117-T120 WeakPolarHBondContact O-CB 3.47Å; Q117-T120 PolarHBondContact O-N 3.42Å; Q117-T120 VanDerWaalsContact O-N 3.09Å; Q117-T120 PolarHBondContact O-OG1 2.8Å; D118-T120 VanDerWaalsContact C-N 3.33Å; T120-C133 WeakPolarHBondContact CA-O 3.36Å; T120-C133 WeakPolarHBondContact CB-O 3.1Å
121	T	88.7	Confident	79	Confident	28 Å²	28	70.8 Å²	70.8	17%	0.172	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.9	-177.1	-53.8	0	0	0	0	111	C123 C133 H135 N137 A138	T121-C123 PolarHBondContact O-N 3.48Å; T121-C133 PolarHBondContact N-O 2.84Å; T121-C133 PolarHBondContact O-N 2.74Å; T121-H135 PolarHBondContact N-O 3.12Å; T121-H135 PolarHBondContact OG1-O 3.09Å; T121-N137 WeakPolarHBondContact OG1-CA 2.93Å; T121-N137 PolarHBondContact OG1-N 2.84Å; T121-A138 HydrophobicContact CG2-CB 4.26Å; T121-A138 PolarHBondContact OG1-N 2.87Å
122	C	91.1	Very high	79.6	Confident	20 Å²	20	71.5 Å²	71.5	14%	0.135	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	118.5	171.1	-76.6	0	0	0	0	109.9	C109 W130 G131	C109-C122 WeakPolarHBondContact CA-SG 3.33Å; C109-C122 HydrophobicContact CB-CB 3.75Å; C109-C122 WeakPolarHBondContact CB-SG 3.29Å; C109-C122 PolarHBondContact N-SG 2.48Å; C109-C122 WeakPolarHBondContact SG-CB 3.23Å; C109-C122 CovalentContact SG-SG 2.05Å; C109-C122 PolarHBondContact SG-SG 3.31Å; C122-W130 HydrophobicContact CB-CE3 3.79Å; C122-W130 HydrophobicContact CB-CZ3 4.07Å; C122-W130 WeakPolarHBondContact O-CZ3 2.99Å; C122-G131 WeakPolarHBondContact CA-O 3.39Å
123	C	91.2	Very high	80.3	Confident	4 Å²	4	61.1 Å²	61.1	3%	0.027	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.8	177.5	-72.3	0	0	0	0	111.7	T121 M125 G131 C133 C140	T121-C123 PolarHBondContact O-N 3.48Å; C123-M125 PolarHBondContact O-N 2.92Å; C123-G131 PolarHBondContact N-O 3.02Å; C123-G131 PolarHBondContact O-N 2.89Å; C123-C133 WeakPolarHBondContact CB-SG 3.46Å; C123-C133 PolarHBondContact SG-SG 3.45Å; C123-C140 WeakPolarHBondContact CA-SG 3.19Å; C123-C140 HydrophobicContact CB-CB 3.59Å; C123-C140 WeakPolarHBondContact CB-SG 3.22Å; C123-C140 WeakPolarHBondContact SG-CA 3.3Å; C123-C140 WeakPolarHBondContact SG-CB 3.46Å; C123-C140 CovalentContact SG-SG 2.02Å; C123-C140 PolarHBondContact SG-SG 2.68Å
124	P	86.1	Confident	80.9	Confident	57 Å²	57	62.5 Å²	62.5	37%	0.37	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	121.2	171.3	28.9	-32.8	0	0	0	109.2
125	M	78	Confident	81	Confident	86 Å²	86	65.1 Å²	65.1	42%	0.424	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	167.9	172.5	-62	-169.5	114.2	0	0	110.2	C123 G127 I129 G144	C123-M125 PolarHBondContact O-N 2.92Å; M125-G127 PolarHBondContact O-N 2.03Å; M125-I129 PolarHBondContact N-O 3.01Å; M125-G144 WeakPolarHBondContact CA-O 3.41Å
126	S	71.3	Confident	80.7	Confident	78 Å²	78	64.3 Å²	64.3	55%	0.545	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	128.4	172.4	54.1	0	0	0	0	111.4	G144	S126-G144 PolarHBondContact N-O 2.93Å
127	G	66.2	Low	80.3	Confident	65 Å²	65	70 Å²	70	67%	0.67	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	20.5	178.7	0	0	0	0	0	117.2	M125 I129	M125-G127 PolarHBondContact O-N 2.03Å; G127-I129 WeakPolarHBondContact O-CG1 3.29Å; G127-I129 PolarHBondContact O-N 2.84Å
128	E	63.7	Low	80.5	Confident	176 Å²	176	64.7 Å²	64.7	82%	0.822	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	18.7	179.4	-55.8	-176.1	166.1	0	0	114.5
129	I	72.3	Confident	81.7	Confident	65 Å²	65	64.5 Å²	64.5	33%	0.333	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	143.1	179.3	-43.6	168.8	0	0	0	108.9	P27 M125 G127	P27-I129 HydrophobicContact CG-CD1 3.4Å; P27-I129 VanDerWaalsContact CG-CD1 3.4Å; P27-I129 HydrophobicContact CG-CG1 4.02Å; M125-I129 PolarHBondContact N-O 3.01Å; G127-I129 WeakPolarHBondContact O-CG1 3.29Å; G127-I129 PolarHBondContact O-N 2.84Å
130	W	86.8	Confident	82.5	Confident	66 Å²	66	60.7 Å²	60.7	25%	0.25	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	136.5	170.9	-70	73.3	0	0	0	111.3	C109 P110 D111 S114 C122	C109-W130 HydrophobicContact CB-CB 3.66Å; C109-W130 HydrophobicContact CB-CD2 4.05Å; C109-W130 HydrophobicContact CB-CE3 4.08Å; C109-W130 HydrophobicContact CB-CG 3.91Å; P110-W130 HydrophobicContact CB-CH2 3.91Å; P110-W130 HydrophobicContact CB-CZ2 3.49Å; P110-W130 VanDerWaalsContact CB-CZ2 3.49Å; P110-W130 VanDerWaalsContact CD-CZ3 3.42Å; P110-W130 HydrophobicContact CG-CD2 4.42Å; P110-W130 HydrophobicContact CG-CE3 4.3Å; P110-W130 HydrophobicContact CG-CH2 3.32Å; P110-W130 HydrophobicContact CG-CZ2 3.48Å; P110-W130 VanDerWaalsContact CG-CZ2 3.48Å; P110-W130 HydrophobicContact CG-CZ3 3.76Å; D111-W130 HydrophobicContact CB-CG 4.25Å; D111-W130 WeakPolarHBondContact OD2-CB 3.09Å; D111-W130 VanDerWaalsContact OD2-CD1 3.24Å; S114-W130 VanDerWaalsContact CB-O 3.29Å; S114-W130 WeakPolarHBondContact CB-O 3.41Å; S114-W130 PolarHBondContact OG-O 3.14Å; C122-W130 HydrophobicContact CB-CE3 3.79Å; C122-W130 HydrophobicContact CB-CZ3 4.07Å; C122-W130 WeakPolarHBondContact O-CZ3 2.99Å
131	G	83.6	Confident	82.7	Confident	9 Å²	9	60 Å²	60	9%	0.093	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	170.1	174.9	0	0	0	0	0	112.8	C122 C123	C122-G131 WeakPolarHBondContact CA-O 3.39Å; C123-G131 PolarHBondContact N-O 3.02Å; C123-G131 PolarHBondContact O-N 2.89Å
132	C	89.4	Confident	82.4	Confident	59 Å²	59	64 Å²	64	40%	0.399	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114	-175.2	-52.3	0	0	0	0	111.1	V115 C116	V115-C132 PolarHBondContact O-SG 3.48Å; C116-C132 WeakPolarHBondContact CA-SG 3.1Å; C116-C132 HydrophobicContact CB-CB 3.68Å; C116-C132 WeakPolarHBondContact CB-SG 2.99Å; C116-C132 WeakPolarHBondContact SG-CA 3.3Å; C116-C132 WeakPolarHBondContact SG-CB 3.11Å; C116-C132 CovalentContact SG-SG 2.03Å; C116-C132 PolarHBondContact SG-SG 3.37Å
133	C	89.6	Confident	82.1	Confident	4 Å²	4	64.7 Å²	64.7	3%	0.027	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.9	171.5	-57.6	0	0	0	0	109.9	T120 T121 C123 H135 A138 C147	T120-C133 WeakPolarHBondContact CA-O 3.36Å; T120-C133 WeakPolarHBondContact CB-O 3.1Å; T121-C133 PolarHBondContact N-O 2.84Å; T121-C133 PolarHBondContact O-N 2.74Å; C123-C133 WeakPolarHBondContact CB-SG 3.46Å; C123-C133 PolarHBondContact SG-SG 3.45Å; C133-H135 PolarHBondContact O-N 2.58Å; C133-A138 HydrophobicContact CB-CB 3.62Å; C133-C147 HydrophobicContact CB-CB 3.4Å; C133-C147 VanDerWaalsContact CB-CB 3.4Å; C133-C147 WeakPolarHBondContact CB-SG 3.34Å; C133-C147 WeakPolarHBondContact SG-CB 3.37Å; C133-C147 CovalentContact SG-SG 2.01Å; C133-C147 PolarHBondContact SG-SG 3.4Å
134	Q	84.9	Confident	81.6	Confident	177 Å²	177	65 Å²	65	83%	0.827	38%	0.376	S	S	*	.	S	Bend	trans	-66.3	-1.7	-173.3	-61.8	-175.8	2	0	0	114.9
135	H	82.2	Confident	81.3	Confident	81 Å²	81	68.2 Å²	68.2	38%	0.375	39%	0.386	S	S	.	.	S	Bend	trans	-103.5	137.8	177	-53.1	-61.9	0	0	0	110.8	N119 T121 C133 A138 P149	N119-H135 CarbonylContact O-C 3.55Å; T121-H135 PolarHBondContact N-O 3.12Å; T121-H135 PolarHBondContact OG1-O 3.09Å; C133-H135 PolarHBondContact O-N 2.58Å; H135-A138 HydrophobicContact CB-CB 3.89Å; H135-A138 PolarHBondContact O-N 2.03Å; H135-P149 HydrophobicContact CB-CB 4.46Å
136	A	75.8	Confident	81.8	Confident	38 Å²	38	65.6 Å²	65.6	31%	0.314	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	135.4	164.7	0	0	0	0	0	109	N119 A138	N119-A136 HydrophobicContact CB-CB 4.48Å; N119-A136 WeakPolarHBondContact O-CA 3.42Å; N119-A136 WeakPolarHBondContact O-CB 3.47Å; N119-A136 PolarHBondContact O-N 3.3Å; N119-A136 WeakPolarHBondContact OD1-CB 3.03Å; A136-A138 PolarHBondContact O-N 3.44Å
137	N	77.2	Confident	82.6	Confident	121 Å²	121	63.4 Å²	63.4	65%	0.647	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	40	-175.3	-56.4	-32.6	0	0	0	113.2	T121 H150	T121-N137 WeakPolarHBondContact OG1-CA 2.93Å; T121-N137 PolarHBondContact OG1-N 2.84Å; N137-H150 HydrophobicContact CB-CB 4.39Å
138	A	87	Confident	83.8	Confident	10 Å²	10	60.3 Å²	60.3	8%	0.083	33%	0.325	C	S	.	.			trans	-61.6	146.5	175.5	0	0	0	0	0	110.9	T121 C133 H135 A136 C140 C147 C148	T121-A138 HydrophobicContact CG2-CB 4.26Å; T121-A138 PolarHBondContact OG1-N 2.87Å; C133-A138 HydrophobicContact CB-CB 3.62Å; H135-A138 HydrophobicContact CB-CB 3.89Å; H135-A138 PolarHBondContact O-N 2.03Å; A136-A138 PolarHBondContact O-N 3.44Å; A138-C140 PolarHBondContact O-N 3.31Å; A138-C147 HydrophobicContact CB-CB 4.23Å; A138-C148 CarbonylContact C-O 3.46Å; A138-C148 VanDerWaalsContact CA-O 3.27Å; A138-C148 WeakPolarHBondContact CA-O 3.25Å
139	I	89	Confident	84.9	Confident	63 Å²	63	54.2 Å²	54.2	32%	0.323	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.8	169.7	-62.1	165.9	0	0	0	106.9	C141 C147 C148 S152	I139-C141 PolarHBondContact O-N 3.37Å; I139-C147 WeakPolarHBondContact O-CA 3.39Å; I139-C148 HydrophobicContact CB-CB 4.1Å; I139-C148 PolarHBondContact N-O 3.31Å; I139-C148 PolarHBondContact O-N 2.82Å; I139-S152 WeakPolarHBondContact CD1-O 3.38Å
140	C	91.7	Very high	85.3	Confident	48 Å²	48	57.2 Å²	57.2	32%	0.324	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	110.2	173.1	-48.4	0	0	0	0	109	C123 A138	C123-C140 WeakPolarHBondContact CA-SG 3.19Å; C123-C140 HydrophobicContact CB-CB 3.59Å; C123-C140 WeakPolarHBondContact CB-SG 3.22Å; C123-C140 WeakPolarHBondContact SG-CA 3.3Å; C123-C140 WeakPolarHBondContact SG-CB 3.46Å; C123-C140 CovalentContact SG-SG 2.02Å; C123-C140 PolarHBondContact SG-SG 2.68Å; A138-C140 PolarHBondContact O-N 3.31Å
141	C	90.1	Very high	85.1	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.027	33%	0.326	C	S	.	.			trans	-74.4	139.9	179.3	-59.8	0	0	0	0	110.2	I139 D143 G144 H146 C148 C154	I139-C141 PolarHBondContact O-N 3.37Å; C141-D143 PolarHBondContact O-N 2.71Å; C141-G144 PolarHBondContact O-N 2.82Å; C141-G144 VanDerWaalsContact O-N 3.07Å; C141-H146 WeakPolarHBondContact CB-O 3.42Å; C141-H146 PolarHBondContact N-O 3.1Å; C141-H146 PolarHBondContact SG-NE2 3.11Å; C141-C148 PolarHBondContact SG-SG 3.02Å; C141-C154 WeakPolarHBondContact CA-SG 3.21Å; C141-C154 HydrophobicContact CB-CB 3.8Å; C141-C154 WeakPolarHBondContact CB-SG 3.45Å; C141-C154 WeakPolarHBondContact SG-CB 3.36Å; C141-C154 CovalentContact SG-SG 2.04Å; C141-C154 PolarHBondContact SG-SG 2.02Å
142	P	84	Confident	85.3	Confident	112 Å²	112	56.7 Å²	56.7	73%	0.727	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-3.8	-173.5	23.5	-30.4	0	0	0	114.3	M156	P142-M156 HydrophobicContact CG-CE 3.86Å; P142-M156 HydrophobicContact CG-SD 3.63Å
143	D	83.4	Confident	85.1	Confident	35 Å²	35	57.8 Å²	57.8	19%	0.187	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.9	169.9	56.9	16.3	0	0	0	112.4	C141 E145 H146 M156 H159	C141-D143 PolarHBondContact O-N 2.71Å; D143-E145 HydrophobicContact CB-CB 4.49Å; D143-E145 HydrophobicContact CB-CG 4.47Å; D143-E145 PolarHBondContact O-N 3.34Å; D143-E145 PolarHBondContact OD1-N 3.18Å; D143-H146 IonicContact OD1-CE1 3.94Å; D143-H146 PolarHBondContact OD1-N 3.31Å; D143-H146 IonicContact OD1-ND1 3.35Å; D143-H146 PolarHBondContact OD1-ND1 2.9Å; D143-H146 IonicContact OD2-CE1 2.92Å; D143-H146 PolarHBondContact OD2-CE1 2.86Å; D143-H146 IonicContact OD2-CG 3.98Å; D143-H146 IonicContact OD2-ND1 2.66Å; D143-H146 PolarHBondContact OD2-ND1 2.8Å; D143-M156 HydrophobicContact CB-CE 3.69Å; D143-H159 IonicContact OD2-CD2 3.56Å
144	G	81	Confident	85.1	Confident	12 Å²	12	58.9 Å²	58.9	12%	0.124	34%	0.338	C	S	.	.	S	Bend	trans	65.9	15.7	-175.8	0	0	0	0	0	113.4	M125 S126 C141	M125-G144 WeakPolarHBondContact CA-O 3.41Å; S126-G144 PolarHBondContact N-O 2.93Å; C141-G144 PolarHBondContact O-N 2.82Å; C141-G144 VanDerWaalsContact O-N 3.07Å
145	E	81.2	Confident	85.3	Confident	124 Å²	124	51.1 Å²	51.1	58%	0.579	30%	0.302	S	S	*	.	S	Bend	trans	-107.8	-38.7	-178.8	-64.5	-161.1	158.8	0	0	112.3	D143 H159	D143-E145 HydrophobicContact CB-CB 4.49Å; D143-E145 HydrophobicContact CB-CG 4.47Å; D143-E145 PolarHBondContact O-N 3.34Å; D143-E145 PolarHBondContact OD1-N 3.18Å; E145-H159 IonicContact OE2-CD2 3.23Å; E145-H159 PolarHBondContact OE2-CD2 2.99Å; E145-H159 VanDerWaalsContact OE2-CD2 3.23Å; E145-H159 IonicContact OE2-NE2 3.63Å
146	H	86.5	Confident	85.3	Confident	30 Å²	30	51.4 Å²	51.4	14%	0.139	30%	0.304	C	S	.	.			trans	-132.5	165	-179	76.3	-73.5	0	0	0	113	C141 D143 S160	C141-H146 WeakPolarHBondContact CB-O 3.42Å; C141-H146 PolarHBondContact N-O 3.1Å; C141-H146 PolarHBondContact SG-NE2 3.11Å; D143-H146 IonicContact OD1-CE1 3.94Å; D143-H146 PolarHBondContact OD1-N 3.31Å; D143-H146 IonicContact OD1-ND1 3.35Å; D143-H146 PolarHBondContact OD1-ND1 2.9Å; D143-H146 IonicContact OD2-CE1 2.92Å; D143-H146 PolarHBondContact OD2-CE1 2.86Å; D143-H146 IonicContact OD2-CG 3.98Å; D143-H146 IonicContact OD2-ND1 2.66Å; D143-H146 PolarHBondContact OD2-ND1 2.8Å; H146-S160 PolarHBondContact NE2-N 3.26Å; H146-S160 PolarHBondContact NE2-O 2.87Å
147	C	89.4	Confident	85.6	Confident	32 Å²	32	55.2 Å²	55.2	22%	0.216	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.6	175.6	-29.4	0	0	0	0	109.7	C133 A138 I139	C133-C147 HydrophobicContact CB-CB 3.4Å; C133-C147 VanDerWaalsContact CB-CB 3.4Å; C133-C147 WeakPolarHBondContact CB-SG 3.34Å; C133-C147 WeakPolarHBondContact SG-CB 3.37Å; C133-C147 CovalentContact SG-SG 2.01Å; C133-C147 PolarHBondContact SG-SG 3.4Å; A138-C147 HydrophobicContact CB-CB 4.23Å; I139-C147 WeakPolarHBondContact O-CA 3.39Å
148	C	91.5	Very high	86	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.2	-176.9	-76.6	0	0	0	0	112.2	A138 I139 C141 S152 C161	A138-C148 CarbonylContact C-O 3.46Å; A138-C148 VanDerWaalsContact CA-O 3.27Å; A138-C148 WeakPolarHBondContact CA-O 3.25Å; I139-C148 HydrophobicContact CB-CB 4.1Å; I139-C148 PolarHBondContact N-O 3.31Å; I139-C148 PolarHBondContact O-N 2.82Å; C141-C148 PolarHBondContact SG-SG 3.02Å; C148-S152 VanDerWaalsContact CB-OG 3.29Å; C148-S152 WeakPolarHBondContact CB-OG 3.31Å; C148-C161 WeakPolarHBondContact CA-SG 3.02Å; C148-C161 HydrophobicContact CB-CB 3.85Å; C148-C161 WeakPolarHBondContact CB-SG 3.1Å; C148-C161 WeakPolarHBondContact SG-CA 2.98Å; C148-C161 WeakPolarHBondContact SG-CB 3.49Å; C148-C161 CovalentContact SG-SG 2.04Å; C148-C161 PolarHBondContact SG-SG 2.88Å
149	P	87.1	Confident	85.8	Confident	49 Å²	49	58.8 Å²	58.8	32%	0.318	34%	0.338	S	S	.	.			trans	-61.6	152.4	175.4	25.4	-33.5	0	0	0	110.9	H135 G151 S152	H135-P149 HydrophobicContact CB-CB 4.46Å; P149-G151 PolarHBondContact O-N 3.21Å; P149-S152 VanDerWaalsContact CD-OG 3.25Å; P149-S152 WeakPolarHBondContact CD-OG 2.92Å; P149-S152 WeakPolarHBondContact CG-OG 3.28Å; P149-S152 PolarHBondContact O-N 3.13Å; P149-S152 VanDerWaalsContact O-N 3.1Å; P149-S152 PolarHBondContact O-OG 3.15Å
150	H	81	Confident	85.8	Confident	128 Å²	128	57.9 Å²	57.9	59%	0.593	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	128.2	177.8	-174.4	-93.1	0	0	0	111.3	N137	N137-H150 HydrophobicContact CB-CB 4.39Å
151	G	80.7	Confident	85.7	Confident	50 Å²	50	57.9 Å²	57.9	52%	0.515	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	1	-179.1	0	0	0	0	0	116.2	P149 A164	P149-G151 PolarHBondContact O-N 3.21Å; G151-A164 WeakPolarHBondContact O-CB 3.04Å; G151-A164 PolarHBondContact O-N 3.38Å
152	S	88.4	Confident	85.5	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.091	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	170	169.4	60.3	0	0	0	0	112	I139 C148 P149 K162	I139-S152 WeakPolarHBondContact CD1-O 3.38Å; C148-S152 VanDerWaalsContact CB-OG 3.29Å; C148-S152 WeakPolarHBondContact CB-OG 3.31Å; P149-S152 VanDerWaalsContact CD-OG 3.25Å; P149-S152 WeakPolarHBondContact CD-OG 2.92Å; P149-S152 WeakPolarHBondContact CG-OG 3.28Å; P149-S152 PolarHBondContact O-N 3.13Å; P149-S152 VanDerWaalsContact O-N 3.1Å; P149-S152 PolarHBondContact O-OG 3.15Å; S152-K162 CarbonylContact C-O 3.5Å; S152-K162 VanDerWaalsContact CA-O 3.31Å; S152-K162 WeakPolarHBondContact CA-O 3.28Å; S152-K162 WeakPolarHBondContact CB-O 3.35Å
153	V	86.2	Confident	85.3	Confident	83 Å²	83	62.4 Å²	62.4	50%	0.503	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.7	-179	-179.4	0	0	0	0	108	D155 K162 A164	V153-D155 PolarHBondContact O-N 3.15Å; V153-K162 PolarHBondContact N-O 3.34Å; V153-K162 PolarHBondContact O-N 3.07Å; V153-A164 HydrophobicContact CG2-CB 4.45Å
154	C	89.5	Confident	84.4	Confident	27 Å²	27	63.6 Å²	63.6	18%	0.182	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	121.1	176.2	-61.2	0	0	0	0	110.4	C141 M156	C141-C154 WeakPolarHBondContact CA-SG 3.21Å; C141-C154 HydrophobicContact CB-CB 3.8Å; C141-C154 WeakPolarHBondContact CB-SG 3.45Å; C141-C154 WeakPolarHBondContact SG-CB 3.36Å; C141-C154 CovalentContact SG-SG 2.04Å; C141-C154 PolarHBondContact SG-SG 2.02Å; C154-M156 HydrophobicContact CB-SD 4.32Å
155	D	87.6	Confident	83	Confident	14 Å²	14	72.4 Å²	72.4	8%	0.075	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	92.7	167.6	-173.1	-2	0	0	0	109.4	V153 V157 N158 H159 S160 K162	V153-D155 PolarHBondContact O-N 3.15Å; D155-V157 PolarHBondContact O-N 2.84Å; D155-V157 VanDerWaalsContact O-N 3.12Å; D155-V157 WeakPolarHBondContact OD1-CB 3.37Å; D155-V157 PolarHBondContact OD1-N 3.27Å; D155-V157 VanDerWaalsContact OD1-N 3.11Å; D155-N158 PolarHBondContact O-N 3.36Å; D155-N158 PolarHBondContact OD1-N 3.02Å; D155-N158 PolarHBondContact OD2-ND2 3.2Å; D155-H159 WeakPolarHBondContact O-CA 3.14Å; D155-H159 PolarHBondContact O-N 3.14Å; D155-S160 WeakPolarHBondContact CA-O 3.35Å; D155-S160 WeakPolarHBondContact CB-O 3.37Å; D155-S160 PolarHBondContact N-O 2.78Å; D155-S160 PolarHBondContact O-N 2.73Å; D155-K162 HydrophobicContact CB-CD 4Å; D155-K162 HydrophobicContact CB-CG 4.21Å; D155-K162 VanDerWaalsContact CG-NZ 3.32Å; D155-K162 IonicContact OD1-NZ 3.75Å; D155-K162 WeakPolarHBondContact OD2-CE 3.25Å; D155-K162 IonicContact OD2-NZ 2.64Å; D155-K162 PolarHBondContact OD2-NZ 2.74Å
156	M	83.4	Confident	81	Confident	86 Å²	86	70.6 Å²	70.6	42%	0.424	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18	179.3	-58.3	-60.5	-59.6	0	0	113.7	P142 D143 C154	P142-M156 HydrophobicContact CG-CE 3.86Å; P142-M156 HydrophobicContact CG-SD 3.63Å; D143-M156 HydrophobicContact CB-CE 3.69Å; C154-M156 HydrophobicContact CB-SD 4.32Å
157	V	82.2	Confident	78.7	Confident	118 Å²	118	76.4 Å²	76.4	72%	0.715	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-41.9	-179.6	-178.4	0	0	0	0	110.6	D155	D155-V157 PolarHBondContact O-N 2.84Å; D155-V157 VanDerWaalsContact O-N 3.12Å; D155-V157 WeakPolarHBondContact OD1-CB 3.37Å; D155-V157 PolarHBondContact OD1-N 3.27Å; D155-V157 VanDerWaalsContact OD1-N 3.11Å
158	N	84.8	Confident	76	Confident	107 Å²	107	84.1 Å²	84.1	57%	0.572	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	4.4	-175.8	-65.1	-54	0	0	0	113.3	D155 S160	D155-N158 PolarHBondContact O-N 3.36Å; D155-N158 PolarHBondContact OD1-N 3.02Å; D155-N158 PolarHBondContact OD2-ND2 3.2Å; N158-S160 WeakPolarHBondContact CB-OG 3.27Å; N158-S160 PolarHBondContact O-N 2.9Å
159	H	82.9	Confident	73.2	Confident	99 Å²	99	90.4 Å²	90.4	46%	0.458	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	43	-172.6	-55.3	81.6	0	0	0	111.7	D143 E145 D155	D143-H159 IonicContact OD2-CD2 3.56Å; E145-H159 IonicContact OE2-CD2 3.23Å; E145-H159 PolarHBondContact OE2-CD2 2.99Å; E145-H159 VanDerWaalsContact OE2-CD2 3.23Å; E145-H159 IonicContact OE2-NE2 3.63Å; D155-H159 WeakPolarHBondContact O-CA 3.14Å; D155-H159 PolarHBondContact O-N 3.14Å
160	S	88.9	Confident	70.6	Confident	45 Å²	45	93.8 Å²	93.8	32%	0.315	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	169.7	-170.7	70	0	0	0	0	112.2	H146 D155 N158	H146-S160 PolarHBondContact NE2-N 3.26Å; H146-S160 PolarHBondContact NE2-O 2.87Å; D155-S160 WeakPolarHBondContact CA-O 3.35Å; D155-S160 WeakPolarHBondContact CB-O 3.37Å; D155-S160 PolarHBondContact N-O 2.78Å; D155-S160 PolarHBondContact O-N 2.73Å; N158-S160 WeakPolarHBondContact CB-OG 3.27Å; N158-S160 PolarHBondContact O-N 2.9Å
161	C	89.5	Confident	68.2	Low	48 Å²	48	95.5 Å²	95.5	32%	0.324	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.5	-179.2	-54.3	0	0	0	0	110.3	C148	C148-C161 WeakPolarHBondContact CA-SG 3.02Å; C148-C161 HydrophobicContact CB-CB 3.85Å; C148-C161 WeakPolarHBondContact CB-SG 3.1Å; C148-C161 WeakPolarHBondContact SG-CA 2.98Å; C148-C161 WeakPolarHBondContact SG-CB 3.49Å; C148-C161 CovalentContact SG-SG 2.04Å; C148-C161 PolarHBondContact SG-SG 2.88Å
162	K	86.6	Confident	65.9	Low	107 Å²	107	100.2 Å²	100.2	47%	0.465	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.4	173.3	-75.2	171.2	168	158	0	109.4	S152 V153 D155 A164	S152-K162 CarbonylContact C-O 3.5Å; S152-K162 VanDerWaalsContact CA-O 3.31Å; S152-K162 WeakPolarHBondContact CA-O 3.28Å; S152-K162 WeakPolarHBondContact CB-O 3.35Å; V153-K162 PolarHBondContact N-O 3.34Å; V153-K162 PolarHBondContact O-N 3.07Å; D155-K162 HydrophobicContact CB-CD 4Å; D155-K162 HydrophobicContact CB-CG 4.21Å; D155-K162 VanDerWaalsContact CG-NZ 3.32Å; D155-K162 IonicContact OD1-NZ 3.75Å; D155-K162 WeakPolarHBondContact OD2-CE 3.25Å; D155-K162 IonicContact OD2-NZ 2.64Å; D155-K162 PolarHBondContact OD2-NZ 2.74Å; K162-A164 PolarHBondContact O-N 2.83Å
163	P	79	Confident	63.4	Low	103 Å²	103	108.4 Å²	108.4	67%	0.669	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-58.5	138.9	169.7	24.6	-31.9	0	0	0	109.4	K165	P163-K165 PolarHBondContact O-N 2.88Å
164	A	64.6	Low	60.7	Low	61 Å²	61	113.2 Å²	113.2	50%	0.504	60%	0.595	S	S	.	*			trans	-60.6	108	170.2	0	0	0	0	0	107.7	G151 V153 K162 S166	G151-A164 WeakPolarHBondContact O-CB 3.04Å; G151-A164 PolarHBondContact O-N 3.38Å; V153-A164 HydrophobicContact CG2-CB 4.45Å; K162-A164 PolarHBondContact O-N 2.83Å; A164-S166 PolarHBondContact O-N 3.44Å
165	K	51.2	Low	58.2	Low	196 Å²	196	116.9 Å²	116.9	85%	0.852	62%	0.621	S	S	*	*			trans	-59.8	110.8	-174.5	-74.9	-175.7	175.9	-176.1	0	110.3	P163	P163-K165 PolarHBondContact O-N 2.88Å
166	S	40.4	Very low	55.5	Low	86 Å²	86	125.4 Å²	125.4	60%	0.601	66%	0.658	S	S	*	*			trans	-79.7	104.5	165.3	54.6	0	0	0	0	109.5	A164	A164-S166 PolarHBondContact O-N 3.44Å
167	N	37.4	Very low	53.3	Low	152 Å²	152	126.3 Å²	126.3	81%	0.813	67%	0.67	S	S	*	*			trans	-104.9	96.4	161.1	-83.9	-1.7	0	0	0	108
168	E	33	Very low	50.7	Low	195 Å²	195	127.2 Å²	127.2	91%	0.911	68%	0.676	S	S	*	*			trans	140.5	94.6	154.6	-77.5	-176.8	-168.9	0	0	110.6
169	I	32.3	Very low	48.1	Very low	132 Å²	132	129.9 Å²	129.9	68%	0.677	69%	0.69	S	S	*	*			trans	-108.2	150.7	165.1	-41.4	174.3	0	0	0	105.9
170	P	33.2	Very low	45.6	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	71%	0.711	S	S	*	*				-148.3	133.6	94.2	29	-7.2	0	0	0	116.9
171	E	30.3	Very low	42.7	Very low	164 Å²	164	139.2 Å²	139.2	77%	0.766	73%	0.732	S	S	*	*			trans	32.8	126.3	136	-58.2	-178.2	160	0	0	122.5
172	M	32.5	Very low	39.9	Very low	150 Å²	150	143.5 Å²	143.5	74%	0.739	76%	0.756	S	S	*	*				176	123.5	103.2	-102.4	-170.5	-89.8	0	0	115.4
173	K	35.5	Very low	37.4	Very low	185 Å²	185	142.6 Å²	142.6	80%	0.804	76%	0.763	S	S	*	*			trans	76.4	108.3	134	-70	173.6	-178.9	173.6	0	122.7
174	E	30.6	Very low	35.2	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	77%	0.769	S	S	*	*			trans	-19.2	139.2	152	-56.8	176	155.4	0	0	119.4
175	S	35.7	Very low	34.1	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	76%	0.758	S	S	*	*				-179.1	111.1	116.9	60.9	0	0	0	0	114
176	F	31.5	Very low	34	Very low	194 Å²	194	134.7 Å²	134.7	85%	0.851	74%	0.741	S	S	*	*			trans	59.7	149.5	139	-68.2	-73.9	0	0	0	123.3
177	P	36.6	Very low	34.7	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	74%	0.743	S	S	*	*				-127.7	147.1	-127.4	37.9	-20.7	0	0	0	115.3
178	T	28.9	Very low	35.6	Very low	137 Å²	137	128.4 Å²	128.4	84%	0.84	71%	0.707	S	S	*	*			trans	-163.8	136.1	147.4	-14.3	0	0	0	0	113.1
179	L	29.9	Very low	36.9	Very low	163 Å²	163	128 Å²	128	85%	0.853	70%	0.697	S	S	*	*			trans	74.2	111.1	175	-85.2	98.9	0	0	0	119.6
180	H	29.9	Very low	38.2	Very low	198 Å²	198	127.7 Å²	127.7	92%	0.917	70%	0.696	S	S	*	*			trans	-62.3	128	-177.7	-94	-101.2	0	0	0	114.7
181	L	28.5	Very low	39.2	Very low	141 Å²	141	122.8 Å²	122.8	74%	0.738	66%	0.664	S	S	*	*			trans	-54.6	143	154.3	-85.8	64.4	0	0	0	111.7	S183	L181-S183 PolarHBondContact O-N 3.32Å
182	V	31.2	Very low	40.2	Very low	138 Å²	138	120.3 Å²	120.3	84%	0.836	66%	0.661	S	S	*	*			trans	-87	95.1	141.9	-177	0	0	0	0	106
183	S	32.9	Very low	41	Very low	89 Å²	89	119.5 Å²	119.5	62%	0.622	66%	0.66	S	S	*	*			trans	-55.1	139.6	175.9	41.1	0	0	0	0	111.4	L181 S185	L181-S183 PolarHBondContact O-N 3.32Å; S183-S185 PolarHBondContact O-N 3.48Å
184	A	32.8	Very low	41.7	Very low	95 Å²	95	113.1 Å²	113.1	79%	0.785	64%	0.636	S	S	*	*			trans	-39.1	124	178.4	0	0	0	0	0	112.5
185	S	42.8	Very low	42.3	Very low	38 Å²	38	113.7 Å²	113.7	27%	0.266	64%	0.636	S	S	.	*			trans	-73.1	156.2	175.4	36.1	0	0	0	0	111.2	S183 C244 C245 P246	S183-S185 PolarHBondContact O-N 3.48Å; S185-C244 WeakPolarHBondContact CB-O 2.95Å; S185-C244 VanDerWaalsContact OG-C 3.27Å; S185-C244 PolarHBondContact OG-O 2.66Å; S185-C245 WeakPolarHBondContact OG-CA 3.47Å; S185-P246 WeakPolarHBondContact OG-CD 3.49Å
186	A	48.3	Very low	42.5	Very low	60 Å²	60	114.2 Å²	114.2	50%	0.496	64%	0.637	S	S	.	*			trans	-35.8	147.5	-162.6	0	0	0	0	0	116.9	A188 C244	A186-A188 PolarHBondContact O-N 3.1Å; A186-C244 PolarHBondContact O-N 3.41Å
187	P	55.5	Low	42.8	Very low	100 Å²	100	110.7 Å²	110.7	65%	0.649	64%	0.636	S	S	*	*	B	Isolated β-bridge	trans	-54.2	137	167	24.6	-32.9	0	0	0	109.3
188	A	56.3	Low	42.7	Very low	7 Å²	7	116 Å²	116	6%	0.058	65%	0.649	C	S	.	*	P	Polyproline II helix	trans	-59.5	143.4	174.8	0	0	0	0	0	109.9	A186 Y226 W242 C244	A186-A188 PolarHBondContact O-N 3.1Å; A188-Y226 HydrophobicContact CB-CD1 3.78Å; A188-Y226 HydrophobicContact CB-CG 4.13Å; A188-Y226 WeakPolarHBondContact O-CD1 3.38Å; A188-W242 HydrophobicContact CB-CB 3.91Å; A188-W242 WeakPolarHBondContact CB-O 3.48Å; A188-W242 PolarHBondContact N-O 2.68Å; A188-C244 VanDerWaalsContact CA-SG 3.53Å
189	R	60.7	Low	43	Very low	185 Å²	185	114 Å²	114	70%	0.698	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.5	146.2	-178.4	-72	-171.1	178.9	-168.4	1.1	110	N191 Y226 E227	R189-N191 PolarHBondContact O-N 3.09Å; R189-Y226 CarbonylContact O-C 3.3Å; R189-Y226 VanDerWaalsContact O-CA 3.31Å; R189-Y226 WeakPolarHBondContact O-CA 3.18Å; R189-E227 PolarHBondContact N-O 2.72Å; R189-E227 PolarHBondContact O-N 2.78Å
190	L	59.6	Low	43.2	Very low	127 Å²	127	112.5 Å²	112.5	67%	0.665	65%	0.649	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-58.1	120.5	167.8	-105.8	130.9	0	0	0	109.3	P192 L225	L190-P192 WeakPolarHBondContact O-CD 3.42Å; L190-P192 VanDerWaalsContact O-N 3.15Å; L190-L225 CarbonylContact C-O 3.57Å; L190-L225 WeakPolarHBondContact CA-O 3.32Å; L190-L225 HydrophobicContact CD2-CD2 4.3Å
191	N	53	Low	43.3	Very low	16 Å²	16	114.2 Å²	114.2	9%	0.086	65%	0.647	C	S	.	*			trans	-64	112	178.8	-177	-11.9	0	0	0	109.2	R189 N193 V194 P224 L225	R189-N191 PolarHBondContact O-N 3.09Å; N191-N193 PolarHBondContact O-N 2.97Å; N191-N193 VanDerWaalsContact OD1-CB 3.29Å; N191-N193 WeakPolarHBondContact OD1-CB 3.25Å; N191-N193 PolarHBondContact OD1-N 2.96Å; N191-N193 PolarHBondContact OD1-ND2 3.42Å; N191-N193 VanDerWaalsContact OD1-ND2 3.14Å; N191-V194 HydrophobicContact CB-CG2 4.13Å; N191-V194 PolarHBondContact O-N 3.05Å; N191-V194 VanDerWaalsContact O-N 3.12Å; N191-P224 WeakPolarHBondContact CB-O 3.38Å; N191-P224 PolarHBondContact ND2-O 3.29Å; N191-L225 PolarHBondContact N-O 3.32Å
192	P	51.8	Low	43.5	Very low	111 Å²	111	118 Å²	118	72%	0.721	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-10	-176.3	27.5	-33.5	0	0	0	113	L190	L190-P192 WeakPolarHBondContact O-CD 3.42Å; L190-P192 VanDerWaalsContact O-N 3.15Å
193	N	48.9	Very low	43.7	Very low	133 Å²	133	119.8 Å²	119.8	71%	0.711	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-7.3	177.2	-59.3	-66.8	0	0	0	113.8	N191	N191-N193 PolarHBondContact O-N 2.97Å; N191-N193 VanDerWaalsContact OD1-CB 3.29Å; N191-N193 WeakPolarHBondContact OD1-CB 3.25Å; N191-N193 PolarHBondContact OD1-N 2.96Å; N191-N193 PolarHBondContact OD1-ND2 3.42Å; N191-N193 VanDerWaalsContact OD1-ND2 3.14Å
194	V	50.8	Low	43.6	Very low	51 Å²	51	123 Å²	123	31%	0.309	66%	0.658	S	S	.	*			trans	-99.3	107	177	-175.9	0	0	0	0	109.3	N191 P196 P224 L225	N191-V194 HydrophobicContact CB-CG2 4.13Å; N191-V194 PolarHBondContact O-N 3.05Å; N191-V194 VanDerWaalsContact O-N 3.12Å; V194-P196 WeakPolarHBondContact O-CD 3.28Å; V194-P224 HydrophobicContact CG2-CB 4.29Å; V194-P224 WeakPolarHBondContact CG2-O 3.06Å; V194-L225 HydrophobicContact CB-CD2 4.36Å; V194-L225 HydrophobicContact CG1-CD2 3.87Å
195	K	42	Very low	43.7	Very low	196 Å²	196	126.4 Å²	126.4	85%	0.852	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-70.7	120.7	169.1	-78.7	-177.2	179.1	175.9	0	108.5	S197	K195-S197 PolarHBondContact O-N 3.14Å
196	P	40.5	Very low	43.5	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-60.2	131.8	171	23	-29.3	0	0	0	108.9	V194	V194-P196 WeakPolarHBondContact O-CD 3.28Å
197	S	38.7	Very low	42.8	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.9	139.1	175.7	51.3	0	0	0	0	109.8	K195 A199	K195-S197 PolarHBondContact O-N 3.14Å; S197-A199 PolarHBondContact O-N 2.81Å
198	K	34.1	Very low	41.8	Very low	218 Å²	218	140.5 Å²	140.5	95%	0.948	72%	0.715	S	S	*	*	S	Bend	trans	-62	101.2	-170.4	-69.4	171	177.8	171.1	0	111.5
199	A	34.8	Very low	40.7	Very low	94 Å²	94	145 Å²	145	78%	0.777	75%	0.745	S	S	*	*			trans	-146.6	128	152	0	0	0	0	0	109.7	S197	S197-A199 PolarHBondContact O-N 2.81Å
200	S	35.2	Very low	39.4	Very low	131 Å²	131	141.3 Å²	141.3	92%	0.916	76%	0.755	S	S	*	*			trans	88.1	92.5	174.2	-127.4	0	0	0	0	118.4
201	R	30.1	Very low	38.4	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	76%	0.758	S	S	*	*			trans	-68.9	143	166.9	-64.6	171.3	172.9	176.5	-3.9	111.1
202	R	32.7	Very low	37.5	Very low	222 Å²	222	152.2 Å²	152.2	84%	0.838	79%	0.792	S	S	*	*				166.4	125.7	107.3	-96.1	179.7	173.1	172.1	-0.1	113.5
203	K	35.6	Very low	36.6	Very low	174 Å²	174	154.4 Å²	154.4	76%	0.757	80%	0.797	S	S	*	*			trans	87.5	111.3	145.2	-67.1	-179	177.9	-174.8	0	120.6
204	N	31.6	Very low	36	Very low	156 Å²	156	156.2 Å²	156.2	83%	0.834	81%	0.805	S	S	*	*			trans	49.8	93.2	138.2	-63.7	-8.7	0	0	0	119.3
205	I	35.2	Very low	35.1	Very low	168 Å²	168	158.5 Å²	158.5	86%	0.862	83%	0.83	S	S	*	*			trans	-139.7	133.5	151.9	-58.9	-178	0	0	0	108.9
206	H	37.6	Very low	35.1	Very low	189 Å²	189	158.2 Å²	158.2	88%	0.875	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-52.5	137.7	178.4	-87.1	-78.1	0	0	0	112.8
207	Q	33.4	Very low	35.7	Very low	186 Å²	186	156.7 Å²	156.7	87%	0.869	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-87.9	119.7	-177.5	-156.2	172.1	5.4	0	0	109.6
208	P	35.3	Very low	36.9	Very low	119 Å²	119	152.1 Å²	152.1	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.7	146.5	170	-9.2	25.9	0	0	0	110.4
209	S	32.9	Very low	38.7	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-63.8	148.6	-174.3	64.7	0	0	0	0	113.5	K211	S209-K211 PolarHBondContact O-N 3.31Å
210	A	33.6	Very low	40.7	Very low	108 Å²	108	144 Å²	144	89%	0.893	75%	0.747	S	S	*	*	S	Bend	trans	-72.5	53.2	-172.2	0	0	0	0	0	114.9
211	K	38.3	Very low	42.7	Very low	172 Å²	172	138 Å²	138	75%	0.748	71%	0.705	S	S	*	*			trans	-107	4.2	-178.6	-118.5	-177.9	178.3	-170.5	0	115.3	S209	S209-K211 PolarHBondContact O-N 3.31Å
212	Y	35.3	Very low	44.8	Very low	201 Å²	201	131.6 Å²	131.6	79%	0.788	69%	0.694	S	S	*	*			trans	-119.7	69.7	-179.4	-79.6	-89.4	0	0	0	112.1
213	L	32.2	Very low	46.7	Very low	157 Å²	157	123.3 Å²	123.3	82%	0.822	67%	0.666	S	S	*	*			trans	-144.9	68.8	169.2	-77.2	175.6	0	0	0	110.2
214	L	35.4	Very low	48.2	Very low	170 Å²	170	118 Å²	118	89%	0.89	65%	0.649	S	S	*	*	S	Bend	trans	-140.6	118.6	165.8	-77.7	172.9	0	0	0	110
215	A	33.4	Very low	50.1	Low	100 Å²	100	113.6 Å²	113.6	83%	0.826	63%	0.625	S	S	*	*			trans	59.8	76.9	160.9	0	0	0	0	0	118.2
216	Y	41	Very low	52	Low	190 Å²	190	107.6 Å²	107.6	75%	0.745	59%	0.592	S	S	*	*			trans	-113.3	119.9	144.4	-93.4	-95.9	0	0	0	107.6
217	S	53.6	Low	53.6	Low	82 Å²	82	100.3 Å²	100.3	57%	0.573	56%	0.559	S	S	*	*			trans	-96	131.2	161.3	-87.4	0	0	0	0	106.4	D230	S217-D230 VanDerWaalsContact C-CG 3.42Å; S217-D230 VanDerWaalsContact CB-CG 3.47Å; S217-D230 WeakPolarHBondContact CB-OD1 3.47Å; S217-D230 WeakPolarHBondContact CB-OD2 3.36Å; S217-D230 PolarHBondContact O-N 3.41Å
218	G	63.8	Low	55.7	Low	23 Å²	23	91.5 Å²	91.5	24%	0.237	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	157.7	179.7	0	0	0	0	0	111.3	V220 E227 C228 D230	G218-V220 PolarHBondContact O-N 2.69Å; G218-E227 VanDerWaalsContact CA-OE1 3.28Å; G218-E227 WeakPolarHBondContact CA-OE1 3.45Å; G218-E227 PolarHBondContact N-OE1 2.87Å; G218-C228 CarbonylContact C-O 3.37Å; G218-C228 WeakPolarHBondContact CA-O 3.16Å; G218-D230 PolarHBondContact N-OD1 3.41Å
219	V	71	Confident	57.5	Low	60 Å²	60	89 Å²	89	36%	0.364	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	108.8	172	-177.7	0	0	0	0	108	C221 C228 T232	V219-C221 PolarHBondContact O-N 3.48Å; V219-C228 HydrophobicContact CB-CB 4.4Å; V219-C228 PolarHBondContact N-O 2.7Å; V219-C228 PolarHBondContact O-N 2.05Å; V219-T232 VanDerWaalsContact CG2-O 3.31Å; V219-T232 WeakPolarHBondContact CG2-O 3.46Å
220	V	77	Confident	58.9	Low	81 Å²	81	88.8 Å²	88.8	49%	0.491	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.5	171.3	-178.2	0	0	0	0	108.5	G218	G218-V220 PolarHBondContact O-N 2.69Å
221	C	77.3	Confident	60.2	Low	5 Å²	5	89.5 Å²	89.5	3%	0.034	48%	0.481	C	S	.	.			trans	-77.1	161.7	177.9	-59.7	0	0	0	0	111.4	V219 D223 Y226 C234 W242	V219-C221 PolarHBondContact O-N 3.48Å; C221-D223 CarbonylContact O-C 3.51Å; C221-D223 VanDerWaalsContact O-C 3.23Å; C221-D223 PolarHBondContact O-N 3.11Å; C221-D223 VanDerWaalsContact O-O 3.1Å; C221-Y226 WeakPolarHBondContact CB-O 3.4Å; C221-Y226 PolarHBondContact N-O 2.73Å; C221-C234 WeakPolarHBondContact CA-SG 3.32Å; C221-C234 HydrophobicContact CB-CB 3.62Å; C221-C234 WeakPolarHBondContact CB-SG 3.05Å; C221-C234 PolarHBondContact N-SG 2.64Å; C221-C234 VanDerWaalsContact N-SG 3.42Å; C221-C234 WeakPolarHBondContact SG-CB 3.06Å; C221-C234 CovalentContact SG-SG 2.04Å; C221-C234 PolarHBondContact SG-SG 2.05Å; C221-W242 HydrophobicContact CB-CB 3.82Å; C221-W242 HydrophobicContact CB-CD2 3.59Å; C221-W242 HydrophobicContact CB-CE3 3.98Å; C221-W242 HydrophobicContact CB-CG 3.48Å; C221-W242 VanDerWaalsContact CB-CG 3.48Å
222	P	75.8	Confident	61.9	Low	101 Å²	101	82.4 Å²	82.4	66%	0.656	45%	0.452	S	S	*	.	S	Bend	trans	-55.9	-24.7	179.4	-28.1	35.2	0	0	0	114.5	P224 W242	P222-P224 WeakPolarHBondContact O-CD 3.07Å; P222-W242 HydrophobicContact CB-CH2 3.74Å; P222-W242 HydrophobicContact CB-CZ2 3.42Å; P222-W242 VanDerWaalsContact CB-CZ2 3.42Å; P222-W242 VanDerWaalsContact CD-CZ2 3.46Å; P222-W242 VanDerWaalsContact CD-CZ3 3.48Å; P222-W242 HydrophobicContact CG-CH2 3.24Å; P222-W242 HydrophobicContact CG-CZ2 3.49Å; P222-W242 VanDerWaalsContact CG-CZ2 3.49Å; P222-W242 HydrophobicContact CG-CZ3 3.83Å
223	D	72.6	Confident	63.7	Low	48 Å²	48	73.8 Å²	73.8	26%	0.257	42%	0.421	S	S	.	.	S	Bend	trans	-86.7	115.2	158.4	-176.8	-12.1	0	0	0	109.5	C221 L225 Y226 W242	C221-D223 CarbonylContact O-C 3.51Å; C221-D223 VanDerWaalsContact O-C 3.23Å; C221-D223 PolarHBondContact O-N 3.11Å; C221-D223 VanDerWaalsContact O-O 3.1Å; D223-L225 PolarHBondContact O-N 3.46Å; D223-L225 WeakPolarHBondContact OD1-CB 3.43Å; D223-L225 WeakPolarHBondContact OD1-CD1 2.95Å; D223-L225 WeakPolarHBondContact OD1-CG 3.4Å; D223-L225 PolarHBondContact OD1-N 3.28Å; D223-Y226 HydrophobicContact CB-CD2 3.95Å; D223-Y226 PolarHBondContact O-N 2.89Å; D223-Y226 WeakPolarHBondContact OD2-CE2 3.07Å; D223-W242 VanDerWaalsContact CB-CD1 3.47Å
224	P	65.6	Low	66	Low	62 Å²	62	67 Å²	67	40%	0.403	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.1	-179.7	-20.2	29.9	0	0	0	114.1	N191 V194 P222 Y226	N191-P224 WeakPolarHBondContact CB-O 3.38Å; N191-P224 PolarHBondContact ND2-O 3.29Å; V194-P224 HydrophobicContact CG2-CB 4.29Å; V194-P224 WeakPolarHBondContact CG2-O 3.06Å; P222-P224 WeakPolarHBondContact O-CD 3.07Å; P224-Y226 PolarHBondContact O-N 2.73Å
225	L	72.6	Confident	68	Low	63 Å²	63	60.4 Å²	60.4	33%	0.33	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-15	173.9	-69.8	163.6	0	0	0	112.5	L190 N191 V194 D223	L190-L225 CarbonylContact C-O 3.57Å; L190-L225 WeakPolarHBondContact CA-O 3.32Å; L190-L225 HydrophobicContact CD2-CD2 4.3Å; N191-L225 PolarHBondContact N-O 3.32Å; V194-L225 HydrophobicContact CB-CD2 4.36Å; V194-L225 HydrophobicContact CG1-CD2 3.87Å; D223-L225 PolarHBondContact O-N 3.46Å; D223-L225 WeakPolarHBondContact OD1-CB 3.43Å; D223-L225 WeakPolarHBondContact OD1-CD1 2.95Å; D223-L225 WeakPolarHBondContact OD1-CG 3.4Å; D223-L225 PolarHBondContact OD1-N 3.28Å
226	Y	74.2	Confident	69.9	Low	42 Å²	42	60.5 Å²	60.5	17%	0.165	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.9	-172.5	-68.4	-80.6	0	0	0	112.6	A188 R189 C221 D223 P224 W242	A188-Y226 HydrophobicContact CB-CD1 3.78Å; A188-Y226 HydrophobicContact CB-CG 4.13Å; A188-Y226 WeakPolarHBondContact O-CD1 3.38Å; R189-Y226 CarbonylContact O-C 3.3Å; R189-Y226 VanDerWaalsContact O-CA 3.31Å; R189-Y226 WeakPolarHBondContact O-CA 3.18Å; C221-Y226 WeakPolarHBondContact CB-O 3.4Å; C221-Y226 PolarHBondContact N-O 2.73Å; D223-Y226 HydrophobicContact CB-CD2 3.95Å; D223-Y226 PolarHBondContact O-N 2.89Å; D223-Y226 WeakPolarHBondContact OD2-CE2 3.07Å; P224-Y226 PolarHBondContact O-N 2.73Å; Y226-W242 HydrophobicContact CD2-CB 4.43Å; Y226-W242 AromaticContact CD2-CD1 3.67Å; Y226-W242 HydrophobicContact CD2-CG 4.43Å; Y226-W242 HydrophobicContact CG-CB 4.01Å; Y226-W242 HydrophobicContact CG-CG 4.41Å
227	E	72	Confident	71.1	Confident	36 Å²	36	53.5 Å²	53.5	17%	0.168	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.9	176.7	-173.3	179.4	172.6	0	0	110.8	R189 G218	R189-E227 PolarHBondContact N-O 2.72Å; R189-E227 PolarHBondContact O-N 2.78Å; G218-E227 VanDerWaalsContact CA-OE1 3.28Å; G218-E227 WeakPolarHBondContact CA-OE1 3.45Å; G218-E227 PolarHBondContact N-OE1 2.87Å
228	C	78	Confident	71.5	Confident	1 Å²	1	55 Å²	55	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142.6	177.7	-75.5	0	0	0	0	110.8	G218 V219 T232 C234 C244	G218-C228 CarbonylContact C-O 3.37Å; G218-C228 WeakPolarHBondContact CA-O 3.16Å; V219-C228 HydrophobicContact CB-CB 4.4Å; V219-C228 PolarHBondContact N-O 2.7Å; V219-C228 PolarHBondContact O-N 2.05Å; C228-T232 WeakPolarHBondContact CB-OG1 3.42Å; C228-C234 VanDerWaalsContact SG-SG 3.63Å; C228-C244 WeakPolarHBondContact CA-SG 2.95Å; C228-C244 HydrophobicContact CB-CB 3.68Å; C228-C244 WeakPolarHBondContact CB-SG 3.34Å; C228-C244 WeakPolarHBondContact SG-CA 3.3Å; C228-C244 WeakPolarHBondContact SG-CB 3.47Å; C228-C244 CovalentContact SG-SG 2.03Å; C228-C244 PolarHBondContact SG-SG 2.82Å
229	P	71.9	Confident	71.5	Confident	67 Å²	67	58.9 Å²	58.9	44%	0.435	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	154.4	179.5	23.9	-31.5	0	0	0	112.1	N231 T232	P229-N231 PolarHBondContact O-N 3.49Å; P229-T232 WeakPolarHBondContact CD-OG1 3.39Å; P229-T232 HydrophobicContact CG-CG2 4.14Å; P229-T232 PolarHBondContact O-N 2.98Å; P229-T232 VanDerWaalsContact O-N 3.11Å; P229-T232 PolarHBondContact O-OG1 2.93Å
230	D	62.5	Low	70.9	Confident	95 Å²	95	65 Å²	65	51%	0.508	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	142	168.6	-75.4	-21.9	0	0	0	111.1	S217 G218	S217-D230 VanDerWaalsContact C-CG 3.42Å; S217-D230 VanDerWaalsContact CB-CG 3.47Å; S217-D230 WeakPolarHBondContact CB-OD1 3.47Å; S217-D230 WeakPolarHBondContact CB-OD2 3.36Å; S217-D230 PolarHBondContact O-N 3.41Å; G218-D230 PolarHBondContact N-OD1 3.41Å
231	N	61.6	Low	70.5	Confident	123 Å²	123	66.5 Å²	66.5	66%	0.658	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	15.3	-171.6	-64.8	-8.2	0	0	0	116.9	P229	P229-N231 PolarHBondContact O-N 3.49Å
232	T	74.1	Confident	70.5	Confident	23 Å²	23	68.9 Å²	68.9	14%	0.141	39%	0.386	C	S	.	.			trans	-123.1	159.5	166.9	62.2	0	0	0	0	111.9	V219 C228 P229 C244 C245	V219-T232 VanDerWaalsContact CG2-O 3.31Å; V219-T232 WeakPolarHBondContact CG2-O 3.46Å; C228-T232 WeakPolarHBondContact CB-OG1 3.42Å; P229-T232 WeakPolarHBondContact CD-OG1 3.39Å; P229-T232 HydrophobicContact CG-CG2 4.14Å; P229-T232 PolarHBondContact O-N 2.98Å; P229-T232 VanDerWaalsContact O-N 3.11Å; P229-T232 PolarHBondContact O-OG1 2.93Å; T232-C244 HydrophobicContact CG2-CB 4.48Å; T232-C245 CarbonylContact C-O 3.59Å; T232-C245 VanDerWaalsContact CA-O 3.25Å; T232-C245 WeakPolarHBondContact CA-O 3.31Å; T232-C245 WeakPolarHBondContact CB-O 3.36Å
233	T	72.7	Confident	70.6	Confident	21 Å²	21	64.7 Å²	64.7	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.2	176.8	30.3	0	0	0	0	110.1	C235 C244 C245 I247 Q249	T233-C235 PolarHBondContact O-N 3.15Å; T233-C244 CarbonylContact O-C 3.35Å; T233-C245 PolarHBondContact N-O 2.92Å; T233-C245 PolarHBondContact O-N 3.4Å; T233-C245 PolarHBondContact OG1-O 3.26Å; T233-C245 VanDerWaalsContact OG1-O 3.1Å; T233-I247 HydrophobicContact CG2-CB 4.31Å; T233-I247 HydrophobicContact CG2-CD1 4.45Å; T233-I247 HydrophobicContact CG2-CG1 3.86Å; T233-I247 HydrophobicContact CG2-CG2 4.22Å; T233-I247 WeakPolarHBondContact OG1-CA 3.41Å; T233-I247 PolarHBondContact OG1-N 2.75Å; T233-Q249 HydrophobicContact CG2-CG 4.27Å
234	C	79.3	Confident	70.8	Confident	13 Å²	13	62.7 Å²	62.7	9%	0.088	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.8	172.4	-65.7	0	0	0	0	111.2	C221 C228 W242 A243	C221-C234 WeakPolarHBondContact CA-SG 3.32Å; C221-C234 HydrophobicContact CB-CB 3.62Å; C221-C234 WeakPolarHBondContact CB-SG 3.05Å; C221-C234 PolarHBondContact N-SG 2.64Å; C221-C234 VanDerWaalsContact N-SG 3.42Å; C221-C234 WeakPolarHBondContact SG-CB 3.06Å; C221-C234 CovalentContact SG-SG 2.04Å; C221-C234 PolarHBondContact SG-SG 2.05Å; C228-C234 VanDerWaalsContact SG-SG 3.63Å; C234-W242 HydrophobicContact CB-CD2 4.48Å; C234-W242 HydrophobicContact CB-CE3 3.61Å; C234-W242 HydrophobicContact CB-CZ3 3.99Å; C234-A243 CarbonylContact C-O 3.43Å; C234-A243 WeakPolarHBondContact CA-O 3.47Å
235	C	77.5	Confident	71.4	Confident	32 Å²	32	61.6 Å²	61.6	22%	0.216	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.1	179.3	-64.2	0	0	0	0	109.8	T233 S237 W242 A243 C245	T233-C235 PolarHBondContact O-N 3.15Å; C235-S237 PolarHBondContact O-N 1.99Å; C235-W242 WeakPolarHBondContact O-CA 3.36Å; C235-A243 PolarHBondContact N-O 3.04Å; C235-A243 PolarHBondContact O-N 2.83Å; C235-C245 HydrophobicContact CB-CB 4.31Å; C235-C245 WeakPolarHBondContact CB-SG 3.03Å; C235-C245 WeakPolarHBondContact SG-CB 3.27Å; C235-C245 CovalentContact SG-SG 2.01Å; C235-C245 PolarHBondContact SG-SG 2.83Å
236	S	74.2	Confident	71.1	Confident	102 Å²	102	62.5 Å²	62.5	71%	0.713	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	124.3	167.6	146.5	0	0	0	0	108.7
237	S	65.7	Low	70.1	Confident	44 Å²	44	65 Å²	65	31%	0.308	37%	0.368	S	S	.	.			trans	-87.8	164.9	164.7	-168.8	0	0	0	0	109.9	C235 D239 K241	C235-S237 PolarHBondContact O-N 1.99Å; S237-D239 PolarHBondContact O-N 3Å; S237-D239 VanDerWaalsContact O-N 3.09Å; S237-K241 WeakPolarHBondContact CB-O 3.35Å; S237-K241 PolarHBondContact N-O 3.16Å
238	S	63	Low	68.8	Low	112 Å²	112	68.1 Å²	68.1	78%	0.783	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-19.1	176.3	53.2	0	0	0	0	114.4
239	D	63.3	Low	66.8	Low	106 Å²	106	75.4 Å²	75.4	57%	0.567	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	23.4	-170.7	-57.3	-6.9	0	0	0	113.2	S237 K241	S237-D239 PolarHBondContact O-N 3Å; S237-D239 VanDerWaalsContact O-N 3.09Å; D239-K241 PolarHBondContact O-N 3.31Å
240	E	57.9	Low	65	Low	188 Å²	188	78.1 Å²	78.1	88%	0.879	44%	0.441	S	S	*	.	S	Bend	trans	57.2	10.6	-171.4	-59.7	-172.8	159	0	0	114.8
241	K	68.9	Low	63.6	Low	112 Å²	112	79.6 Å²	79.6	49%	0.487	45%	0.453	S	S	.	.			trans	-99.6	157.2	177	-67.6	172.3	-173.6	163.7	0	111.1	S237 D239	S237-K241 WeakPolarHBondContact CB-O 3.35Å; S237-K241 PolarHBondContact N-O 3.16Å; D239-K241 PolarHBondContact O-N 3.31Å
242	W	77.2	Confident	62.1	Low	56 Å²	56	79 Å²	79	21%	0.212	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	136.1	176.2	-66.4	90	0	0	0	112.1	A188 C221 P222 D223 Y226 C234 C235	A188-W242 HydrophobicContact CB-CB 3.91Å; A188-W242 WeakPolarHBondContact CB-O 3.48Å; A188-W242 PolarHBondContact N-O 2.68Å; C221-W242 HydrophobicContact CB-CB 3.82Å; C221-W242 HydrophobicContact CB-CD2 3.59Å; C221-W242 HydrophobicContact CB-CE3 3.98Å; C221-W242 HydrophobicContact CB-CG 3.48Å; C221-W242 VanDerWaalsContact CB-CG 3.48Å; P222-W242 HydrophobicContact CB-CH2 3.74Å; P222-W242 HydrophobicContact CB-CZ2 3.42Å; P222-W242 VanDerWaalsContact CB-CZ2 3.42Å; P222-W242 VanDerWaalsContact CD-CZ2 3.46Å; P222-W242 VanDerWaalsContact CD-CZ3 3.48Å; P222-W242 HydrophobicContact CG-CH2 3.24Å; P222-W242 HydrophobicContact CG-CZ2 3.49Å; P222-W242 VanDerWaalsContact CG-CZ2 3.49Å; P222-W242 HydrophobicContact CG-CZ3 3.83Å; D223-W242 VanDerWaalsContact CB-CD1 3.47Å; Y226-W242 HydrophobicContact CD2-CB 4.43Å; Y226-W242 AromaticContact CD2-CD1 3.67Å; Y226-W242 HydrophobicContact CD2-CG 4.43Å; Y226-W242 HydrophobicContact CG-CB 4.01Å; Y226-W242 HydrophobicContact CG-CG 4.41Å; C234-W242 HydrophobicContact CB-CD2 4.48Å; C234-W242 HydrophobicContact CB-CE3 3.61Å; C234-W242 HydrophobicContact CB-CZ3 3.99Å; C235-W242 WeakPolarHBondContact O-CA 3.36Å
243	A	77.1	Confident	60.1	Low	13 Å²	13	87.2 Å²	87.2	11%	0.107	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	156.7	170.4	0	0	0	0	0	110	C234 C235	C234-A243 CarbonylContact C-O 3.43Å; C234-A243 WeakPolarHBondContact CA-O 3.47Å; C235-A243 PolarHBondContact N-O 3.04Å; C235-A243 PolarHBondContact O-N 2.83Å
244	C	78	Confident	58.2	Low	5 Å²	5	94.3 Å²	94.3	3%	0.034	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	89.9	-175.7	-58.5	0	0	0	0	111.6	S185 A186 A188 C228 T232 T233	S185-C244 WeakPolarHBondContact CB-O 2.95Å; S185-C244 VanDerWaalsContact OG-C 3.27Å; S185-C244 PolarHBondContact OG-O 2.66Å; A186-C244 PolarHBondContact O-N 3.41Å; A188-C244 VanDerWaalsContact CA-SG 3.53Å; C228-C244 WeakPolarHBondContact CA-SG 2.95Å; C228-C244 HydrophobicContact CB-CB 3.68Å; C228-C244 WeakPolarHBondContact CB-SG 3.34Å; C228-C244 WeakPolarHBondContact SG-CA 3.3Å; C228-C244 WeakPolarHBondContact SG-CB 3.47Å; C228-C244 CovalentContact SG-SG 2.03Å; C228-C244 PolarHBondContact SG-SG 2.82Å; T232-C244 HydrophobicContact CG2-CB 4.48Å; T233-C244 CarbonylContact O-C 3.35Å
245	C	76.9	Confident	55.8	Low	39 Å²	39	97.3 Å²	97.3	26%	0.264	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.6	141.2	178.2	-59.3	0	0	0	0	113.2	S185 T232 T233 C235 I247	S185-C245 WeakPolarHBondContact OG-CA 3.47Å; T232-C245 CarbonylContact C-O 3.59Å; T232-C245 VanDerWaalsContact CA-O 3.25Å; T232-C245 WeakPolarHBondContact CA-O 3.31Å; T232-C245 WeakPolarHBondContact CB-O 3.36Å; T233-C245 PolarHBondContact N-O 2.92Å; T233-C245 PolarHBondContact O-N 3.4Å; T233-C245 PolarHBondContact OG1-O 3.26Å; T233-C245 VanDerWaalsContact OG1-O 3.1Å; C235-C245 HydrophobicContact CB-CB 4.31Å; C235-C245 WeakPolarHBondContact CB-SG 3.03Å; C235-C245 WeakPolarHBondContact SG-CB 3.27Å; C235-C245 CovalentContact SG-SG 2.01Å; C235-C245 PolarHBondContact SG-SG 2.83Å; C245-I247 PolarHBondContact O-N 3.01Å; C245-I247 VanDerWaalsContact O-N 3.09Å
246	P	68.2	Low	53.7	Low	82 Å²	82	102.1 Å²	102.1	53%	0.532	59%	0.59	S	S	.	*	S	Bend	trans	-64.6	109.2	158.1	27.4	-32.2	0	0	0	108.8	S185	S185-P246 WeakPolarHBondContact OG-CD 3.49Å
247	I	51.7	Low	51.8	Low	95 Å²	95	101.2 Å²	101.2	49%	0.487	58%	0.583	S	S	.	*	S	Bend	trans	-26.2	142.5	177	-46	-174.4	0	0	0	113.5	T233 C245	T233-I247 HydrophobicContact CG2-CB 4.31Å; T233-I247 HydrophobicContact CG2-CD1 4.45Å; T233-I247 HydrophobicContact CG2-CG1 3.86Å; T233-I247 HydrophobicContact CG2-CG2 4.22Å; T233-I247 WeakPolarHBondContact OG1-CA 3.41Å; T233-I247 PolarHBondContact OG1-N 2.75Å; C245-I247 PolarHBondContact O-N 3.01Å; C245-I247 VanDerWaalsContact O-N 3.09Å
248	P	45.2	Very low	50.5	Low	101 Å²	101	105.1 Å²	105.1	66%	0.656	60%	0.601	S	S	*	*			cis	-125.4	154.3	25.1	18.3	5.7	0	0	0	115.2	T250	P248-T250 PolarHBondContact O-N 3.12Å
249	Q	37	Very low	49.5	Very low	154 Å²	154	108.4 Å²	108.4	72%	0.72	60%	0.601	S	S	*	*			trans	-51.5	103.9	157.8	-66.9	179.5	-16	0	0	109.2	T233 V251	T233-Q249 HydrophobicContact CG2-CG 4.27Å; Q249-V251 PolarHBondContact O-N 3.43Å
250	T	33.1	Very low	48.2	Very low	125 Å²	125	106.2 Å²	106.2	77%	0.767	60%	0.598	S	S	*	*			trans	-66.8	116.6	154	45.2	0	0	0	0	106.1	P248 S252	P248-T250 PolarHBondContact O-N 3.12Å; T250-S252 PolarHBondContact O-N 2.58Å
251	V	33.3	Very low	47.3	Very low	125 Å²	125	103 Å²	103	76%	0.758	59%	0.586	S	S	*	*			trans	-55.9	124	166.5	-92.5	0	0	0	0	108.1	Q249 F253	Q249-V251 PolarHBondContact O-N 3.43Å; V251-F253 PolarHBondContact O-N 3.04Å
252	S	29.9	Very low	46	Very low	111 Å²	111	103.4 Å²	103.4	78%	0.776	59%	0.589	S	S	*	*			trans	-60.8	102.2	176.9	-33.1	0	0	0	0	109.1	T250 L254	T250-S252 PolarHBondContact O-N 2.58Å; S252-L254 VanDerWaalsContact C-N 3.31Å; S252-L254 PolarHBondContact O-N 2.84Å; S252-L254 VanDerWaalsContact O-N 3.14Å
253	F	32.5	Very low	44.3	Very low	195 Å²	195	108.2 Å²	108.2	86%	0.855	61%	0.612	S	S	*	*			trans	-76.3	91.9	157.7	-93.2	-86.9	0	0	0	107.5	V251 G255	V251-F253 PolarHBondContact O-N 3.04Å; F253-G255 PolarHBondContact O-N 3.37Å
254	L	32.7	Very low	42.5	Very low	170 Å²	170	111.6 Å²	111.6	89%	0.89	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	117.6	155.7	-75.3	163.6	0	0	0	107.5	S252	S252-L254 VanDerWaalsContact C-N 3.31Å; S252-L254 PolarHBondContact O-N 2.84Å; S252-L254 VanDerWaalsContact O-N 3.14Å
255	G	28.1	Very low	40.7	Very low	76 Å²	76	116.5 Å²	116.5	78%	0.784	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.6	-16.4	163.6	0	0	0	0	0	119.7	F253	F253-G255 PolarHBondContact O-N 3.37Å
256	V	33.3	Very low	38.9	Very low	134 Å²	134	121.5 Å²	121.5	81%	0.812	68%	0.679	S	S	*	*			trans	-128.7	119.1	179.8	-172.2	0	0	0	0	110.4	D258	V256-D258 PolarHBondContact O-N 3.37Å
257	S	36	Very low	37.6	Very low	82 Å²	82	125.6 Å²	125.6	57%	0.573	69%	0.691	S	S	*	*			trans	-64.3	133.2	179.4	72.8	0	0	0	0	111.5	K259 A260	S257-K259 PolarHBondContact O-N 2.04Å; S257-A260 PolarHBondContact O-N 3.44Å
258	D	38.4	Very low	37	Very low	127 Å²	127	128 Å²	128	68%	0.679	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	-14.7	173.9	-103.4	-42.8	0	0	0	115.5	V256 A260	V256-D258 PolarHBondContact O-N 3.37Å; D258-A260 PolarHBondContact O-N 2.02Å
259	K	40.5	Very low	36.6	Very low	181 Å²	181	131.6 Å²	131.6	79%	0.787	71%	0.712	S	S	*	*	H	α-helix	trans	-76	-18.2	-177.8	-73	-177	176.8	178.7	0	115.1	S257	S257-K259 PolarHBondContact O-N 2.04Å
260	A	36.5	Very low	36.6	Very low	60 Å²	60	129 Å²	129	50%	0.496	71%	0.711	S	S	.	*	H	α-helix	trans	-91.4	-24.5	-178.8	0	0	0	0	0	113.5	S257 D258	S257-A260 PolarHBondContact O-N 3.44Å; D258-A260 PolarHBondContact O-N 2.02Å
261	L	39.3	Very low	36.7	Very low	119 Å²	119	130.7 Å²	130.7	62%	0.623	72%	0.715	S	S	*	*	H	α-helix	trans	-84.1	-34.5	179.9	-169.6	63.2	0	0	0	112	K263 S264	L261-K263 VanDerWaalsContact C-N 3.31Å; L261-K263 PolarHBondContact O-N 3.43Å; L261-S264 PolarHBondContact O-N 2.99Å
262	H	42.1	Very low	36.7	Very low	122 Å²	122	133.8 Å²	133.8	57%	0.565	72%	0.719	S	S	*	*	H	α-helix	trans	-64.6	-32.2	174.6	-100.1	-89.7	0	0	0	113.4	S264 L265 E266	H262-S264 VanDerWaalsContact C-N 3.34Å; H262-S264 PolarHBondContact O-N 3.26Å; H262-L265 PolarHBondContact O-N 2.64Å; H262-E266 PolarHBondContact O-N 3.49Å
263	K	40.8	Very low	37	Very low	157 Å²	157	136.2 Å²	136.2	68%	0.683	72%	0.723	S	S	*	*	H	α-helix	trans	-73.6	-23.2	-177.2	-143.5	176.2	-173.3	-179	0	113.9	L261	L261-K263 VanDerWaalsContact C-N 3.31Å; L261-K263 PolarHBondContact O-N 3.43Å
264	S	38.1	Very low	37.1	Very low	84 Å²	84	131.5 Å²	131.5	59%	0.587	71%	0.714	S	S	*	*	H	α-helix	trans	-87.9	-19.5	175.8	-61.6	0	0	0	0	113	L261 H262	L261-S264 PolarHBondContact O-N 2.99Å; H262-S264 VanDerWaalsContact C-N 3.34Å; H262-S264 PolarHBondContact O-N 3.26Å
265	L	41.8	Very low	37	Very low	108 Å²	108	128.5 Å²	128.5	57%	0.565	71%	0.708	S	S	*	*	H	α-helix	trans	-87.3	-23.6	176.6	-92.6	148	0	0	0	113.1	H262	H262-L265 PolarHBondContact O-N 2.64Å
266	E	37.8	Very low	37	Very low	143 Å²	143	135 Å²	135	67%	0.668	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-73.2	-22.7	176.7	-79.7	-176.2	159	0	0	114.5	H262 L268	H262-E266 PolarHBondContact O-N 3.49Å; E266-L268 VanDerWaalsContact C-N 3.28Å; E266-L268 PolarHBondContact O-N 3.28Å
267	Q	41.8	Very low	36.7	Very low	168 Å²	168	133.9 Å²	133.9	79%	0.785	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-78.2	-6.6	-179.6	-74.6	-169.3	-23.2	0	0	114.6
268	L	38.6	Very low	36.4	Very low	147 Å²	147	136.6 Å²	136.6	77%	0.77	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-101.4	-5.7	-177.4	-74.9	163	0	0	0	114.3	E266	E266-L268 VanDerWaalsContact C-N 3.28Å; E266-L268 PolarHBondContact O-N 3.28Å
269	H	36.1	Very low	35.9	Very low	175 Å²	175	134.3 Å²	134.3	81%	0.81	72%	0.72	S	S	*	*	S	Bend	trans	-102.3	15.9	-175.4	-82.6	161.7	0	0	0	116
270	S	37.4	Very low	35.4	Very low	99 Å²	99	133 Å²	133	69%	0.692	72%	0.721	S	S	*	*			trans	-95.9	5.8	-173.2	100.1	0	0	0	0	117.6
271	N	36.1	Very low	35.3	Very low	161 Å²	161	140.2 Å²	140.2	86%	0.861	74%	0.742	S	S	*	*			trans	-112.6	84.1	178.7	-103.9	-24.2	0	0	0	112.8	N273	N271-N273 PolarHBondContact O-N 3.25Å
272	K	33.4	Very low	34.9	Very low	191 Å²	191	141.6 Å²	141.6	83%	0.83	75%	0.75	S	S	*	*			trans	-71.2	109	159.2	-71.2	-179.7	177.8	176.8	0	108.2
273	N	35.6	Very low	34.7	Very low	161 Å²	161	142.7 Å²	142.7	86%	0.861	76%	0.759	S	S	*	*			trans	155.8	92.4	151.8	-82.5	-15.8	0	0	0	108.8	N271	N271-N273 PolarHBondContact O-N 3.25Å
274	S	33.8	Very low	34.2	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	76%	0.758	S	S	*	*				175.5	129.6	127.2	-160.9	0	0	0	0	109.9	Y276	S274-Y276 VanDerWaalsContact OG-CE2 3.3Å; S274-Y276 WeakPolarHBondContact OG-CE2 3.35Å
275	S	31	Very low	33.9	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	78%	0.775	S	S	*	*			trans	-79.6	108.8	179.6	152.1	0	0	0	0	110.6
276	Y	28.5	Very low	33.7	Very low	211 Å²	211	149.9 Å²	149.9	83%	0.827	79%	0.789	S	S	*	*			trans	-147.6	133.8	158.6	-63.8	-73.1	0	0	0	111	S274	S274-Y276 VanDerWaalsContact OG-CE2 3.3Å; S274-Y276 WeakPolarHBondContact OG-CE2 3.35Å
277	S	27.7	Very low	33.3	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	80%	0.8	S	S	*	*			trans	-79.9	155	-176.1	148	0	0	0	0	113
278	V	28.8	Very low	32.9	Very low	139 Å²	139	152.3 Å²	152.3	84%	0.842	79%	0.794	S	S	*	*	S	Bend	trans	-10.8	137.5	167.2	-164.1	0	0	0	0	117.3
279	A	28.6	Very low	32.7	Very low	79 Å²	79	149 Å²	149	65%	0.653	78%	0.783	S	S	*	*	S	Bend	trans	95.8	120.6	168.7	0	0	0	0	0	115.3
280	N	30.3	Very low	32.4	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	79%	0.788	S	S	*	*			trans	85.7	76.3	172.6	-50.3	-40.1	0	0	0	117
281	F	33.4	Very low	32.5	Very low	213 Å²	213	150.1 Å²	150.1	93%	0.934	79%	0.785	S	S	*	*			trans	-124	101.2	141	-110.2	-90.6	0	0	0	109.2
282	N	31.1	Very low	32.8	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	79%	0.787	S	S	*	*			trans	-101.8	129.9	168.1	-159.5	8.4	0	0	0	104.6
283	L	38.4	Very low	33.7	Very low	146 Å²	146	142.8 Å²	142.8	76%	0.764	76%	0.761	S	S	*	*			trans	174.6	96.4	155	-94	156.3	0	0	0	109.6
284	T	31.1	Very low	35.2	Very low	106 Å²	106	137.7 Å²	137.7	65%	0.65	74%	0.736	S	S	*	*			trans	20.5	106.5	132.5	54.4	0	0	0	0	117.1
285	W	31.4	Very low	37.3	Very low	250 Å²	250	136.9 Å²	136.9	95%	0.947	72%	0.721	S	S	*	*			trans	178.9	52.3	138.2	-93.1	108.9	0	0	0	111.7
286	V	36.6	Very low	39.9	Very low	144 Å²	144	136.3 Å²	136.3	87%	0.873	71%	0.709	S	S	*	*			trans	-149.2	95.4	146.7	-176.2	0	0	0	0	106.8
287	R	30.5	Very low	42.8	Very low	237 Å²	237	126.5 Å²	126.5	89%	0.894	67%	0.671	S	S	*	*			trans	-104.3	145.6	168.3	-158	177.3	-174.7	175.9	1.4	106.1
288	L	33.4	Very low	45.7	Very low	125 Å²	125	125.9 Å²	125.9	65%	0.654	67%	0.665	S	S	*	*			trans	87.2	113.2	-169	-64	105.9	0	0	0	112.2
289	S	33.1	Very low	48.4	Very low	78 Å²	78	121.6 Å²	121.6	55%	0.545	64%	0.637	S	S	.	*			cis	-157.7	113.3	20.7	31.7	0	0	0	0	109.6	L291	S289-L291 PolarHBondContact O-N 3.21Å
290	I	30.5	Very low	50.8	Low	176 Å²	176	121 Å²	121	90%	0.903	63%	0.632	S	S	*	*			trans	-85.9	94.4	154.3	-58.7	173.8	0	0	0	105.2
291	L	39.5	Very low	53.1	Low	120 Å²	120	122 Å²	122	63%	0.628	63%	0.629	S	S	*	*			trans	-141.7	97.2	163.9	-101	147	0	0	0	104.7	S289 G293	S289-L291 PolarHBondContact O-N 3.21Å; L291-G293 PolarHBondContact O-N 3.36Å; L291-G293 VanDerWaalsContact O-N 3.08Å
292	N	42.4	Very low	55.6	Low	171 Å²	171	113.3 Å²	113.3	91%	0.914	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	116.5	167.6	-86.6	-8.1	0	0	0	108.1
293	G	52	Low	58.3	Low	27 Å²	27	112 Å²	112	28%	0.278	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	110.6	19.1	169.3	0	0	0	0	0	118.1	L291 S305 D306	L291-G293 PolarHBondContact O-N 3.36Å; L291-G293 VanDerWaalsContact O-N 3.08Å; G293-S305 CarbonylContact O-C 3.48Å; G293-S305 WeakPolarHBondContact O-CA 3.04Å; G293-S305 PolarHBondContact O-OG 2.04Å; G293-D306 VanDerWaalsContact C-CG 3.48Å; G293-D306 VanDerWaalsContact C-OD1 3.28Å; G293-D306 VanDerWaalsContact CA-OD2 3.3Å; G293-D306 WeakPolarHBondContact CA-OD2 2.91Å; G293-D306 PolarHBondContact O-N 3.19Å
294	T	66.8	Low	60.7	Low	54 Å²	54	105 Å²	105	33%	0.331	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.4	176.5	62.4	0	0	0	0	114.7	C304 D306	T294-C304 CarbonylContact C-O 3.52Å; T294-C304 WeakPolarHBondContact CA-O 3.37Å; T294-C304 WeakPolarHBondContact CB-O 3.01Å; T294-D306 WeakPolarHBondContact CA-OD1 2.95Å; T294-D306 PolarHBondContact N-OD1 3.14Å
295	Q	78.6	Confident	63.3	Low	80 Å²	80	102.1 Å²	102.1	37%	0.374	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.2	168.3	69.2	172.5	36	0	0	112.5	R303 C304 D306 C310	Q295-R303 WeakPolarHBondContact O-CA 3.41Å; Q295-C304 HydrophobicContact CG-CB 4.07Å; Q295-C304 PolarHBondContact N-O 3.42Å; Q295-C304 PolarHBondContact O-N 3.28Å; Q295-D306 PolarHBondContact N-OD1 2.9Å; Q295-C310 PolarHBondContact NE2-SG 3.02Å; Q295-C310 VanDerWaalsContact NE2-SG 3.38Å
296	L	85.6	Confident	65.6	Low	96 Å²	96	93.8 Å²	93.8	50%	0.503	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131.6	173.6	-162.5	73.4	0	0	0	109.6	A300 R303	L296-A300 HydrophobicContact CD2-CB 4Å; L296-R303 HydrophobicContact CD1-CG 4.03Å
297	C	89.1	Confident	67.8	Low	4 Å²	4	92.4 Å²	92.4	3%	0.027	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-74.7	163.1	177.1	-61.5	0	0	0	0	111.9	D299 A300 S302 C304 C310 W318	C297-D299 PolarHBondContact O-N 3.42Å; C297-A300 PolarHBondContact O-N 2.7Å; C297-S302 PolarHBondContact N-O 3.4Å; C297-C304 PolarHBondContact SG-SG 3.11Å; C297-C310 WeakPolarHBondContact CA-SG 3.44Å; C297-C310 HydrophobicContact CB-CB 3.7Å; C297-C310 WeakPolarHBondContact CB-SG 3.28Å; C297-C310 WeakPolarHBondContact SG-CB 3.33Å; C297-C310 CovalentContact SG-SG 2.04Å; C297-C310 PolarHBondContact SG-SG 3.31Å; C297-W318 HydrophobicContact CB-CB 3.99Å; C297-W318 HydrophobicContact CB-CD2 4.23Å; C297-W318 HydrophobicContact CB-CE3 4.28Å; C297-W318 HydrophobicContact CB-CG 4.14Å
298	P	87.7	Confident	70.7	Confident	99 Å²	99	84 Å²	84	64%	0.643	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.9	-176.3	-27.5	37.4	0	0	0	116.3	A300 W318	P298-A300 VanDerWaalsContact C-N 3.27Å; P298-W318 HydrophobicContact CB-CH2 3.87Å; P298-W318 HydrophobicContact CB-CZ2 3.53Å; P298-W318 HydrophobicContact CG-CE3 4.43Å; P298-W318 HydrophobicContact CG-CH2 3.4Å; P298-W318 VanDerWaalsContact CG-CH2 3.4Å; P298-W318 HydrophobicContact CG-CZ2 3.63Å; P298-W318 HydrophobicContact CG-CZ3 3.84Å
299	D	86.2	Confident	73.5	Confident	50 Å²	50	79.1 Å²	79.1	27%	0.267	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4	170.3	62.8	-2.4	0	0	0	114.6	C297 K301 S302 W318	C297-D299 PolarHBondContact O-N 3.42Å; D299-K301 PolarHBondContact O-N 3.25Å; D299-K301 PolarHBondContact OD1-N 2.91Å; D299-S302 PolarHBondContact OD1-N 3.12Å; D299-S302 PolarHBondContact OD2-OG 3.39Å; D299-W318 HydrophobicContact CB-CG 4.24Å; D299-W318 VanDerWaalsContact OD2-CD1 3.31Å
300	A	78.8	Confident	76.4	Confident	66 Å²	66	76.1 Å²	76.1	55%	0.545	41%	0.41	S	S	.	.	S	Bend	trans	56.8	12.1	-172.2	0	0	0	0	0	115.1	L296 C297 P298	L296-A300 HydrophobicContact CD2-CB 4Å; C297-A300 PolarHBondContact O-N 2.7Å; P298-A300 VanDerWaalsContact C-N 3.27Å
301	K	79.2	Confident	79.4	Confident	172 Å²	172	68.1 Å²	68.1	75%	0.748	37%	0.37	S	S	*	.	S	Bend	trans	-115.2	-45.4	-177.7	-71.2	-178.9	-178.5	179	0	111.7	D299	D299-K301 PolarHBondContact O-N 3.25Å; D299-K301 PolarHBondContact OD1-N 2.91Å
302	S	86.1	Confident	81.9	Confident	32 Å²	32	68.5 Å²	68.5	22%	0.224	37%	0.366	C	S	.	.			trans	-81.6	148.2	178	-71.5	0	0	0	0	111.8	C297 D299 W318	C297-S302 PolarHBondContact N-O 3.4Å; D299-S302 PolarHBondContact OD1-N 3.12Å; D299-S302 PolarHBondContact OD2-OG 3.39Å; S302-W318 WeakPolarHBondContact CB-O 3.34Å; S302-W318 PolarHBondContact OG-O 3.14Å
303	R	86.5	Confident	84.2	Confident	118 Å²	118	63.9 Å²	63.9	45%	0.445	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.9	-177.3	-47.7	177.3	-158.3	-91.8	-8.3	108.7	Q295 L296 C320	Q295-R303 WeakPolarHBondContact O-CA 3.41Å; L296-R303 HydrophobicContact CD1-CG 4.03Å; R303-C320 PolarHBondContact O-SG 2.9Å
304	C	88.8	Confident	85.8	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.007	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	154	174.8	-60.2	0	0	0	0	109.8	T294 Q295 C297 Q308 C310 C320	T294-C304 CarbonylContact C-O 3.52Å; T294-C304 WeakPolarHBondContact CA-O 3.37Å; T294-C304 WeakPolarHBondContact CB-O 3.01Å; Q295-C304 HydrophobicContact CG-CB 4.07Å; Q295-C304 PolarHBondContact N-O 3.42Å; Q295-C304 PolarHBondContact O-N 3.28Å; C297-C304 PolarHBondContact SG-SG 3.11Å; C304-Q308 HydrophobicContact CB-CB 3.84Å; C304-C310 PolarHBondContact SG-SG 2.77Å; C304-C320 WeakPolarHBondContact CA-SG 3.26Å; C304-C320 HydrophobicContact CB-CB 3.81Å; C304-C320 WeakPolarHBondContact CB-SG 3.42Å; C304-C320 WeakPolarHBondContact SG-CA 3.22Å; C304-C320 WeakPolarHBondContact SG-CB 3.38Å; C304-C320 CovalentContact SG-SG 2.03Å; C304-C320 PolarHBondContact SG-SG 2.88Å
305	S	85.5	Confident	86.8	Confident	45 Å²	45	71.3 Å²	71.3	32%	0.315	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	158.8	171.1	-177.2	0	0	0	0	111.5	G293 E307 Q308	G293-S305 CarbonylContact O-C 3.48Å; G293-S305 WeakPolarHBondContact O-CA 3.04Å; G293-S305 PolarHBondContact O-OG 2.04Å; S305-E307 PolarHBondContact O-N 3.06Å; S305-Q308 WeakPolarHBondContact O-CB 3.46Å; S305-Q308 PolarHBondContact O-N 2.83Å
306	D	79.6	Confident	87	Confident	74 Å²	74	69.3 Å²	69.3	40%	0.396	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-13.5	173.9	-60.5	-9.2	0	0	0	113.3	G293 T294 Q295 K324	G293-D306 VanDerWaalsContact C-CG 3.48Å; G293-D306 VanDerWaalsContact C-OD1 3.28Å; G293-D306 VanDerWaalsContact CA-OD2 3.3Å; G293-D306 WeakPolarHBondContact CA-OD2 2.91Å; G293-D306 PolarHBondContact O-N 3.19Å; T294-D306 WeakPolarHBondContact CA-OD1 2.95Å; T294-D306 PolarHBondContact N-OD1 3.14Å; Q295-D306 PolarHBondContact N-OD1 2.9Å; D306-K324 WeakPolarHBondContact O-CD 3.37Å; D306-K324 WeakPolarHBondContact O-CE 3.33Å; D306-K324 PolarHBondContact O-NZ 3.2Å
307	E	84.3	Confident	87.1	Confident	115 Å²	115	70.9 Å²	70.9	54%	0.537	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	9	173.7	-61.7	-54.8	132.3	0	0	113.5	S305 V323 K324	S305-E307 PolarHBondContact O-N 3.06Å; E307-V323 CarbonylContact O-C 3.52Å; E307-K324 PolarHBondContact O-N 3.01Å; E307-K324 VanDerWaalsContact O-N 3.15Å; E307-K324 IonicContact OE1-NZ 3.81Å; E307-K324 PolarHBondContact OE1-NZ 3.05Å
308	Q	91.9	Very high	87.2	Confident	62 Å²	62	73.8 Å²	73.8	29%	0.29	39%	0.386	S	S	.	.	S	Bend	trans	-123.6	160.5	179.8	-68.3	-178.4	-41.8	0	0	111.6	C304 S305 C320 C321	C304-Q308 HydrophobicContact CB-CB 3.84Å; S305-Q308 WeakPolarHBondContact O-CB 3.46Å; S305-Q308 PolarHBondContact O-N 2.83Å; Q308-C320 HydrophobicContact CB-CB 4.27Å; Q308-C321 CarbonylContact C-O 3.48Å; Q308-C321 WeakPolarHBondContact CA-O 3.32Å; Q308-C321 WeakPolarHBondContact CB-O 3.12Å
309	T	91.7	Very high	87.3	Confident	21 Å²	21	69.8 Å²	69.8	13%	0.129	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131	178.9	-52.7	0	0	0	0	111.6	C311 C320 C321 V323 N325 A326	T309-C311 PolarHBondContact O-N 2.82Å; T309-C320 CarbonylContact O-C 3.45Å; T309-C320 WeakPolarHBondContact O-CA 3.25Å; T309-C321 PolarHBondContact N-O 3.02Å; T309-C321 PolarHBondContact O-N 3.24Å; T309-V323 PolarHBondContact N-O 3.27Å; T309-V323 PolarHBondContact OG1-O 3.25Å; T309-N325 WeakPolarHBondContact OG1-CA 3.35Å; T309-N325 PolarHBondContact OG1-N 3.05Å; T309-A326 HydrophobicContact CG2-CB 4.2Å; T309-A326 PolarHBondContact OG1-N 3.39Å
310	C	93.3	Very high	87.6	Confident	15 Å²	15	69.8 Å²	69.8	10%	0.101	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	121.1	173.8	-68.5	0	0	0	0	110.4	Q295 C297 C304 W318 G319	Q295-C310 PolarHBondContact NE2-SG 3.02Å; Q295-C310 VanDerWaalsContact NE2-SG 3.38Å; C297-C310 WeakPolarHBondContact CA-SG 3.44Å; C297-C310 HydrophobicContact CB-CB 3.7Å; C297-C310 WeakPolarHBondContact CB-SG 3.28Å; C297-C310 WeakPolarHBondContact SG-CB 3.33Å; C297-C310 CovalentContact SG-SG 2.04Å; C297-C310 PolarHBondContact SG-SG 3.31Å; C304-C310 PolarHBondContact SG-SG 2.77Å; C310-W318 HydrophobicContact CB-CE3 3.76Å; C310-W318 HydrophobicContact CB-CZ3 4.01Å; C310-G319 WeakPolarHBondContact CA-O 3.27Å
311	C	94.1	Very high	88.3	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.9	176.6	-72.5	0	0	0	0	111.2	T309 W318 G319 C321 C328	T309-C311 PolarHBondContact O-N 2.82Å; C311-W318 CarbonylContact O-C 3.5Å; C311-W318 WeakPolarHBondContact O-CA 3.22Å; C311-G319 PolarHBondContact N-O 2.93Å; C311-G319 PolarHBondContact O-N 3.39Å; C311-C321 PolarHBondContact SG-SG 3.15Å; C311-C328 WeakPolarHBondContact CA-SG 3.39Å; C311-C328 HydrophobicContact CB-CB 3.67Å; C311-C328 WeakPolarHBondContact CB-SG 3.4Å; C311-C328 VanDerWaalsContact SG-CA 3.54Å; C311-C328 WeakPolarHBondContact SG-CB 3.31Å; C311-C328 CovalentContact SG-SG 2.03Å; C311-C328 PolarHBondContact SG-SG 3.48Å
312	K	92.4	Very high	88.9	Confident	127 Å²	127	63.9 Å²	63.9	55%	0.552	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.5	178	-163.9	175.2	-176.7	179.7	0	109.9	G316 G332	K312-G316 WeakPolarHBondContact CE-O 3.36Å; K312-G332 WeakPolarHBondContact O-CA 3.16Å
313	L	89.5	Confident	89	Confident	75 Å²	75	65 Å²	65	39%	0.393	35%	0.346	S	S	.	.			trans	-78.6	165.8	178.6	-62.9	169.9	0	0	0	111.3	T315 G316 E317 G332	L313-T315 PolarHBondContact O-N 3.49Å; L313-T315 VanDerWaalsContact O-N 3.14Å; L313-G316 PolarHBondContact O-N 2.67Å; L313-E317 PolarHBondContact N-O 3.31Å; L313-G332 WeakPolarHBondContact CA-O 3Å
314	K	86	Confident	89.1	Confident	131 Å²	131	64.4 Å²	64.4	57%	0.57	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.5	171.8	-72.1	-173.2	-177.5	166.8	0	113.7	G316 D331 G332 E333	K314-G316 PolarHBondContact O-N 3.4Å; K314-D331 WeakPolarHBondContact CD-O 3.3Å; K314-D331 WeakPolarHBondContact CE-O 3.23Å; K314-D331 WeakPolarHBondContact CG-O 3.39Å; K314-G332 PolarHBondContact N-O 2.87Å; K314-E333 HydrophobicContact CD-CG 4.04Å; K314-E333 WeakPolarHBondContact CD-OE1 3.43Å; K314-E333 VanDerWaalsContact CE-OE1 3.29Å; K314-E333 WeakPolarHBondContact CE-OE1 3.4Å; K314-E333 HydrophobicContact CG-CG 4.35Å; K314-E333 IonicContact NZ-OE1 3.67Å; K314-E333 PolarHBondContact NZ-OE1 2.77Å; K314-E333 IonicContact NZ-OE2 3.47Å; K314-E333 PolarHBondContact NZ-OE2 3.09Å
315	T	87	Confident	89	Confident	105 Å²	105	69.3 Å²	69.3	64%	0.644	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.4	179.2	58.1	0	0	0	0	113.4	L313 E317	L313-T315 PolarHBondContact O-N 3.49Å; L313-T315 VanDerWaalsContact O-N 3.14Å; T315-E317 VanDerWaalsContact C-N 3.33Å; T315-E317 PolarHBondContact OG1-N 3.36Å
316	G	83.9	Confident	89.3	Confident	38 Å²	38	67.7 Å²	67.7	39%	0.392	36%	0.362	S	S	.	.	S	Bend	trans	90.4	-10.3	-173.1	0	0	0	0	0	114.3	K312 L313 K314	K312-G316 WeakPolarHBondContact CE-O 3.36Å; L313-G316 PolarHBondContact O-N 2.67Å; K314-G316 PolarHBondContact O-N 3.4Å
317	E	87.1	Confident	89.9	Confident	129 Å²	129	66.9 Å²	66.9	60%	0.603	36%	0.36	S	S	*	.	S	Bend	trans	-76.9	165.4	173.9	-60.4	-179.1	146.2	0	0	111.7	L313 T315	L313-E317 PolarHBondContact N-O 3.31Å; T315-E317 VanDerWaalsContact C-N 3.33Å; T315-E317 PolarHBondContact OG1-N 3.36Å
318	W	92.6	Very high	90.4	Very high	65 Å²	65	64.1 Å²	64.1	25%	0.246	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.7	177.6	-70.8	80	0	0	0	111.9	C297 P298 D299 S302 C310 C311	C297-W318 HydrophobicContact CB-CB 3.99Å; C297-W318 HydrophobicContact CB-CD2 4.23Å; C297-W318 HydrophobicContact CB-CE3 4.28Å; C297-W318 HydrophobicContact CB-CG 4.14Å; P298-W318 HydrophobicContact CB-CH2 3.87Å; P298-W318 HydrophobicContact CB-CZ2 3.53Å; P298-W318 HydrophobicContact CG-CE3 4.43Å; P298-W318 HydrophobicContact CG-CH2 3.4Å; P298-W318 VanDerWaalsContact CG-CH2 3.4Å; P298-W318 HydrophobicContact CG-CZ2 3.63Å; P298-W318 HydrophobicContact CG-CZ3 3.84Å; D299-W318 HydrophobicContact CB-CG 4.24Å; D299-W318 VanDerWaalsContact OD2-CD1 3.31Å; S302-W318 WeakPolarHBondContact CB-O 3.34Å; S302-W318 PolarHBondContact OG-O 3.14Å; C310-W318 HydrophobicContact CB-CE3 3.76Å; C310-W318 HydrophobicContact CB-CZ3 4.01Å; C311-W318 CarbonylContact O-C 3.5Å; C311-W318 WeakPolarHBondContact O-CA 3.22Å
319	G	87.8	Confident	90.4	Very high	16 Å²	16	61.5 Å²	61.5	17%	0.165	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	172.7	172.2	0	0	0	0	0	112.5	C310 C311	C310-G319 WeakPolarHBondContact CA-O 3.27Å; C311-G319 PolarHBondContact N-O 2.93Å; C311-G319 PolarHBondContact O-N 3.39Å
320	C	93.5	Very high	90.3	Very high	50 Å²	50	65.9 Å²	65.9	34%	0.338	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.5	-177.3	-58.9	0	0	0	0	111.4	R303 C304 Q308 T309	R303-C320 PolarHBondContact O-SG 2.9Å; C304-C320 WeakPolarHBondContact CA-SG 3.26Å; C304-C320 HydrophobicContact CB-CB 3.81Å; C304-C320 WeakPolarHBondContact CB-SG 3.42Å; C304-C320 WeakPolarHBondContact SG-CA 3.22Å; C304-C320 WeakPolarHBondContact SG-CB 3.38Å; C304-C320 CovalentContact SG-SG 2.03Å; C304-C320 PolarHBondContact SG-SG 2.88Å; Q308-C320 HydrophobicContact CB-CB 4.27Å; T309-C320 CarbonylContact O-C 3.45Å; T309-C320 WeakPolarHBondContact O-CA 3.25Å
321	C	93.4	Very high	90	Very high	10 Å²	10	66.8 Å²	66.8	7%	0.068	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.9	169	-78.3	0	0	0	0	110.7	Q308 T309 C311 V323 A326 C335	Q308-C321 CarbonylContact C-O 3.48Å; Q308-C321 WeakPolarHBondContact CA-O 3.32Å; Q308-C321 WeakPolarHBondContact CB-O 3.12Å; T309-C321 PolarHBondContact N-O 3.02Å; T309-C321 PolarHBondContact O-N 3.24Å; C311-C321 PolarHBondContact SG-SG 3.15Å; C321-V323 PolarHBondContact O-N 3.3Å; C321-A326 HydrophobicContact CB-CB 3.72Å; C321-C335 HydrophobicContact CB-CB 3.83Å; C321-C335 WeakPolarHBondContact CB-SG 2.97Å; C321-C335 WeakPolarHBondContact SG-CB 3.25Å; C321-C335 CovalentContact SG-SG 2.02Å; C321-C335 PolarHBondContact SG-SG 3.48Å
322	P	91	Very high	89.7	Confident	103 Å²	103	66.9 Å²	66.9	67%	0.669	38%	0.378	S	S	*	.	S	Bend	trans	-73.2	3.1	-171.1	30	-36	0	0	0	114.3
323	V	88.4	Confident	89.4	Confident	57 Å²	57	66.8 Å²	66.8	35%	0.345	38%	0.38	S	S	.	.	S	Bend	trans	-120.8	140.1	176.6	-62.9	0	0	0	0	110	E307 T309 C321 A326 P337	E307-V323 CarbonylContact O-C 3.52Å; T309-V323 PolarHBondContact N-O 3.27Å; T309-V323 PolarHBondContact OG1-O 3.25Å; C321-V323 PolarHBondContact O-N 3.3Å; V323-A326 HydrophobicContact CG2-CB 3.61Å; V323-P337 HydrophobicContact CG2-CB 4.45Å
324	K	89	Confident	89.4	Confident	104 Å²	104	67.4 Å²	67.4	45%	0.452	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	138.1	173.9	-165.8	174.4	-165.1	154.5	0	110.5	D306 E307 A326	D306-K324 WeakPolarHBondContact O-CD 3.37Å; D306-K324 WeakPolarHBondContact O-CE 3.33Å; D306-K324 PolarHBondContact O-NZ 3.2Å; E307-K324 PolarHBondContact O-N 3.01Å; E307-K324 VanDerWaalsContact O-N 3.15Å; E307-K324 IonicContact OE1-NZ 3.81Å; E307-K324 PolarHBondContact OE1-NZ 3.05Å; K324-A326 PolarHBondContact O-N 3.49Å
325	N	87.9	Confident	89.6	Confident	104 Å²	104	62.9 Å²	62.9	56%	0.556	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	42.5	-176.9	-55.9	-29	0	0	0	114.3	T309 N338	T309-N325 WeakPolarHBondContact OG1-CA 3.35Å; T309-N325 PolarHBondContact OG1-N 3.05Å; N325-N338 HydrophobicContact CB-CB 4.29Å; N325-N338 VanDerWaalsContact O-CB 3.28Å; N325-N338 WeakPolarHBondContact O-CB 3.47Å
326	A	91.3	Very high	89.9	Confident	11 Å²	11	58 Å²	58	9%	0.091	34%	0.335	C	S	.	.			trans	-68	145	175.4	0	0	0	0	0	111.9	T309 C321 V323 K324 C335 C336	T309-A326 HydrophobicContact CG2-CB 4.2Å; T309-A326 PolarHBondContact OG1-N 3.39Å; C321-A326 HydrophobicContact CB-CB 3.72Å; V323-A326 HydrophobicContact CG2-CB 3.61Å; K324-A326 PolarHBondContact O-N 3.49Å; A326-C335 HydrophobicContact CB-CB 4.07Å; A326-C336 CarbonylContact C-O 3.43Å; A326-C336 VanDerWaalsContact CA-O 3.24Å; A326-C336 WeakPolarHBondContact CA-O 2.98Å
327	V	92.4	Very high	90.2	Very high	58 Å²	58	58.7 Å²	58.7	35%	0.352	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	111.2	164.8	-180	0	0	0	0	107.8	C329 C335 C336 Y340	V327-C329 PolarHBondContact O-N 3.11Å; V327-C335 CarbonylContact O-C 3.44Å; V327-C335 VanDerWaalsContact O-CA 3.3Å; V327-C335 WeakPolarHBondContact O-CA 3.4Å; V327-C336 HydrophobicContact CB-CB 4.27Å; V327-C336 PolarHBondContact N-O 2.89Å; V327-C336 PolarHBondContact O-N 2.77Å; V327-Y340 WeakPolarHBondContact CG2-O 3.3Å
328	C	93.7	Very high	90.3	Very high	56 Å²	56	58 Å²	58	38%	0.378	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	118.3	175.2	-49.6	0	0	0	0	109.4	C311	C311-C328 WeakPolarHBondContact CA-SG 3.39Å; C311-C328 HydrophobicContact CB-CB 3.67Å; C311-C328 WeakPolarHBondContact CB-SG 3.4Å; C311-C328 VanDerWaalsContact SG-CA 3.54Å; C311-C328 WeakPolarHBondContact SG-CB 3.31Å; C311-C328 CovalentContact SG-SG 2.03Å; C311-C328 PolarHBondContact SG-SG 3.48Å
329	C	92.3	Very high	89.9	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.054	34%	0.341	C	S	.	.			trans	-70.8	148.6	178	-56.8	0	0	0	0	110.5	V327 D331 G332 H334 C342 L344	V327-C329 PolarHBondContact O-N 3.11Å; C329-D331 WeakPolarHBondContact CB-OD1 3.02Å; C329-D331 PolarHBondContact O-N 2.97Å; C329-G332 PolarHBondContact O-N 3.06Å; C329-H334 HydrophobicContact CB-CB 4Å; C329-H334 WeakPolarHBondContact CB-O 3.4Å; C329-H334 PolarHBondContact N-O 2.8Å; C329-H334 VanDerWaalsContact SG-C 3.51Å; C329-H334 PolarHBondContact SG-O 2.77Å; C329-H334 VanDerWaalsContact SG-O 3.36Å; C329-C342 WeakPolarHBondContact CA-SG 3.35Å; C329-C342 HydrophobicContact CB-CB 3.58Å; C329-C342 WeakPolarHBondContact CB-SG 3.2Å; C329-C342 WeakPolarHBondContact SG-CB 3.27Å; C329-C342 CovalentContact SG-SG 2.02Å; C329-C342 PolarHBondContact SG-SG 3.4Å; C329-L344 HydrophobicContact CB-CD2 4Å
330	S	88.8	Confident	90.1	Very high	113 Å²	113	60 Å²	60	79%	0.79	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.6	-178.5	41.1	0	0	0	0	113.5	G332 L344	S330-G332 PolarHBondContact O-N 2.76Å; S330-L344 VanDerWaalsContact OG-CD1 3.27Å; S330-L344 WeakPolarHBondContact OG-CD1 3.08Å
331	D	88	Confident	89.8	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.182	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.2	170	69.5	3.4	0	0	0	113.3	K314 C329 E333 H334 L344	K314-D331 WeakPolarHBondContact CD-O 3.3Å; K314-D331 WeakPolarHBondContact CE-O 3.23Å; K314-D331 WeakPolarHBondContact CG-O 3.39Å; C329-D331 WeakPolarHBondContact CB-OD1 3.02Å; C329-D331 PolarHBondContact O-N 2.97Å; D331-E333 PolarHBondContact O-N 2.62Å; D331-E333 PolarHBondContact OD1-N 3.46Å; D331-H334 PolarHBondContact OD1-N 3.39Å; D331-H334 IonicContact OD1-ND1 2.68Å; D331-H334 IonicContact OD2-CE1 2.64Å; D331-H334 IonicContact OD2-CG 3.09Å; D331-H334 IonicContact OD2-ND1 3.53Å; D331-H334 PolarHBondContact OD2-ND1 2.88Å; D331-L344 HydrophobicContact CB-CD1 4.14Å; D331-L344 HydrophobicContact CB-CD2 3.75Å; D331-L344 WeakPolarHBondContact OD2-CD2 3.13Å
332	G	87.5	Confident	89.6	Confident	10 Å²	10	61.3 Å²	61.3	10%	0.103	36%	0.356	C	S	.	.	S	Bend	trans	65	13.2	-179.6	0	0	0	0	0	115.3	K312 L313 K314 C329 S330	K312-G332 WeakPolarHBondContact O-CA 3.16Å; L313-G332 WeakPolarHBondContact CA-O 3Å; K314-G332 PolarHBondContact N-O 2.87Å; C329-G332 PolarHBondContact O-N 3.06Å; S330-G332 PolarHBondContact O-N 2.76Å
333	E	86.2	Confident	89.5	Confident	125 Å²	125	58.5 Å²	58.5	58%	0.584	34%	0.335	S	S	*	.	S	Bend	trans	-118.5	-34.9	176.5	-82.6	175.9	-175.2	0	0	111.7	K314 D331	K314-E333 HydrophobicContact CD-CG 4.04Å; K314-E333 WeakPolarHBondContact CD-OE1 3.43Å; K314-E333 VanDerWaalsContact CE-OE1 3.29Å; K314-E333 WeakPolarHBondContact CE-OE1 3.4Å; K314-E333 HydrophobicContact CG-CG 4.35Å; K314-E333 IonicContact NZ-OE1 3.67Å; K314-E333 PolarHBondContact NZ-OE1 2.77Å; K314-E333 IonicContact NZ-OE2 3.47Å; K314-E333 PolarHBondContact NZ-OE2 3.09Å; D331-E333 PolarHBondContact O-N 2.62Å; D331-E333 PolarHBondContact OD1-N 3.46Å
334	H	88.7	Confident	89.3	Confident	89 Å²	89	59.5 Å²	59.5	41%	0.412	34%	0.338	S	S	.	.			trans	-102.2	154.9	-179.1	-62	93.2	0	0	0	111.4	C329 D331	C329-H334 HydrophobicContact CB-CB 4Å; C329-H334 WeakPolarHBondContact CB-O 3.4Å; C329-H334 PolarHBondContact N-O 2.8Å; C329-H334 VanDerWaalsContact SG-C 3.51Å; C329-H334 PolarHBondContact SG-O 2.77Å; C329-H334 VanDerWaalsContact SG-O 3.36Å; D331-H334 PolarHBondContact OD1-N 3.39Å; D331-H334 IonicContact OD1-ND1 2.68Å; D331-H334 IonicContact OD2-CE1 2.64Å; D331-H334 IonicContact OD2-CG 3.09Å; D331-H334 IonicContact OD2-ND1 3.53Å; D331-H334 PolarHBondContact OD2-ND1 2.88Å
335	C	91.7	Very high	88.8	Confident	36 Å²	36	59.9 Å²	59.9	24%	0.243	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	138.6	165.5	38.2	0	0	0	0	110.9	C321 A326 V327	C321-C335 HydrophobicContact CB-CB 3.83Å; C321-C335 WeakPolarHBondContact CB-SG 2.97Å; C321-C335 WeakPolarHBondContact SG-CB 3.25Å; C321-C335 CovalentContact SG-SG 2.02Å; C321-C335 PolarHBondContact SG-SG 3.48Å; A326-C335 HydrophobicContact CB-CB 4.07Å; V327-C335 CarbonylContact O-C 3.44Å; V327-C335 VanDerWaalsContact O-CA 3.3Å; V327-C335 WeakPolarHBondContact O-CA 3.4Å
336	C	93	Very high	88.2	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143	-178.6	-69.3	0	0	0	0	110.4	A326 V327 C342 C349	A326-C336 CarbonylContact C-O 3.43Å; A326-C336 VanDerWaalsContact CA-O 3.24Å; A326-C336 WeakPolarHBondContact CA-O 2.98Å; V327-C336 HydrophobicContact CB-CB 4.27Å; V327-C336 PolarHBondContact N-O 2.89Å; V327-C336 PolarHBondContact O-N 2.77Å; C336-C342 PolarHBondContact SG-SG 3.4Å; C336-C349 WeakPolarHBondContact CA-SG 3.09Å; C336-C349 HydrophobicContact CB-CB 3.7Å; C336-C349 WeakPolarHBondContact CB-SG 3Å; C336-C349 WeakPolarHBondContact SG-CA 3.48Å; C336-C349 WeakPolarHBondContact SG-CB 3.36Å; C336-C349 CovalentContact SG-SG 2.03Å; C336-C349 PolarHBondContact SG-SG 2.95Å
337	P	90.4	Very high	87.5	Confident	54 Å²	54	61 Å²	61	35%	0.351	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-62.5	156.5	172.8	22.7	-27.1	0	0	0	110.5	V323 G339 Y340	V323-P337 HydrophobicContact CG2-CB 4.45Å; P337-G339 PolarHBondContact O-N 2.81Å; P337-Y340 HydrophobicContact CB-CD2 4.37Å; P337-Y340 HydrophobicContact CG-CD2 3.65Å; P337-Y340 HydrophobicContact CG-CE2 3.93Å; P337-Y340 HydrophobicContact CG-CG 4.28Å; P337-Y340 PolarHBondContact O-N 2.01Å; P337-Y340 VanDerWaalsContact O-N 3.15Å
338	N	88.6	Confident	87.1	Confident	114 Å²	114	64.1 Å²	64.1	61%	0.61	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	132	179.3	-164.4	-1.7	0	0	0	111.5	N325	N325-N338 HydrophobicContact CB-CB 4.29Å; N325-N338 VanDerWaalsContact O-CB 3.28Å; N325-N338 WeakPolarHBondContact O-CB 3.47Å
339	G	84.9	Confident	86.8	Confident	39 Å²	39	63.6 Å²	63.6	40%	0.402	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	0.3	-177.4	0	0	0	0	0	115.7	P337 N352	P337-G339 PolarHBondContact O-N 2.81Å; G339-N352 PolarHBondContact O-N 3.26Å
340	Y	91.4	Very high	86.5	Confident	84 Å²	84	66.8 Å²	66.8	33%	0.329	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.3	172.6	-67.1	-104.1	0	0	0	110.9	V327 P337 C349 I350 K351	V327-Y340 WeakPolarHBondContact CG2-O 3.3Å; P337-Y340 HydrophobicContact CB-CD2 4.37Å; P337-Y340 HydrophobicContact CG-CD2 3.65Å; P337-Y340 HydrophobicContact CG-CE2 3.93Å; P337-Y340 HydrophobicContact CG-CG 4.28Å; P337-Y340 PolarHBondContact O-N 2.01Å; P337-Y340 VanDerWaalsContact O-N 3.15Å; Y340-C349 HydrophobicContact CD1-CB 3.85Å; Y340-C349 VanDerWaalsContact CD1-O 3.23Å; Y340-C349 WeakPolarHBondContact CD1-O 3.45Å; Y340-C349 HydrophobicContact CG-CB 4.07Å; Y340-I350 CarbonylContact C-O 3.23Å; Y340-I350 WeakPolarHBondContact CA-O 3.25Å; Y340-K351 HydrophobicContact CD1-CB 3.91Å; Y340-K351 HydrophobicContact CE1-CB 3.76Å; Y340-K351 HydrophobicContact CE1-CG 4.37Å
341	T	87.3	Confident	86	Confident	62 Å²	62	67.1 Å²	67.1	38%	0.38	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139.6	171	-63.2	0	0	0	0	108.7	D343 I350 N352	T341-D343 PolarHBondContact O-N 2.91Å; T341-I350 PolarHBondContact N-O 3.5Å; T341-I350 PolarHBondContact O-N 2.83Å; T341-N352 WeakPolarHBondContact CB-OD1 2.79Å; T341-N352 PolarHBondContact OG1-ND2 2.55Å; T341-N352 PolarHBondContact OG1-OD1 2.89Å
342	C	89.4	Confident	84.9	Confident	26 Å²	26	70.6 Å²	70.6	18%	0.176	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	117.3	176.4	-55.9	0	0	0	0	109.8	C329 C336 L344	C329-C342 WeakPolarHBondContact CA-SG 3.35Å; C329-C342 HydrophobicContact CB-CB 3.58Å; C329-C342 WeakPolarHBondContact CB-SG 3.2Å; C329-C342 WeakPolarHBondContact SG-CB 3.27Å; C329-C342 CovalentContact SG-SG 2.02Å; C329-C342 PolarHBondContact SG-SG 3.4Å; C336-C342 PolarHBondContact SG-SG 3.4Å; C342-L344 HydrophobicContact CB-CD2 4.37Å
343	D	88.1	Confident	82.8	Confident	43 Å²	43	74.9 Å²	74.9	23%	0.23	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	95.6	161.7	-171.3	-11.7	0	0	0	108.9	T341 S345 V346 G347 E348 I350	T341-D343 PolarHBondContact O-N 2.91Å; D343-S345 PolarHBondContact O-N 3.11Å; D343-S345 WeakPolarHBondContact OD1-CA 3.48Å; D343-S345 WeakPolarHBondContact OD1-CB 3.32Å; D343-S345 PolarHBondContact OD1-N 3.08Å; D343-S345 PolarHBondContact OD1-OG 3.22Å; D343-V346 PolarHBondContact O-N 3.47Å; D343-G347 PolarHBondContact O-N 3.47Å; D343-E348 PolarHBondContact N-O 3.14Å; D343-E348 PolarHBondContact O-N 2.64Å; D343-I350 HydrophobicContact CB-CD1 3.35Å; D343-I350 HydrophobicContact CB-CG1 3.59Å; D343-I350 WeakPolarHBondContact OD2-CD1 2.98Å
344	L	83.9	Confident	80.6	Confident	79 Å²	79	77.2 Å²	77.2	41%	0.414	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.9	178	-62.4	-174.1	0	0	0	113.1	C329 S330 D331 C342 V346	C329-L344 HydrophobicContact CB-CD2 4Å; S330-L344 VanDerWaalsContact OG-CD1 3.27Å; S330-L344 WeakPolarHBondContact OG-CD1 3.08Å; D331-L344 HydrophobicContact CB-CD1 4.14Å; D331-L344 HydrophobicContact CB-CD2 3.75Å; D331-L344 WeakPolarHBondContact OD2-CD2 3.13Å; C342-L344 HydrophobicContact CB-CD2 4.37Å; L344-V346 VanDerWaalsContact C-N 3.33Å
345	S	80.1	Confident	77.8	Confident	111 Å²	111	77.5 Å²	77.5	78%	0.776	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-34.3	178	-21	0	0	0	0	111.5	D343	D343-S345 PolarHBondContact O-N 3.11Å; D343-S345 WeakPolarHBondContact OD1-CA 3.48Å; D343-S345 WeakPolarHBondContact OD1-CB 3.32Å; D343-S345 PolarHBondContact OD1-N 3.08Å; D343-S345 PolarHBondContact OD1-OG 3.22Å
346	V	75.3	Confident	75.2	Confident	91 Å²	91	81 Å²	81	55%	0.552	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-17.3	-176.3	-167.6	0	0	0	0	111.2	D343 L344 E348	D343-V346 PolarHBondContact O-N 3.47Å; L344-V346 VanDerWaalsContact C-N 3.33Å; V346-E348 HydrophobicContact CB-CB 4.2Å; V346-E348 HydrophobicContact CB-CG 4.49Å; V346-E348 HydrophobicContact CG1-CB 4.06Å; V346-E348 HydrophobicContact CG1-CG 3.88Å
347	G	76.5	Confident	72.1	Confident	47 Å²	47	88.3 Å²	88.3	49%	0.485	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	22.8	-169.1	0	0	0	0	0	111.7	D343	D343-G347 PolarHBondContact O-N 3.47Å
348	E	82.6	Confident	69.3	Low	125 Å²	125	94.8 Å²	94.8	58%	0.584	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	152.6	-177.3	-77.2	-168	164.9	0	0	111.6	D343 V346	D343-E348 PolarHBondContact N-O 3.14Å; D343-E348 PolarHBondContact O-N 2.64Å; V346-E348 HydrophobicContact CB-CB 4.2Å; V346-E348 HydrophobicContact CB-CG 4.49Å; V346-E348 HydrophobicContact CG1-CB 4.06Å; V346-E348 HydrophobicContact CG1-CG 3.88Å
349	C	88.2	Confident	66.7	Low	44 Å²	44	94.1 Å²	94.1	30%	0.297	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	113.5	170.7	-64.8	0	0	0	0	108	C336 Y340	C336-C349 WeakPolarHBondContact CA-SG 3.09Å; C336-C349 HydrophobicContact CB-CB 3.7Å; C336-C349 WeakPolarHBondContact CB-SG 3Å; C336-C349 WeakPolarHBondContact SG-CA 3.48Å; C336-C349 WeakPolarHBondContact SG-CB 3.36Å; C336-C349 CovalentContact SG-SG 2.03Å; C336-C349 PolarHBondContact SG-SG 2.95Å; Y340-C349 HydrophobicContact CD1-CB 3.85Å; Y340-C349 VanDerWaalsContact CD1-O 3.23Å; Y340-C349 WeakPolarHBondContact CD1-O 3.45Å; Y340-C349 HydrophobicContact CG-CB 4.07Å
350	I	85.4	Confident	63.9	Low	75 Å²	75	101.4 Å²	101.4	39%	0.385	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.1	126.3	177.3	-58.5	-172.4	0	0	0	109.1	Y340 T341 D343 N352	Y340-I350 CarbonylContact C-O 3.23Å; Y340-I350 WeakPolarHBondContact CA-O 3.25Å; T341-I350 PolarHBondContact N-O 3.5Å; T341-I350 PolarHBondContact O-N 2.83Å; D343-I350 HydrophobicContact CB-CD1 3.35Å; D343-I350 HydrophobicContact CB-CG1 3.59Å; D343-I350 WeakPolarHBondContact OD2-CD1 2.98Å; I350-N352 PolarHBondContact O-N 3.31Å
351	K	80	Confident	60.8	Low	121 Å²	121	105.7 Å²	105.7	53%	0.526	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.2	122.9	175.7	-166.9	175.7	-176.2	178.2	0	108.8	Y340 S353	Y340-K351 HydrophobicContact CD1-CB 3.91Å; Y340-K351 HydrophobicContact CE1-CB 3.76Å; Y340-K351 HydrophobicContact CE1-CG 4.37Å; K351-S353 PolarHBondContact O-N 3.23Å; K351-S353 PolarHBondContact O-OG 3Å
352	N	64.2	Low	58.3	Low	106 Å²	106	111.4 Å²	111.4	57%	0.567	61%	0.606	S	S	*	*			trans	-55	106.3	179.8	-84.4	-18	0	0	0	110.7	G339 T341 I350	G339-N352 PolarHBondContact O-N 3.26Å; T341-N352 WeakPolarHBondContact CB-OD1 2.79Å; T341-N352 PolarHBondContact OG1-ND2 2.55Å; T341-N352 PolarHBondContact OG1-OD1 2.89Å; I350-N352 PolarHBondContact O-N 3.31Å
353	S	42.1	Very low	55.3	Low	100 Å²	100	114.3 Å²	114.3	70%	0.699	63%	0.627	S	S	*	*			trans	-132.3	65.2	176.5	34.9	0	0	0	0	108.5	K351	K351-S353 PolarHBondContact O-N 3.23Å; K351-S353 PolarHBondContact O-OG 3Å
354	H	40.6	Very low	52.6	Low	174 Å²	174	116.7 Å²	116.7	81%	0.806	65%	0.647	S	S	*	*			trans	-135.4	146.6	172.8	-81.3	-88.7	0	0	0	106.2
355	S	31.3	Very low	50.3	Low	96 Å²	96	120.1 Å²	120.1	67%	0.671	67%	0.666	S	S	*	*			cis	-177.4	132.8	4.1	47.1	0	0	0	0	105.4
356	S	35.6	Very low	47.8	Very low	110 Å²	110	119.6 Å²	119.6	77%	0.769	66%	0.658	S	S	*	*				-179.7	103.9	106.4	34.3	0	0	0	0	106.6
357	N	27.8	Very low	45.6	Very low	154 Å²	154	122.1 Å²	122.1	82%	0.824	67%	0.667	S	S	*	*				67.9	98.8	96.2	-76.2	-10.9	0	0	0	114.4
358	E	33.2	Very low	43.2	Very low	189 Å²	189	126.7 Å²	126.7	88%	0.883	68%	0.679	S	S	*	*				176.6	109.3	128	-94.1	170.9	177.8	0	0	114.2
359	S	32.3	Very low	40.6	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	69%	0.686	S	S	*	*			trans	65.1	106.9	133.9	-56.4	0	0	0	0	125.2
360	K	27.7	Very low	37.9	Very low	193 Å²	193	128 Å²	128	84%	0.839	70%	0.702	S	S	*	*			trans	70.2	138.9	133.1	-69.4	173.4	-177.8	172.5	0	118.9
361	K	25.8	Very low	35.3	Very low	173 Å²	173	131.8 Å²	131.8	75%	0.752	72%	0.723	S	S	*	*			cis	-170.1	144.9	31.3	-125.3	-177.9	-176.7	-178.7	0	111.7
362	F	33.7	Very low	32.9	Very low	183 Å²	183	132 Å²	132	80%	0.803	74%	0.737	S	S	*	*			trans	73.4	144	160.4	-79.7	-102.2	0	0	0	120.4
363	S	27.7	Very low	31.4	Very low	86 Å²	86	133.7 Å²	133.7	60%	0.601	74%	0.744	S	S	*	*			cis	-174.6	140.5	-17.7	-154	0	0	0	0	111.5
364	S	29.8	Very low	30.7	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	75%	0.754	S	S	*	*			trans	60.8	97	140	-56.3	0	0	0	0	121.7
365	N	35.7	Very low	30.4	Very low	151 Å²	151	136.1 Å²	136.1	81%	0.807	74%	0.744	S	S	*	*				156.4	141.9	107.8	-82.8	-9.9	0	0	0	108
366	T	28.4	Very low	30.3	Very low	100 Å²	100	135 Å²	135	61%	0.613	75%	0.748	S	S	*	*			cis	173.4	122.4	-1.2	-90	0	0	0	0	102.3
367	I	28.8	Very low	30.5	Very low	145 Å²	145	133.8 Å²	133.8	74%	0.744	74%	0.739	S	S	*	*			trans	59.7	122.3	140.4	-58.7	179.9	0	0	0	115
368	L	26.7	Very low	31.3	Very low	143 Å²	143	131.8 Å²	131.8	75%	0.749	73%	0.729	S	S	*	*			cis	175.3	161.7	24.1	-160.8	60.8	0	0	0	105.7
369	S	28.5	Very low	32.5	Very low	102 Å²	102	125 Å²	125	71%	0.713	71%	0.705	S	S	*	*			trans	65.4	136.6	151.3	45.3	0	0	0	0	118.1
370	S	31.2	Very low	34.4	Very low	93 Å²	93	125.8 Å²	125.8	65%	0.65	70%	0.701	S	S	*	*			cis	174	143.1	-7.9	43.2	0	0	0	0	106.9
371	L	29.8	Very low	36.9	Very low	155 Å²	155	116.7 Å²	116.7	81%	0.812	66%	0.661	S	S	*	*			trans	73.3	126.6	152.1	-84.3	79.1	0	0	0	120.1
372	P	29.5	Very low	39.5	Very low	126 Å²	126	112 Å²	112	82%	0.818	65%	0.649	S	S	*	*			trans	-83	126.1	177.4	34.4	-29.9	0	0	0	110.2	K374	P372-K374 PolarHBondContact O-N 2.95Å
373	I	32.5	Very low	41.5	Very low	142 Å²	142	111.6 Å²	111.6	73%	0.728	66%	0.655	S	S	*	*			trans	-87.3	111.1	177	-63.3	174.2	0	0	0	109	I375	I373-I375 HydrophobicContact CG2-CB 4.42Å; I373-I375 HydrophobicContact CG2-CD1 3.38Å; I373-I375 HydrophobicContact CG2-CG1 3.48Å; I373-I375 VanDerWaalsContact CG2-CG1 3.48Å; I373-I375 PolarHBondContact O-N 2.96Å
374	K	28.6	Very low	43.6	Very low	207 Å²	207	108.6 Å²	108.6	90%	0.9	63%	0.634	S	S	*	*			trans	-58.5	109.9	153.2	-83.1	-179.2	175.9	174.5	0	108.1	P372	P372-K374 PolarHBondContact O-N 2.95Å
375	I	34.7	Very low	45.4	Very low	118 Å²	118	111.2 Å²	111.2	61%	0.605	64%	0.641	S	S	*	*			trans	-129.3	106.8	156.2	-73.5	157.2	0	0	0	107	I373	I373-I375 HydrophobicContact CG2-CB 4.42Å; I373-I375 HydrophobicContact CG2-CD1 3.38Å; I373-I375 HydrophobicContact CG2-CG1 3.48Å; I373-I375 VanDerWaalsContact CG2-CG1 3.48Å; I373-I375 PolarHBondContact O-N 2.96Å
376	G	28.8	Very low	47.2	Very low	73 Å²	73	104.9 Å²	104.9	75%	0.753	61%	0.607	S	S	*	*			trans	-64	139.7	153	0	0	0	0	0	108.2
377	S	38.8	Very low	49.5	Very low	83 Å²	83	104.4 Å²	104.4	58%	0.58	60%	0.595	S	S	*	*	S	Bend	trans	94.6	107.2	-171.6	72	0	0	0	0	115.5
378	N	45.7	Very low	51.9	Low	112 Å²	112	97.6 Å²	97.6	60%	0.599	56%	0.56	S	S	*	*			trans	41.4	83.3	162	-61	-42.2	0	0	0	115.8	L380 D390	N378-L380 PolarHBondContact O-N 2.79Å; N378-D390 PolarHBondContact N-OD1 3.41Å; N378-D390 PolarHBondContact OD1-OD1 2.02Å
379	A	56.9	Low	53.9	Low	46 Å²	46	93.5 Å²	93.5	38%	0.38	54%	0.543	S	S	.	.			trans	-68.9	105.5	-179.8	0	0	0	0	0	111.9	C388	A379-C388 PolarHBondContact O-N 3.18Å
380	L	73.6	Confident	55.3	Low	118 Å²	118	93.6 Å²	93.6	62%	0.618	54%	0.536	S	S	*	.	B	Isolated β-bridge	trans	-68	131.2	158.5	-170.6	75.9	0	0	0	108.1	N378 S384	N378-L380 PolarHBondContact O-N 2.79Å; L380-S384 WeakPolarHBondContact CD1-O 3.19Å
381	C	80.5	Confident	57.1	Low	2 Å²	2	95.4 Å²	95.4	1%	0.014	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-69.7	143.9	177.7	-59.3	0	0	0	0	110.7	D383 S384 V386 C388 C394 W401	C381-D383 PolarHBondContact O-N 3.05Å; C381-S384 PolarHBondContact O-N 3.4Å; C381-V386 HydrophobicContact CB-CB 4.45Å; C381-V386 WeakPolarHBondContact CB-O 3.3Å; C381-V386 PolarHBondContact N-O 2.79Å; C381-V386 PolarHBondContact SG-O 3.28Å; C381-C388 PolarHBondContact SG-SG 2.97Å; C381-C394 WeakPolarHBondContact CA-SG 3.23Å; C381-C394 HydrophobicContact CB-CB 3.7Å; C381-C394 WeakPolarHBondContact CB-SG 2.99Å; C381-C394 WeakPolarHBondContact SG-CB 3.27Å; C381-C394 CovalentContact SG-SG 2.04Å; C381-C394 PolarHBondContact SG-SG 2.85Å; C381-W401 HydrophobicContact CB-CB 4.07Å; C381-W401 HydrophobicContact CB-CD2 3.61Å; C381-W401 HydrophobicContact CB-CE3 3.63Å; C381-W401 HydrophobicContact CB-CG 3.83Å; C381-W401 HydrophobicContact CB-CZ3 4.28Å
382	P	79.5	Confident	59.5	Low	75 Å²	75	88.8 Å²	88.8	49%	0.487	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	135.1	178.2	-24.7	31.9	0	0	0	111.7	S384 W401	P382-S384 PolarHBondContact O-N 2.92Å; P382-S384 VanDerWaalsContact O-N 3.08Å; P382-W401 HydrophobicContact CB-CH2 3.96Å; P382-W401 HydrophobicContact CB-CZ2 3.82Å; P382-W401 HydrophobicContact CG-CH2 3.78Å; P382-W401 HydrophobicContact CG-CZ2 4.16Å; P382-W401 HydrophobicContact CG-CZ3 4.46Å; P382-W401 WeakPolarHBondContact O-CZ2 3.13Å; P382-W401 PolarHBondContact O-NE1 2.98Å
383	D	75.2	Confident	62.3	Low	173 Å²	173	84.1 Å²	84.1	93%	0.925	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	34	176.3	-55.7	-40.9	0	0	0	115	C381	C381-D383 PolarHBondContact O-N 3.05Å
384	S	71.4	Confident	64.9	Low	24 Å²	24	78.7 Å²	78.7	17%	0.168	45%	0.448	C	S	.	.	S	Bend	trans	-146.4	150.3	-174.8	-163.1	0	0	0	0	114.2	L380 C381 P382 V386	L380-S384 WeakPolarHBondContact CD1-O 3.19Å; C381-S384 PolarHBondContact O-N 3.4Å; P382-S384 PolarHBondContact O-N 2.92Å; P382-S384 VanDerWaalsContact O-N 3.08Å; S384-V386 PolarHBondContact O-N 2.9Å; S384-V386 WeakPolarHBondContact OG-CB 3.34Å; S384-V386 VanDerWaalsContact OG-CG2 3.32Å; S384-V386 WeakPolarHBondContact OG-CG2 3Å; S384-V386 PolarHBondContact OG-N 2.9Å; S384-V386 VanDerWaalsContact OG-N 3.17Å
385	D	68.6	Low	67.8	Low	148 Å²	148	68.8 Å²	68.8	79%	0.791	41%	0.406	S	S	*	.	S	Bend	trans	-80.6	3.6	167.5	-55.7	-28.8	0	0	0	112.5
386	V	73.8	Confident	70.3	Confident	18 Å²	18	67.9 Å²	67.9	11%	0.109	40%	0.399	C	S	.	.			trans	-82.3	123.5	180	172.2	0	0	0	0	110.3	C381 S384 W401 P449	C381-V386 HydrophobicContact CB-CB 4.45Å; C381-V386 WeakPolarHBondContact CB-O 3.3Å; C381-V386 PolarHBondContact N-O 2.79Å; C381-V386 PolarHBondContact SG-O 3.28Å; S384-V386 PolarHBondContact O-N 2.9Å; S384-V386 WeakPolarHBondContact OG-CB 3.34Å; S384-V386 VanDerWaalsContact OG-CG2 3.32Å; S384-V386 WeakPolarHBondContact OG-CG2 3Å; S384-V386 PolarHBondContact OG-N 2.9Å; S384-V386 VanDerWaalsContact OG-N 3.17Å; V386-W401 HydrophobicContact CB-CB 3.82Å; V386-W401 HydrophobicContact CG1-CB 4.02Å; V386-W401 HydrophobicContact CG2-CB 3.9Å; V386-P449 HydrophobicContact CB-CB 4.16Å; V386-P449 HydrophobicContact CB-CG 4.27Å; V386-P449 HydrophobicContact CG1-CB 3.62Å; V386-P449 HydrophobicContact CG1-CG 3.66Å; V386-P449 HydrophobicContact CG2-CB 3.66Å; V386-P449 HydrophobicContact CG2-CG 3.58Å
387	Y	75.6	Confident	72.7	Confident	90 Å²	90	67.9 Å²	67.9	35%	0.353	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-107.7	137.6	171.4	70.3	-88.3	0	0	0	110.8	C403 K450	Y387-C403 PolarHBondContact O-SG 2.97Å; Y387-K450 HydrophobicContact CE1-CB 3.8Å; Y387-K450 WeakPolarHBondContact CE1-O 3.43Å; Y387-K450 HydrophobicContact CE2-CB 3.79Å; Y387-K450 HydrophobicContact CE2-CD 3.7Å; Y387-K450 HydrophobicContact CE2-CG 4.32Å; Y387-K450 WeakPolarHBondContact OH-CB 3.47Å; Y387-K450 WeakPolarHBondContact OH-CD 3.21Å
388	C	79	Confident	74.6	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.007	39%	0.387	C	S	.	.			trans	-108.1	142.4	173.6	-60.8	0	0	0	0	108.8	A379 C381 S392 C394 C403	A379-C388 PolarHBondContact O-N 3.18Å; C381-C388 PolarHBondContact SG-SG 2.97Å; C388-S392 VanDerWaalsContact CB-OG 3.22Å; C388-S392 WeakPolarHBondContact CB-OG 3.48Å; C388-C394 PolarHBondContact SG-SG 3.38Å; C388-C403 WeakPolarHBondContact CA-SG 3.38Å; C388-C403 HydrophobicContact CB-CB 3.82Å; C388-C403 WeakPolarHBondContact CB-SG 3.44Å; C388-C403 WeakPolarHBondContact SG-CA 3.46Å; C388-C403 WeakPolarHBondContact SG-CB 3.06Å; C388-C403 CovalentContact SG-SG 2.03Å; C388-C403 PolarHBondContact SG-SG 3.42Å
389	S	70.2	Confident	75.8	Confident	57 Å²	57	74.1 Å²	74.1	40%	0.399	40%	0.397	S	S	.	.			trans	-59.9	157.3	178.6	40.3	0	0	0	0	111.7	N391 S392	S389-N391 PolarHBondContact O-N 3.36Å; S389-S392 PolarHBondContact N-OG 3.34Å; S389-S392 PolarHBondContact O-N 3.03Å; S389-S392 PolarHBondContact O-OG 3.27Å; S389-S392 PolarHBondContact OG-OG 2.88Å
390	D	58	Low	76.7	Confident	105 Å²	105	79.7 Å²	79.7	56%	0.561	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	129.4	169.6	-64.6	-31.6	0	0	0	109.6	N378	N378-D390 PolarHBondContact N-OD1 3.41Å; N378-D390 PolarHBondContact OD1-OD1 2.02Å
391	N	67.5	Low	77.3	Confident	130 Å²	130	75.9 Å²	75.9	70%	0.695	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	17.7	-174.6	-103.3	21.2	0	0	0	118.7	S389 F406 P407	S389-N391 PolarHBondContact O-N 3.36Å; N391-F406 CarbonylContact O-C 3.39Å; N391-P407 WeakPolarHBondContact O-CA 3.4Å; N391-P407 WeakPolarHBondContact O-CD 2.99Å; N391-P407 VanDerWaalsContact O-N 3.13Å
392	S	81.7	Confident	77.4	Confident	16 Å²	16	76 Å²	76	11%	0.112	39%	0.392	C	S	.	.			trans	-110.8	155.6	170.4	46.2	0	0	0	0	113.5	C388 S389 C404	C388-S392 VanDerWaalsContact CB-OG 3.22Å; C388-S392 WeakPolarHBondContact CB-OG 3.48Å; S389-S392 PolarHBondContact N-OG 3.34Å; S389-S392 PolarHBondContact O-N 3.03Å; S389-S392 PolarHBondContact O-OG 3.27Å; S389-S392 PolarHBondContact OG-OG 2.88Å; S392-C404 CarbonylContact C-O 3.52Å; S392-C404 WeakPolarHBondContact CA-O 3.04Å; S392-C404 WeakPolarHBondContact CB-O 3.35Å
393	T	87	Confident	77.8	Confident	28 Å²	28	72.7 Å²	72.7	17%	0.172	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.6	-178.2	-50.3	0	0	0	0	110.7	C395 C403 C404 F406 N408 A409	T393-C395 PolarHBondContact O-SG 3.43Å; T393-C403 CarbonylContact O-C 3.41Å; T393-C404 PolarHBondContact N-O 2.03Å; T393-C404 WeakPolarHBondContact O-CB 3.05Å; T393-C404 PolarHBondContact O-N 3.43Å; T393-F406 PolarHBondContact N-O 2.72Å; T393-F406 PolarHBondContact OG1-O 3.43Å; T393-N408 WeakPolarHBondContact OG1-CA 3.48Å; T393-N408 PolarHBondContact OG1-N 3.25Å; T393-A409 HydrophobicContact CG2-CB 4.38Å; T393-A409 PolarHBondContact OG1-N 3.21Å
394	C	88.6	Confident	78.4	Confident	28 Å²	28	64.5 Å²	64.5	19%	0.189	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	128.3	173.7	-75.4	0	0	0	0	110.6	C381 C388 W401	C381-C394 WeakPolarHBondContact CA-SG 3.23Å; C381-C394 HydrophobicContact CB-CB 3.7Å; C381-C394 WeakPolarHBondContact CB-SG 2.99Å; C381-C394 WeakPolarHBondContact SG-CB 3.27Å; C381-C394 CovalentContact SG-SG 2.04Å; C381-C394 PolarHBondContact SG-SG 2.85Å; C388-C394 PolarHBondContact SG-SG 3.38Å; C394-W401 HydrophobicContact CB-CE3 3.68Å; C394-W401 HydrophobicContact CB-CZ3 3.68Å
395	C	88.4	Confident	79	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	101.1	-169.2	-56.5	0	0	0	0	109.9	T393 G402 C404 C411 K446	T393-C395 PolarHBondContact O-SG 3.43Å; C395-G402 PolarHBondContact N-O 2.04Å; C395-G402 PolarHBondContact O-N 3.38Å; C395-C404 WeakPolarHBondContact CB-SG 3.2Å; C395-C404 WeakPolarHBondContact SG-CB 3.28Å; C395-C404 CovalentContact SG-SG 2.03Å; C395-C404 PolarHBondContact SG-SG 2.9Å; C395-C411 VanDerWaalsContact CA-SG 3.54Å; C395-C411 HydrophobicContact CB-CB 4.17Å; C395-C411 WeakPolarHBondContact CB-SG 3.49Å; C395-C411 PolarHBondContact SG-SG 3.02Å; C395-K446 HydrophobicContact CB-CD 3.9Å; C395-K446 VanDerWaalsContact CB-CE 3.45Å; C395-K446 HydrophobicContact CB-CG 4.38Å; C395-K446 PolarHBondContact O-NZ 2.88Å
396	E	86.7	Confident	79.6	Confident	98 Å²	98	64.9 Å²	64.9	46%	0.458	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	143.2	-178.3	-166	-175.7	175.3	0	0	112	K400 W401	E396-K400 WeakPolarHBondContact CA-O 2.98Å; E396-W401 HydrophobicContact CB-CD2 4.04Å; E396-W401 HydrophobicContact CB-CE3 3.92Å; E396-W401 HydrophobicContact CB-CH2 4Å; E396-W401 HydrophobicContact CB-CZ2 4.09Å; E396-W401 HydrophobicContact CB-CZ3 3.91Å; E396-W401 HydrophobicContact CG-CD2 4.29Å; E396-W401 HydrophobicContact CG-CZ2 4.24Å
397	H	79.2	Confident	79.9	Confident	73 Å²	73	66.6 Å²	66.6	34%	0.338	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	136.2	161.3	-173.1	79.5	0	0	0	109.9	K399 K400 S413 D414	H397-K399 VanDerWaalsContact C-N 3.26Å; H397-K399 PolarHBondContact O-N 2.73Å; H397-K400 PolarHBondContact N-O 3.41Å; H397-K400 WeakPolarHBondContact O-CA 3.42Å; H397-K400 WeakPolarHBondContact O-CB 3.24Å; H397-K400 PolarHBondContact O-N 2.86Å; H397-K400 VanDerWaalsContact O-O 3.05Å; H397-S413 PolarHBondContact CE1-O 3.24Å; H397-S413 PolarHBondContact ND1-O 3.21Å; H397-D414 PolarHBondContact NE2-O 2.03Å
398	D	79	Confident	80.2	Confident	139 Å²	139	67.8 Å²	67.8	74%	0.743	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	45.1	-179.1	-90.7	-6	0	0	0	113.7	K400	D398-K400 PolarHBondContact O-N 3.46Å; D398-K400 VanDerWaalsContact O-N 3.11Å
399	K	71.3	Confident	80.6	Confident	187 Å²	187	68.3 Å²	68.3	81%	0.813	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	17.7	-177.4	-53	179.9	178.8	-179.6	0	114.4	H397	H397-K399 VanDerWaalsContact C-N 3.26Å; H397-K399 PolarHBondContact O-N 2.73Å
400	K	75.9	Confident	81.6	Confident	163 Å²	163	68 Å²	68	71%	0.709	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.9	173.7	-70.7	179.5	-179.1	172.6	0	109.7	E396 H397 D398	E396-K400 WeakPolarHBondContact CA-O 2.98Å; H397-K400 PolarHBondContact N-O 3.41Å; H397-K400 WeakPolarHBondContact O-CA 3.42Å; H397-K400 WeakPolarHBondContact O-CB 3.24Å; H397-K400 PolarHBondContact O-N 2.86Å; H397-K400 VanDerWaalsContact O-O 3.05Å; D398-K400 PolarHBondContact O-N 3.46Å; D398-K400 VanDerWaalsContact O-N 3.11Å
401	W	85.9	Confident	83.2	Confident	38 Å²	38	65.7 Å²	65.7	14%	0.144	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.9	177.5	-68.9	85.3	0	0	0	110.9	C381 P382 V386 C394 E396 P449	C381-W401 HydrophobicContact CB-CB 4.07Å; C381-W401 HydrophobicContact CB-CD2 3.61Å; C381-W401 HydrophobicContact CB-CE3 3.63Å; C381-W401 HydrophobicContact CB-CG 3.83Å; C381-W401 HydrophobicContact CB-CZ3 4.28Å; P382-W401 HydrophobicContact CB-CH2 3.96Å; P382-W401 HydrophobicContact CB-CZ2 3.82Å; P382-W401 HydrophobicContact CG-CH2 3.78Å; P382-W401 HydrophobicContact CG-CZ2 4.16Å; P382-W401 HydrophobicContact CG-CZ3 4.46Å; P382-W401 WeakPolarHBondContact O-CZ2 3.13Å; P382-W401 PolarHBondContact O-NE1 2.98Å; V386-W401 HydrophobicContact CB-CB 3.82Å; V386-W401 HydrophobicContact CG1-CB 4.02Å; V386-W401 HydrophobicContact CG2-CB 3.9Å; C394-W401 HydrophobicContact CB-CE3 3.68Å; C394-W401 HydrophobicContact CB-CZ3 3.68Å; E396-W401 HydrophobicContact CB-CD2 4.04Å; E396-W401 HydrophobicContact CB-CE3 3.92Å; E396-W401 HydrophobicContact CB-CH2 4Å; E396-W401 HydrophobicContact CB-CZ2 4.09Å; E396-W401 HydrophobicContact CB-CZ3 3.91Å; E396-W401 HydrophobicContact CG-CD2 4.29Å; E396-W401 HydrophobicContact CG-CZ2 4.24Å; W401-P449 WeakPolarHBondContact O-CG 3.45Å
402	G	82.8	Confident	84.3	Confident	6 Å²	6	59.8 Å²	59.8	6%	0.062	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	161.5	167.6	0	0	0	0	0	110.6	C395	C395-G402 PolarHBondContact N-O 2.04Å; C395-G402 PolarHBondContact O-N 3.38Å
403	C	88.3	Confident	84.5	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.034	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.6	-178.8	-61.7	0	0	0	0	110.3	Y387 C388 T393 K446 S447	Y387-C403 PolarHBondContact O-SG 2.97Å; C388-C403 WeakPolarHBondContact CA-SG 3.38Å; C388-C403 HydrophobicContact CB-CB 3.82Å; C388-C403 WeakPolarHBondContact CB-SG 3.44Å; C388-C403 WeakPolarHBondContact SG-CA 3.46Å; C388-C403 WeakPolarHBondContact SG-CB 3.06Å; C388-C403 CovalentContact SG-SG 2.03Å; C388-C403 PolarHBondContact SG-SG 3.42Å; T393-C403 CarbonylContact O-C 3.41Å; C403-K446 CarbonylContact O-C 3.21Å; C403-K446 VanDerWaalsContact O-CA 3.28Å; C403-K446 WeakPolarHBondContact O-CA 3.48Å; C403-S447 WeakPolarHBondContact CB-OG 3.3Å; C403-S447 PolarHBondContact N-O 2.84Å; C403-S447 VanDerWaalsContact N-O 3.14Å; C403-S447 PolarHBondContact O-N 2.72Å; C403-S447 PolarHBondContact O-OG 2.78Å
404	C	88.1	Confident	84.3	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.4	173.2	-63.2	0	0	0	0	108.1	S392 T393 C395 F406 A409 C418	S392-C404 CarbonylContact C-O 3.52Å; S392-C404 WeakPolarHBondContact CA-O 3.04Å; S392-C404 WeakPolarHBondContact CB-O 3.35Å; T393-C404 PolarHBondContact N-O 2.03Å; T393-C404 WeakPolarHBondContact O-CB 3.05Å; T393-C404 PolarHBondContact O-N 3.43Å; C395-C404 WeakPolarHBondContact CB-SG 3.2Å; C395-C404 WeakPolarHBondContact SG-CB 3.28Å; C395-C404 CovalentContact SG-SG 2.03Å; C395-C404 PolarHBondContact SG-SG 2.9Å; C404-F406 PolarHBondContact O-N 2.92Å; C404-F406 VanDerWaalsContact O-N 3.07Å; C404-A409 HydrophobicContact CB-CB 3.41Å; C404-A409 VanDerWaalsContact CB-CB 3.41Å; C404-C418 HydrophobicContact CB-CB 3.8Å; C404-C418 WeakPolarHBondContact SG-CB 3.49Å; C404-C418 PolarHBondContact SG-SG 2.91Å
405	L	83.4	Confident	83.9	Confident	117 Å²	117	63.1 Å²	63.1	61%	0.613	33%	0.331	S	S	*	.	S	Bend	trans	-65.3	-12.7	-174.8	-67	174.8	0	0	0	114.3
406	F	81.4	Confident	83.6	Confident	63 Å²	63	67.6 Å²	67.6	28%	0.276	35%	0.354	S	S	.	.	S	Bend	trans	-87.8	139.3	173.2	-50.7	-67.9	0	0	0	111.2	N391 T393 C404 A409 P420 Q444	N391-F406 CarbonylContact O-C 3.39Å; T393-F406 PolarHBondContact N-O 2.72Å; T393-F406 PolarHBondContact OG1-O 3.43Å; C404-F406 PolarHBondContact O-N 2.92Å; C404-F406 VanDerWaalsContact O-N 3.07Å; F406-A409 HydrophobicContact CB-CB 4.03Å; F406-P420 HydrophobicContact CD1-CB 4.37Å; F406-P420 HydrophobicContact CD2-CB 4.29Å; F406-P420 HydrophobicContact CE2-CB 4.44Å; F406-P420 HydrophobicContact CG-CB 4.23Å; F406-Q444 HydrophobicContact CE2-CB 3.88Å; F406-Q444 HydrophobicContact CE2-CG 3.33Å; F406-Q444 HydrophobicContact CZ-CB 4.41Å; F406-Q444 HydrophobicContact CZ-CG 3.42Å; F406-Q444 VanDerWaalsContact CZ-CG 3.42Å
407	P	79.5	Confident	83.7	Confident	54 Å²	54	64.6 Å²	64.6	35%	0.351	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	137.6	164.3	27.9	-32	0	0	0	109.2	N391 A409	N391-P407 WeakPolarHBondContact O-CA 3.4Å; N391-P407 WeakPolarHBondContact O-CD 2.99Å; N391-P407 VanDerWaalsContact O-N 3.13Å; P407-A409 VanDerWaalsContact C-N 3.3Å; P407-A409 PolarHBondContact O-N 3.15Å
408	N	82.7	Confident	84.2	Confident	116 Å²	116	61.1 Å²	61.1	62%	0.62	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	39.7	-177.8	-49.9	-45.9	0	0	0	114.6	T393 Q421	T393-N408 WeakPolarHBondContact OG1-CA 3.48Å; T393-N408 PolarHBondContact OG1-N 3.25Å; N408-Q421 HydrophobicContact CB-CB 4.23Å; N408-Q421 WeakPolarHBondContact O-CB 3.09Å
409	A	87.7	Confident	84.8	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-62.8	147.2	179.2	0	0	0	0	0	112.3	T393 C404 F406 P407 C419	T393-A409 HydrophobicContact CG2-CB 4.38Å; T393-A409 PolarHBondContact OG1-N 3.21Å; C404-A409 HydrophobicContact CB-CB 3.41Å; C404-A409 VanDerWaalsContact CB-CB 3.41Å; F406-A409 HydrophobicContact CB-CB 4.03Å; P407-A409 VanDerWaalsContact C-N 3.3Å; P407-A409 PolarHBondContact O-N 3.15Å; A409-C419 CarbonylContact C-O 3.58Å; A409-C419 VanDerWaalsContact CA-O 3.22Å; A409-C419 WeakPolarHBondContact CA-O 3.14Å; A409-C419 WeakPolarHBondContact CB-O 3.15Å
410	V	90.5	Very high	85.6	Confident	52 Å²	52	46.8 Å²	46.8	32%	0.315	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	118.4	166.7	178.1	0	0	0	0	108.4	C418 C419 T423	V410-C418 WeakPolarHBondContact O-CA 3.15Å; V410-C419 HydrophobicContact CB-CB 4.04Å; V410-C419 PolarHBondContact N-O 3.43Å; V410-C419 PolarHBondContact O-N 2.99Å; V410-T423 WeakPolarHBondContact CG2-O 3.49Å
411	C	91.6	Very high	86	Confident	56 Å²	56	44.2 Å²	44.2	38%	0.378	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	122.2	175.7	-54.4	0	0	0	0	109.1	C395	C395-C411 VanDerWaalsContact CA-SG 3.54Å; C395-C411 HydrophobicContact CB-CB 4.17Å; C395-C411 WeakPolarHBondContact CB-SG 3.49Å; C395-C411 PolarHBondContact SG-SG 3.02Å
412	C	90.3	Very high	85.8	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.034	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-72.5	151.5	174.9	-64.1	0	0	0	0	111.5	D414 G415 H417 C425 V427	C412-D414 WeakPolarHBondContact CB-OD1 3.02Å; C412-D414 PolarHBondContact O-N 2.89Å; C412-G415 PolarHBondContact O-N 2.87Å; C412-G415 VanDerWaalsContact O-N 3.14Å; C412-H417 HydrophobicContact CB-CB 3.74Å; C412-H417 VanDerWaalsContact CB-O 3.22Å; C412-H417 WeakPolarHBondContact CB-O 3.13Å; C412-H417 PolarHBondContact N-O 2.84Å; C412-H417 VanDerWaalsContact SG-CB 3.54Å; C412-H417 PolarHBondContact SG-O 3.33Å; C412-C425 HydrophobicContact CB-CB 4.02Å; C412-C425 WeakPolarHBondContact CB-SG 3.24Å; C412-C425 WeakPolarHBondContact SG-CB 3.07Å; C412-C425 CovalentContact SG-SG 2.02Å; C412-C425 PolarHBondContact SG-SG 2.94Å; C412-V427 HydrophobicContact CB-CG2 4.19Å
413	S	86.7	Confident	86	Confident	98 Å²	98	47.3 Å²	47.3	69%	0.685	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.3	-178.6	51.3	0	0	0	0	113.7	H397 G415	H397-S413 PolarHBondContact CE1-O 3.24Å; H397-S413 PolarHBondContact ND1-O 3.21Å; S413-G415 PolarHBondContact O-N 2.03Å
414	D	82.7	Confident	85.9	Confident	34 Å²	34	51.6 Å²	51.6	18%	0.182	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.6	174.1	62.1	18.2	0	0	0	114.1	H397 C412 I416 H417 V427	H397-D414 PolarHBondContact NE2-O 2.03Å; C412-D414 WeakPolarHBondContact CB-OD1 3.02Å; C412-D414 PolarHBondContact O-N 2.89Å; D414-I416 PolarHBondContact O-N 2.88Å; D414-I416 VanDerWaalsContact O-N 3.11Å; D414-I416 PolarHBondContact OD1-N 2.72Å; D414-H417 PolarHBondContact OD1-N 3.4Å; D414-H417 IonicContact OD1-ND1 3.52Å; D414-H417 IonicContact OD2-CE1 3.77Å; D414-H417 IonicContact OD2-CG 3.63Å; D414-H417 IonicContact OD2-ND1 3.73Å; D414-H417 PolarHBondContact OD2-ND1 3.07Å; D414-V427 HydrophobicContact CB-CG1 3.9Å; D414-V427 HydrophobicContact CB-CG2 4.36Å; D414-V427 WeakPolarHBondContact OD2-CG1 3.42Å
415	G	79.2	Confident	86	Confident	11 Å²	11	52.9 Å²	52.9	11%	0.113	30%	0.297	C	S	.	.	S	Bend	trans	70.5	1.1	179.7	0	0	0	0	0	116.8	C412 S413 K446	C412-G415 PolarHBondContact O-N 2.87Å; C412-G415 VanDerWaalsContact O-N 3.14Å; S413-G415 PolarHBondContact O-N 2.03Å; G415-K446 VanDerWaalsContact C-CE 3.43Å; G415-K446 WeakPolarHBondContact O-CD 3.28Å; G415-K446 WeakPolarHBondContact O-CE 3.39Å; G415-K446 PolarHBondContact O-NZ 3.02Å
416	I	83.3	Confident	86.1	Confident	94 Å²	94	49.5 Å²	49.5	48%	0.482	28%	0.279	S	S	.	.	S	Bend	trans	-109.7	-30	-178	-59.8	166.2	0	0	0	109.4	D414 L445 K446	D414-I416 PolarHBondContact O-N 2.88Å; D414-I416 VanDerWaalsContact O-N 3.11Å; D414-I416 PolarHBondContact OD1-N 2.72Å; I416-L445 HydrophobicContact CG2-CD2 3.96Å; I416-L445 HydrophobicContact CG2-CG 4.31Å; I416-L445 CarbonylContact O-C 3.56Å; I416-L445 WeakPolarHBondContact O-CA 3.28Å; I416-K446 WeakPolarHBondContact O-CG 3.03Å; I416-K446 PolarHBondContact O-N 2.84Å
417	H	88.8	Confident	86.2	Confident	34 Å²	34	48.8 Å²	48.8	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	160.2	-172.6	-66.8	114.4	0	0	0	114.3	C412 D414 L443 Q444	C412-H417 HydrophobicContact CB-CB 3.74Å; C412-H417 VanDerWaalsContact CB-O 3.22Å; C412-H417 WeakPolarHBondContact CB-O 3.13Å; C412-H417 PolarHBondContact N-O 2.84Å; C412-H417 VanDerWaalsContact SG-CB 3.54Å; C412-H417 PolarHBondContact SG-O 3.33Å; D414-H417 PolarHBondContact OD1-N 3.4Å; D414-H417 IonicContact OD1-ND1 3.52Å; D414-H417 IonicContact OD2-CE1 3.77Å; D414-H417 IonicContact OD2-CG 3.63Å; D414-H417 IonicContact OD2-ND1 3.73Å; D414-H417 PolarHBondContact OD2-ND1 3.07Å; H417-L443 HydrophobicContact CB-CB 3.86Å; H417-L443 HydrophobicContact CB-CD1 3.88Å; H417-L443 HydrophobicContact CB-CD2 4.31Å; H417-L443 HydrophobicContact CB-CG 4.2Å; H417-Q444 CarbonylContact C-O 3.59Å; H417-Q444 VanDerWaalsContact CA-O 3.26Å; H417-Q444 WeakPolarHBondContact CA-O 3.49Å
418	C	90	Very high	86.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	142.7	-177.2	-30.9	0	0	0	0	108.7	C404 V410 Q444 K446	C404-C418 HydrophobicContact CB-CB 3.8Å; C404-C418 WeakPolarHBondContact SG-CB 3.49Å; C404-C418 PolarHBondContact SG-SG 2.91Å; V410-C418 WeakPolarHBondContact O-CA 3.15Å; C418-Q444 PolarHBondContact N-O 2.98Å; C418-Q444 PolarHBondContact O-N 2.04Å; C418-Q444 PolarHBondContact SG-O 2.72Å; C418-K446 VanDerWaalsContact SG-CA 3.52Å; C418-K446 WeakPolarHBondContact SG-CG 3.49Å; C418-K446 PolarHBondContact SG-N 2.83Å; C418-K446 VanDerWaalsContact SG-N 3.39Å
419	C	91.5	Very high	86.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.5	174.7	-83.1	0	0	0	0	110.3	A409 V410 T423 C425 C432 L443	A409-C419 CarbonylContact C-O 3.58Å; A409-C419 VanDerWaalsContact CA-O 3.22Å; A409-C419 WeakPolarHBondContact CA-O 3.14Å; A409-C419 WeakPolarHBondContact CB-O 3.15Å; V410-C419 HydrophobicContact CB-CB 4.04Å; V410-C419 PolarHBondContact N-O 3.43Å; V410-C419 PolarHBondContact O-N 2.99Å; C419-T423 VanDerWaalsContact CB-OG1 3.27Å; C419-T423 WeakPolarHBondContact CB-OG1 2.96Å; C419-C425 HydrophobicContact CB-CB 4.41Å; C419-C432 WeakPolarHBondContact CA-SG 3.15Å; C419-C432 HydrophobicContact CB-CB 3.85Å; C419-C432 WeakPolarHBondContact CB-SG 3.47Å; C419-C432 VanDerWaalsContact SG-CA 3.52Å; C419-C432 WeakPolarHBondContact SG-CB 3.15Å; C419-C432 CovalentContact SG-SG 2.04Å; C419-C432 PolarHBondContact SG-SG 3.35Å; C419-L443 WeakPolarHBondContact SG-CD2 2.98Å
420	P	86.7	Confident	85.9	Confident	25 Å²	25	60.7 Å²	60.7	16%	0.162	33%	0.325	C	S	.	.			trans	-61.2	160.8	175.3	24.5	-30.9	0	0	0	111	F406 N422 T423 I440	F406-P420 HydrophobicContact CD1-CB 4.37Å; F406-P420 HydrophobicContact CD2-CB 4.29Å; F406-P420 HydrophobicContact CE2-CB 4.44Å; F406-P420 HydrophobicContact CG-CB 4.23Å; P420-N422 PolarHBondContact O-N 3.24Å; P420-T423 WeakPolarHBondContact CD-OG1 3.01Å; P420-T423 HydrophobicContact CG-CG2 4.06Å; P420-T423 PolarHBondContact O-N 3.11Å; P420-T423 PolarHBondContact O-OG1 3.25Å; P420-I440 HydrophobicContact CG-CG2 4.44Å
421	Q	84.2	Confident	85.5	Confident	109 Å²	109	60.3 Å²	60.3	51%	0.509	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	145.6	176.5	70.8	-178.5	2.7	0	0	111.2	N408 T423	N408-Q421 HydrophobicContact CB-CB 4.23Å; N408-Q421 WeakPolarHBondContact O-CB 3.09Å; Q421-T423 VanDerWaalsContact C-N 3.34Å; Q421-T423 PolarHBondContact O-N 3.35Å
422	N	81.9	Confident	85.3	Confident	101 Å²	101	57.7 Å²	57.7	54%	0.54	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	20.8	-179.4	-63.7	-11.5	0	0	0	117	P420	P420-N422 PolarHBondContact O-N 3.24Å
423	T	87.7	Confident	85	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.043	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	155.1	168.9	52.8	0	0	0	0	111.8	V410 C419 P420 Q421 C432 I433 I440	V410-T423 WeakPolarHBondContact CG2-O 3.49Å; C419-T423 VanDerWaalsContact CB-OG1 3.27Å; C419-T423 WeakPolarHBondContact CB-OG1 2.96Å; P420-T423 WeakPolarHBondContact CD-OG1 3.01Å; P420-T423 HydrophobicContact CG-CG2 4.06Å; P420-T423 PolarHBondContact O-N 3.11Å; P420-T423 PolarHBondContact O-OG1 3.25Å; Q421-T423 VanDerWaalsContact C-N 3.34Å; Q421-T423 PolarHBondContact O-N 3.35Å; T423-C432 HydrophobicContact CG2-CB 4.16Å; T423-I433 CarbonylContact C-O 3.55Å; T423-I433 VanDerWaalsContact CA-O 3.22Å; T423-I433 WeakPolarHBondContact CA-O 2.76Å; T423-I433 WeakPolarHBondContact CB-O 3.37Å; T423-I440 HydrophobicContact CG2-CB 3.75Å; T423-I440 HydrophobicContact CG2-CD1 3.69Å; T423-I440 HydrophobicContact CG2-CG1 4.11Å; T423-I440 HydrophobicContact CG2-CG2 3.78Å
424	I	87.1	Confident	84.6	Confident	96 Å²	96	55.4 Å²	55.4	49%	0.492	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.2	171.9	-61	173.2	0	0	0	106.7	D426 C432 I433	I424-D426 PolarHBondContact O-N 2.75Å; I424-C432 WeakPolarHBondContact O-CA 3.27Å; I424-I433 PolarHBondContact N-O 2.79Å; I424-I433 PolarHBondContact O-N 2.85Å
425	C	88.3	Confident	84	Confident	27 Å²	27	61.6 Å²	61.6	18%	0.182	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	110.5	175.8	-178.1	0	0	0	0	110	C412 C419 L443	C412-C425 HydrophobicContact CB-CB 4.02Å; C412-C425 WeakPolarHBondContact CB-SG 3.24Å; C412-C425 WeakPolarHBondContact SG-CB 3.07Å; C412-C425 CovalentContact SG-SG 2.02Å; C412-C425 PolarHBondContact SG-SG 2.94Å; C419-C425 HydrophobicContact CB-CB 4.41Å; C425-L443 HydrophobicContact CB-CD2 4.4Å; C425-L443 WeakPolarHBondContact SG-CD2 2.99Å
426	D	86.7	Confident	83.2	Confident	45 Å²	45	65.2 Å²	65.2	24%	0.241	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	99.7	167.7	-166.7	-28	0	0	0	109.1	I424 Q428 E429 E430 M431 I433	I424-D426 PolarHBondContact O-N 2.75Å; D426-Q428 VanDerWaalsContact C-N 3.31Å; D426-Q428 PolarHBondContact OD1-N 2.04Å; D426-E429 HydrophobicContact CB-CB 4.38Å; D426-E429 PolarHBondContact OD1-N 2.02Å; D426-E430 WeakPolarHBondContact O-CA 3.39Å; D426-E430 PolarHBondContact O-N 3.07Å; D426-E430 VanDerWaalsContact O-N 3.14Å; D426-M431 PolarHBondContact N-O 3.5Å; D426-M431 PolarHBondContact O-N 3.05Å; D426-I433 HydrophobicContact CB-CD1 3.76Å; D426-I433 HydrophobicContact CB-CG1 4.25Å
427	V	83.2	Confident	82	Confident	49 Å²	49	63.6 Å²	63.6	30%	0.297	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-28.5	179.2	179.6	0	0	0	0	111.5	C412 D414	C412-V427 HydrophobicContact CB-CG2 4.19Å; D414-V427 HydrophobicContact CB-CG1 3.9Å; D414-V427 HydrophobicContact CB-CG2 4.36Å; D414-V427 WeakPolarHBondContact OD2-CG1 3.42Å
428	Q	81.9	Confident	80.5	Confident	178 Å²	178	67 Å²	67	83%	0.832	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-40.2	-177.4	-66.5	-177.2	-3.2	0	0	111.2	D426	D426-Q428 VanDerWaalsContact C-N 3.31Å; D426-Q428 PolarHBondContact OD1-N 2.04Å
429	E	80.2	Confident	78.8	Confident	127 Å²	127	73.4 Å²	73.4	59%	0.593	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.2	178.7	-62.8	-62	145.5	0	0	113.2	D426 M431	D426-E429 HydrophobicContact CB-CB 4.38Å; D426-E429 PolarHBondContact OD1-N 2.02Å; E429-M431 VanDerWaalsContact C-N 3.3Å; E429-M431 HydrophobicContact CB-CE 4.17Å; E429-M431 HydrophobicContact CB-CG 4.34Å; E429-M431 VanDerWaalsContact O-CG 3.28Å; E429-M431 WeakPolarHBondContact O-CG 3.47Å; E429-M431 PolarHBondContact O-N 3.12Å
430	E	80.6	Confident	77.4	Confident	126 Å²	126	77.4 Å²	77.4	59%	0.589	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	40	-172.7	-61.1	-175.1	165	0	0	113.5	D426 L443	D426-E430 WeakPolarHBondContact O-CA 3.39Å; D426-E430 PolarHBondContact O-N 3.07Å; D426-E430 VanDerWaalsContact O-N 3.14Å; E430-L443 VanDerWaalsContact C-CG 3.46Å; E430-L443 HydrophobicContact CB-CD1 4.29Å; E430-L443 PolarHBondContact O-N 3.29Å
431	M	83.1	Confident	76.5	Confident	44 Å²	44	79.5 Å²	79.5	22%	0.217	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.6	-174.7	-62.7	-153.3	-65.5	0	0	115.3	D426 E429 I433 M439	D426-M431 PolarHBondContact N-O 3.5Å; D426-M431 PolarHBondContact O-N 3.05Å; E429-M431 VanDerWaalsContact C-N 3.3Å; E429-M431 HydrophobicContact CB-CE 4.17Å; E429-M431 HydrophobicContact CB-CG 4.34Å; E429-M431 VanDerWaalsContact O-CG 3.28Å; E429-M431 WeakPolarHBondContact O-CG 3.47Å; E429-M431 PolarHBondContact O-N 3.12Å; M431-I433 HydrophobicContact CB-CG1 4.41Å; M431-M439 HydrophobicContact CE-CE 3.55Å; M431-M439 HydrophobicContact CE-CG 4.36Å; M431-M439 HydrophobicContact SD-CE 3.48Å; M431-M439 WeakPolarHBondContact SD-CE 3.42Å; M431-M439 HydrophobicContact SD-CG 4.13Å; M431-M439 HydrophobicContact SD-SD 4.16Å
432	C	87	Confident	76.1	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.007	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	109.1	164.6	-56.8	0	0	0	0	108.8	C419 T423 I424 I440 T441	C419-C432 WeakPolarHBondContact CA-SG 3.15Å; C419-C432 HydrophobicContact CB-CB 3.85Å; C419-C432 WeakPolarHBondContact CB-SG 3.47Å; C419-C432 VanDerWaalsContact SG-CA 3.52Å; C419-C432 WeakPolarHBondContact SG-CB 3.15Å; C419-C432 CovalentContact SG-SG 2.04Å; C419-C432 PolarHBondContact SG-SG 3.35Å; T423-C432 HydrophobicContact CG2-CB 4.16Å; I424-C432 WeakPolarHBondContact O-CA 3.27Å; C432-I440 PolarHBondContact O-N 3.18Å; C432-T441 WeakPolarHBondContact CB-O 3.07Å; C432-T441 PolarHBondContact N-O 3.08Å; C432-T441 PolarHBondContact O-N 2.77Å
433	I	84.6	Confident	76	Confident	48 Å²	48	77.7 Å²	77.7	25%	0.246	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.4	-176.4	-49.5	175.6	0	0	0	108.5	T423 I424 D426 M431	T423-I433 CarbonylContact C-O 3.55Å; T423-I433 VanDerWaalsContact CA-O 3.22Å; T423-I433 WeakPolarHBondContact CA-O 2.76Å; T423-I433 WeakPolarHBondContact CB-O 3.37Å; I424-I433 PolarHBondContact N-O 2.79Å; I424-I433 PolarHBondContact O-N 2.85Å; D426-I433 HydrophobicContact CB-CD1 3.76Å; D426-I433 HydrophobicContact CB-CG1 4.25Å; M431-I433 HydrophobicContact CB-CG1 4.41Å
434	S	77.9	Confident	75.3	Confident	6 Å²	6	81.3 Å²	81.3	4%	0.042	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	159.2	171.7	67.5	0	0	0	0	111.2	S436 G437 D438 I440	S434-S436 WeakPolarHBondContact CB-OG 3.41Å; S434-S436 PolarHBondContact O-N 3.46Å; S434-S436 WeakPolarHBondContact OG-CA 2.84Å; S434-S436 PolarHBondContact OG-N 2.65Å; S434-S436 PolarHBondContact OG-OG 2.02Å; S434-G437 PolarHBondContact O-N 3.31Å; S434-G437 PolarHBondContact OG-N 3.03Å; S434-D438 WeakPolarHBondContact CB-O 3.36Å; S434-D438 PolarHBondContact N-O 3.04Å; S434-D438 VanDerWaalsContact N-O 3.07Å; S434-D438 PolarHBondContact OG-N 2.88Å; S434-D438 PolarHBondContact OG-O 2.98Å; S434-I440 VanDerWaalsContact CB-CG1 3.49Å
435	K	69.5	Low	74.7	Confident	165 Å²	165	82.3 Å²	82.3	72%	0.717	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.8	161.6	-67.6	-173.1	176	-174.9	0	113.5
436	S	62.5	Low	73.7	Confident	87 Å²	87	82.3 Å²	82.3	61%	0.608	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-0	175.1	58.2	0	0	0	0	113.9	S434 D438	S434-S436 WeakPolarHBondContact CB-OG 3.41Å; S434-S436 PolarHBondContact O-N 3.46Å; S434-S436 WeakPolarHBondContact OG-CA 2.84Å; S434-S436 PolarHBondContact OG-N 2.65Å; S434-S436 PolarHBondContact OG-OG 2.02Å; S436-D438 WeakPolarHBondContact CB-OD2 3.29Å; S436-D438 PolarHBondContact O-N 2.79Å; S436-D438 PolarHBondContact OG-OD2 2.03Å
437	G	58.7	Low	72.4	Confident	60 Å²	60	81.9 Å²	81.9	62%	0.619	43%	0.428	S	S	*	.	S	Bend	trans	80.5	-12.1	-175.1	0	0	0	0	0	114.2	S434	S434-G437 PolarHBondContact O-N 3.31Å; S434-G437 PolarHBondContact OG-N 3.03Å
438	D	57.5	Low	70.9	Confident	105 Å²	105	85.2 Å²	85.2	56%	0.561	45%	0.448	S	S	*	.			trans	-69.3	134.6	172.7	-55.5	-54.2	0	0	0	110.8	S434 S436 I440	S434-D438 WeakPolarHBondContact CB-O 3.36Å; S434-D438 PolarHBondContact N-O 3.04Å; S434-D438 VanDerWaalsContact N-O 3.07Å; S434-D438 PolarHBondContact OG-N 2.88Å; S434-D438 PolarHBondContact OG-O 2.98Å; S436-D438 WeakPolarHBondContact CB-OD2 3.29Å; S436-D438 PolarHBondContact O-N 2.79Å; S436-D438 PolarHBondContact OG-OD2 2.03Å; D438-I440 PolarHBondContact O-N 3Å
439	M	54.5	Low	69.1	Low	136 Å²	136	78.6 Å²	78.6	67%	0.67	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	119.7	173	-97.1	-177.9	-177.6	0	0	109.9	M431	M431-M439 HydrophobicContact CE-CE 3.55Å; M431-M439 HydrophobicContact CE-CG 4.36Å; M431-M439 HydrophobicContact SD-CE 3.48Å; M431-M439 WeakPolarHBondContact SD-CE 3.42Å; M431-M439 HydrophobicContact SD-CG 4.13Å; M431-M439 HydrophobicContact SD-SD 4.16Å
440	I	61.8	Low	67	Low	83 Å²	83	78.7 Å²	78.7	43%	0.426	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-42.9	-178.3	-64.5	-164.2	0	0	0	112.9	P420 T423 C432 S434 D438	P420-I440 HydrophobicContact CG-CG2 4.44Å; T423-I440 HydrophobicContact CG2-CB 3.75Å; T423-I440 HydrophobicContact CG2-CD1 3.69Å; T423-I440 HydrophobicContact CG2-CG1 4.11Å; T423-I440 HydrophobicContact CG2-CG2 3.78Å; C432-I440 PolarHBondContact O-N 3.18Å; S434-I440 VanDerWaalsContact CB-CG1 3.49Å; D438-I440 PolarHBondContact O-N 3Å
441	T	67.4	Low	64.8	Low	70 Å²	70	80 Å²	80	43%	0.429	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	163.1	178.9	4	0	0	0	0	111.8	C432	C432-T441 WeakPolarHBondContact CB-O 3.07Å; C432-T441 PolarHBondContact N-O 3.08Å; C432-T441 PolarHBondContact O-N 2.77Å
442	K	76.8	Confident	62.3	Low	157 Å²	157	81.9 Å²	81.9	68%	0.683	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	151.2	166.1	-71.2	-172.7	176.9	-171.8	0	111.5	Q444	K442-Q444 PolarHBondContact O-N 3.49Å; K442-Q444 PolarHBondContact O-NE2 2.8Å
443	L	78.5	Confident	59.7	Low	14 Å²	14	87.1 Å²	87.1	7%	0.073	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-48.8	134.3	170.7	-63.5	-178.4	0	0	0	111.2	H417 C419 C425 E430	H417-L443 HydrophobicContact CB-CB 3.86Å; H417-L443 HydrophobicContact CB-CD1 3.88Å; H417-L443 HydrophobicContact CB-CD2 4.31Å; H417-L443 HydrophobicContact CB-CG 4.2Å; C419-L443 WeakPolarHBondContact SG-CD2 2.98Å; C425-L443 HydrophobicContact CB-CD2 4.4Å; C425-L443 WeakPolarHBondContact SG-CD2 2.99Å; E430-L443 VanDerWaalsContact C-CG 3.46Å; E430-L443 HydrophobicContact CB-CD1 4.29Å; E430-L443 PolarHBondContact O-N 3.29Å
444	Q	74.3	Confident	57.4	Low	83 Å²	83	92.2 Å²	92.2	39%	0.388	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140	170.9	-63.7	-57	-62.9	0	0	109.9	F406 H417 C418 K442	F406-Q444 HydrophobicContact CE2-CB 3.88Å; F406-Q444 HydrophobicContact CE2-CG 3.33Å; F406-Q444 HydrophobicContact CZ-CB 4.41Å; F406-Q444 HydrophobicContact CZ-CG 3.42Å; F406-Q444 VanDerWaalsContact CZ-CG 3.42Å; H417-Q444 CarbonylContact C-O 3.59Å; H417-Q444 VanDerWaalsContact CA-O 3.26Å; H417-Q444 WeakPolarHBondContact CA-O 3.49Å; C418-Q444 PolarHBondContact N-O 2.98Å; C418-Q444 PolarHBondContact O-N 2.04Å; C418-Q444 PolarHBondContact SG-O 2.72Å; K442-Q444 PolarHBondContact O-N 3.49Å; K442-Q444 PolarHBondContact O-NE2 2.8Å
445	L	72.9	Confident	55.3	Low	117 Å²	117	100.7 Å²	100.7	61%	0.613	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	141.5	171.6	-75.8	99.1	0	0	0	110.7	I416 S447	I416-L445 HydrophobicContact CG2-CD2 3.96Å; I416-L445 HydrophobicContact CG2-CG 4.31Å; I416-L445 CarbonylContact O-C 3.56Å; I416-L445 WeakPolarHBondContact O-CA 3.28Å; L445-S447 PolarHBondContact O-N 3.21Å
446	K	67.6	Low	54	Low	28 Å²	28	98.7 Å²	98.7	12%	0.122	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-52.8	126.5	163.6	-70.7	-177.2	-167.1	-179.3	0	107.6	C395 C403 G415 I416 C418 T448	C395-K446 HydrophobicContact CB-CD 3.9Å; C395-K446 VanDerWaalsContact CB-CE 3.45Å; C395-K446 HydrophobicContact CB-CG 4.38Å; C395-K446 PolarHBondContact O-NZ 2.88Å; C403-K446 CarbonylContact O-C 3.21Å; C403-K446 VanDerWaalsContact O-CA 3.28Å; C403-K446 WeakPolarHBondContact O-CA 3.48Å; G415-K446 VanDerWaalsContact C-CE 3.43Å; G415-K446 WeakPolarHBondContact O-CD 3.28Å; G415-K446 WeakPolarHBondContact O-CE 3.39Å; G415-K446 PolarHBondContact O-NZ 3.02Å; I416-K446 WeakPolarHBondContact O-CG 3.03Å; I416-K446 PolarHBondContact O-N 2.84Å; C418-K446 VanDerWaalsContact SG-CA 3.52Å; C418-K446 WeakPolarHBondContact SG-CG 3.49Å; C418-K446 PolarHBondContact SG-N 2.83Å; C418-K446 VanDerWaalsContact SG-N 3.39Å; K446-T448 PolarHBondContact O-N 2.74Å
447	S	59	Low	53	Low	36 Å²	36	102.1 Å²	102.1	25%	0.252	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-62.2	131.3	165.2	40.4	0	0	0	0	107.8	C403 L445	C403-S447 WeakPolarHBondContact CB-OG 3.3Å; C403-S447 PolarHBondContact N-O 2.84Å; C403-S447 VanDerWaalsContact N-O 3.14Å; C403-S447 PolarHBondContact O-N 2.72Å; C403-S447 PolarHBondContact O-OG 2.78Å; L445-S447 PolarHBondContact O-N 3.21Å
448	T	52.8	Low	52.5	Low	119 Å²	119	101.1 Å²	101.1	73%	0.73	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-51.8	133.7	171.7	49.3	0	0	0	0	107.5	K446 K450	K446-T448 PolarHBondContact O-N 2.74Å; T448-K450 PolarHBondContact O-N 3.11Å
449	P	43.7	Very low	52.4	Low	38 Å²	38	101.6 Å²	101.6	25%	0.247	53%	0.527	C	S	.	.			trans	-40.8	134.5	164.9	-30.5	37.2	0	0	0	108.1	V386 W401 L451	V386-P449 HydrophobicContact CB-CB 4.16Å; V386-P449 HydrophobicContact CB-CG 4.27Å; V386-P449 HydrophobicContact CG1-CB 3.62Å; V386-P449 HydrophobicContact CG1-CG 3.66Å; V386-P449 HydrophobicContact CG2-CB 3.66Å; V386-P449 HydrophobicContact CG2-CG 3.58Å; W401-P449 WeakPolarHBondContact O-CG 3.45Å; P449-L451 PolarHBondContact O-N 2.89Å
450	K	36.5	Very low	53	Low	130 Å²	130	99 Å²	99	57%	0.565	51%	0.514	S	S	*	.			trans	-69.4	75.5	163.2	-71.8	-179.7	178.6	174.1	0	106.8	Y387 T448 H452	Y387-K450 HydrophobicContact CE1-CB 3.8Å; Y387-K450 WeakPolarHBondContact CE1-O 3.43Å; Y387-K450 HydrophobicContact CE2-CB 3.79Å; Y387-K450 HydrophobicContact CE2-CD 3.7Å; Y387-K450 HydrophobicContact CE2-CG 4.32Å; Y387-K450 WeakPolarHBondContact OH-CB 3.47Å; Y387-K450 WeakPolarHBondContact OH-CD 3.21Å; T448-K450 PolarHBondContact O-N 3.11Å; K450-H452 PolarHBondContact O-N 3.21Å
451	L	33.8	Very low	53.5	Low	152 Å²	152	97.4 Å²	97.4	80%	0.796	51%	0.507	S	S	*	.			trans	-56.1	130.8	160.8	-160.5	78.7	0	0	0	105	P449 S453	P449-L451 PolarHBondContact O-N 2.89Å; L451-S453 PolarHBondContact O-N 2.03Å
452	H	31.7	Very low	54	Low	84 Å²	84	99.4 Å²	99.4	39%	0.389	51%	0.514	S	S	.	.			trans	-56.1	86.8	-174.6	-143.8	-104.9	0	0	0	109.4	K450 F454	K450-H452 PolarHBondContact O-N 3.21Å; H452-F454 WeakPolarHBondContact O-CD2 3.15Å; H452-F454 PolarHBondContact O-N 3.46Å
453	S	30.8	Very low	54.3	Low	112 Å²	112	92.1 Å²	92.1	78%	0.783	48%	0.482	S	S	*	.			trans	-73.3	85.7	159.9	178.7	0	0	0	0	104.2	L451 K455	L451-S453 PolarHBondContact O-N 2.03Å; S453-K455 PolarHBondContact O-N 3.14Å
454	F	37.1	Very low	54.3	Low	155 Å²	155	97.5 Å²	97.5	68%	0.68	52%	0.521	S	S	*	.			trans	-18.8	90.2	167.6	-72.1	-99.1	0	0	0	111.9	H452 S456 I460	H452-F454 WeakPolarHBondContact O-CD2 3.15Å; H452-F454 PolarHBondContact O-N 3.46Å; F454-S456 PolarHBondContact O-N 3.45Å; F454-I460 HydrophobicContact CE1-CD1 4.09Å
455	K	34.4	Very low	54.3	Low	184 Å²	184	95.3 Å²	95.3	80%	0.8	51%	0.512	S	S	*	.			trans	-66.4	124.1	149.6	-86.9	-174	175.6	-177.5	0	104.5	S453 N457	S453-K455 PolarHBondContact O-N 3.14Å; K455-N457 PolarHBondContact O-N 2.98Å
456	S	40.7	Very low	54.1	Low	123 Å²	123	97.1 Å²	97.1	86%	0.86	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	35.1	-170.5	67.1	0	0	0	0	114.9	F454	F454-S456 PolarHBondContact O-N 3.45Å
457	N	42.6	Very low	54.4	Low	159 Å²	159	100.9 Å²	100.9	85%	0.85	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.7	17.5	-168.9	-128.4	15.1	0	0	0	114.8	K455	K455-N457 PolarHBondContact O-N 2.98Å
458	S	48.4	Very low	55.4	Low	38 Å²	38	99.5 Å²	99.5	27%	0.266	53%	0.526	S	S	.	.			trans	-88.2	132.9	168.5	-61.9	0	0	0	0	109.8	I460	S458-I460 PolarHBondContact O-N 3.25Å
459	R	55.7	Low	56.8	Low	116 Å²	116	94.8 Å²	94.8	44%	0.438	50%	0.497	S	S	.	.			trans	-75.4	109.2	173.1	-90.9	-172	-113.3	160.4	12.4	108.6	N472 E491	R459-N472 PolarHBondContact N-OD1 3.01Å; R459-N472 VanDerWaalsContact N-OD1 3.09Å; R459-N472 PolarHBondContact O-N 3.31Å; R459-E491 VanDerWaalsContact CD-OE1 3.27Å; R459-E491 WeakPolarHBondContact CD-OE1 3.12Å; R459-E491 IonicContact CZ-OE1 2.73Å; R459-E491 IonicContact CZ-OE2 3.1Å; R459-E491 IonicContact NE-OE1 2.91Å; R459-E491 PolarHBondContact NE-OE1 2.87Å; R459-E491 IonicContact NH1-OE1 3.03Å; R459-E491 PolarHBondContact NH1-OE1 2.8Å; R459-E491 IonicContact NH1-OE2 3.15Å; R459-E491 PolarHBondContact NH1-OE2 2.78Å; R459-E491 VanDerWaalsContact NH1-OE2 3.15Å; R459-E491 IonicContact NH2-OE1 3.07Å; R459-E491 PolarHBondContact NH2-OE1 2.98Å; R459-E491 IonicContact NH2-OE2 2.7Å; R459-E491 PolarHBondContact NH2-OE2 2.86Å
460	I	67.4	Low	58.7	Low	81 Å²	81	93 Å²	93	42%	0.415	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	105.7	173.8	-61	178.8	0	0	0	106.2	F454 S458 V469	F454-I460 HydrophobicContact CE1-CD1 4.09Å; S458-I460 PolarHBondContact O-N 3.25Å; I460-V469 HydrophobicContact CG2-CG1 3.34Å
461	N	70.5	Confident	60.6	Low	49 Å²	49	90.5 Å²	90.5	26%	0.262	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	106.7	172.9	-72.9	-21.1	0	0	0	108	C470 G473 C475	N461-C470 HydrophobicContact CB-CB 4.33Å; N461-C470 PolarHBondContact N-O 3.29Å; N461-C470 PolarHBondContact O-N 2.61Å; N461-G473 PolarHBondContact ND2-O 2.93Å; N461-C475 PolarHBondContact O-SG 2.77Å
462	I	79.8	Confident	62.6	Low	113 Å²	113	87 Å²	87	58%	0.579	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	125.8	169.4	-57.6	171.6	0	0	0	106.8	M466	I462-M466 HydrophobicContact CG2-SD 4.26Å
463	C	81.7	Confident	65.1	Low	3 Å²	3	83.1 Å²	83.1	2%	0.02	44%	0.442	C	S	.	.			trans	-80.8	162.5	-176.3	-57.9	0	0	0	0	112	D465 M466 S468 C470 C475 T485	C463-D465 PolarHBondContact O-N 3.05Å; C463-M466 PolarHBondContact O-N 3.02Å; C463-S468 WeakPolarHBondContact CB-O 3.4Å; C463-S468 PolarHBondContact N-O 2.93Å; C463-C470 PolarHBondContact SG-SG 2.8Å; C463-C475 WeakPolarHBondContact CA-SG 3.04Å; C463-C475 HydrophobicContact CB-CB 3.65Å; C463-C475 WeakPolarHBondContact CB-SG 3.3Å; C463-C475 PolarHBondContact N-SG 3.43Å; C463-C475 WeakPolarHBondContact SG-CB 2.99Å; C463-C475 CovalentContact SG-SG 2.05Å; C463-C475 PolarHBondContact SG-SG 2.83Å; C463-T485 HydrophobicContact CB-CG2 3.65Å; C463-T485 WeakPolarHBondContact SG-CG2 3.22Å
464	S	78.6	Confident	67.8	Low	127 Å²	127	78.8 Å²	78.8	89%	0.888	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	-175.4	-52.5	0	0	0	0	114	M466	S464-M466 VanDerWaalsContact C-N 3.28Å; S464-M466 PolarHBondContact O-N 3.23Å
465	D	74.5	Confident	70.4	Confident	37 Å²	37	73 Å²	73	20%	0.198	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.3	175.9	63.8	11.6	0	0	0	113.9	C463 K467 S468 T485	C463-D465 PolarHBondContact O-N 3.05Å; D465-K467 PolarHBondContact O-N 3.36Å; D465-K467 PolarHBondContact OD1-N 3.37Å; D465-S468 WeakPolarHBondContact OD1-CB 3.47Å; D465-S468 PolarHBondContact OD1-N 3.08Å; D465-S468 PolarHBondContact OD1-OG 3.19Å; D465-S468 WeakPolarHBondContact OD2-CB 3.14Å; D465-S468 PolarHBondContact OD2-OG 2.82Å; D465-T485 WeakPolarHBondContact OD2-CB 3.36Å; D465-T485 PolarHBondContact OD2-OG1 3.3Å
466	M	69.3	Low	73	Confident	156 Å²	156	64.2 Å²	64.2	77%	0.768	35%	0.351	S	S	*	.	S	Bend	trans	56.6	3.8	-175.2	-64.7	-72.3	-149.2	0	0	115.3	I462 C463 S464	I462-M466 HydrophobicContact CG2-SD 4.26Å; C463-M466 PolarHBondContact O-N 3.02Å; S464-M466 VanDerWaalsContact C-N 3.28Å; S464-M466 PolarHBondContact O-N 3.23Å
467	K	74.4	Confident	75	Confident	106 Å²	106	62.8 Å²	62.8	46%	0.461	34%	0.341	S	S	.	.	S	Bend	trans	-112.2	-17.1	-178.3	-68.4	175.5	-175.1	176	0	111.2	D465 H539 V540	D465-K467 PolarHBondContact O-N 3.36Å; D465-K467 PolarHBondContact OD1-N 3.37Å; K467-H539 CarbonylContact O-C 3.55Å; K467-H539 VanDerWaalsContact O-CA 3.28Å; K467-H539 WeakPolarHBondContact O-CA 3.18Å; K467-V540 PolarHBondContact O-N 3.36Å
468	S	78.4	Confident	76.5	Confident	7 Å²	7	56.6 Å²	56.6	5%	0.049	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.3	-174.1	-63.4	0	0	0	0	111.6	C463 D465 L538	C463-S468 WeakPolarHBondContact CB-O 3.4Å; C463-S468 PolarHBondContact N-O 2.93Å; D465-S468 WeakPolarHBondContact OD1-CB 3.47Å; D465-S468 PolarHBondContact OD1-N 3.08Å; D465-S468 PolarHBondContact OD1-OG 3.19Å; D465-S468 WeakPolarHBondContact OD2-CB 3.14Å; D465-S468 PolarHBondContact OD2-OG 2.82Å; S468-L538 CarbonylContact C-O 3.54Å; S468-L538 VanDerWaalsContact CA-O 3.31Å; S468-L538 WeakPolarHBondContact CA-O 3.43Å
469	V	82.7	Confident	77.5	Confident	21 Å²	21	59.1 Å²	59.1	13%	0.127	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.5	179.6	174	0	0	0	0	110.6	I460 I471 L538 V540	I460-V469 HydrophobicContact CG2-CG1 3.34Å; V469-I471 HydrophobicContact CG1-CG1 4.35Å; V469-L538 HydrophobicContact CB-CB 4.28Å; V469-L538 PolarHBondContact N-O 3.33Å; V469-L538 PolarHBondContact O-N 2.87Å; V469-V540 HydrophobicContact CG2-CG2 3.69Å
470	C	83	Confident	78.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.3	172	-61.1	0	0	0	0	110.6	N461 C463 G473 C475 C487	N461-C470 HydrophobicContact CB-CB 4.33Å; N461-C470 PolarHBondContact N-O 3.29Å; N461-C470 PolarHBondContact O-N 2.61Å; C463-C470 PolarHBondContact SG-SG 2.8Å; C470-G473 WeakPolarHBondContact CB-O 3.16Å; C470-C475 VanDerWaalsContact SG-SG 3.6Å; C470-C487 WeakPolarHBondContact CA-SG 3.34Å; C470-C487 HydrophobicContact CB-CB 3.73Å; C470-C487 WeakPolarHBondContact CB-SG 3.06Å; C470-C487 WeakPolarHBondContact SG-CA 3.13Å; C470-C487 WeakPolarHBondContact SG-CB 3.42Å; C470-C487 CovalentContact SG-SG 2.01Å; C470-C487 PolarHBondContact SG-SG 3.29Å
471	I	77.4	Confident	78.2	Confident	77 Å²	77	59 Å²	59	40%	0.395	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	119.9	177.2	-56	174.2	0	0	0	108.3	V469 G473	V469-I471 HydrophobicContact CG1-CG1 4.35Å; I471-G473 PolarHBondContact O-N 3.05Å; I471-G473 VanDerWaalsContact O-N 3.13Å
472	N	76.7	Confident	77.9	Confident	80 Å²	80	62.3 Å²	62.3	43%	0.428	35%	0.354	S	S	.	.	S	Bend	trans	52.7	27.8	-174.6	-65.1	-14.9	0	0	0	113.8	R459	R459-N472 PolarHBondContact N-OD1 3.01Å; R459-N472 VanDerWaalsContact N-OD1 3.09Å; R459-N472 PolarHBondContact O-N 3.31Å
473	G	82.9	Confident	77	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.01	36%	0.359	C	S	.	.	S	Bend	trans	-139	166	-177.1	0	0	0	0	0	112.3	N461 C470 I471 C488	N461-G473 PolarHBondContact ND2-O 2.93Å; C470-G473 WeakPolarHBondContact CB-O 3.16Å; I471-G473 PolarHBondContact O-N 3.05Å; I471-G473 VanDerWaalsContact O-N 3.13Å; G473-C488 CarbonylContact C-O 3.59Å; G473-C488 WeakPolarHBondContact CA-O 3.5Å
474	T	88.7	Confident	76.5	Confident	22 Å²	22	64.3 Å²	64.3	14%	0.135	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.9	-179.2	-51.4	0	0	0	0	110.4	C476 C487 C488 Y490 N492 A493	T474-C476 PolarHBondContact O-N 3.13Å; T474-C476 PolarHBondContact O-SG 3.23Å; T474-C487 CarbonylContact O-C 3.5Å; T474-C487 WeakPolarHBondContact O-CA 3.13Å; T474-C488 PolarHBondContact N-O 3.3Å; T474-C488 PolarHBondContact O-N 3.3Å; T474-Y490 PolarHBondContact N-O 2.99Å; T474-Y490 PolarHBondContact OG1-O 3.11Å; T474-N492 VanDerWaalsContact OG1-CA 3.31Å; T474-N492 WeakPolarHBondContact OG1-CA 3.33Å; T474-N492 PolarHBondContact OG1-N 2.94Å; T474-A493 HydrophobicContact CG2-CB 4.46Å; T474-A493 PolarHBondContact OG1-N 3.45Å
475	C	89.9	Confident	76.6	Confident	33 Å²	33	59.1 Å²	59.1	22%	0.223	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	121.4	173.7	-66.5	0	0	0	0	109.7	N461 C463 C470 T485	N461-C475 PolarHBondContact O-SG 2.77Å; C463-C475 WeakPolarHBondContact CA-SG 3.04Å; C463-C475 HydrophobicContact CB-CB 3.65Å; C463-C475 WeakPolarHBondContact CB-SG 3.3Å; C463-C475 PolarHBondContact N-SG 3.43Å; C463-C475 WeakPolarHBondContact SG-CB 2.99Å; C463-C475 CovalentContact SG-SG 2.05Å; C463-C475 PolarHBondContact SG-SG 2.83Å; C470-C475 VanDerWaalsContact SG-SG 3.6Å; C475-T485 HydrophobicContact CB-CG2 3.86Å
476	C	89.4	Confident	77.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	119.5	-172	-57.7	0	0	0	0	108.2	T474 N478 L486 C488 C495 K534	T474-C476 PolarHBondContact O-N 3.13Å; T474-C476 PolarHBondContact O-SG 3.23Å; C476-N478 PolarHBondContact O-N 3.08Å; C476-L486 WeakPolarHBondContact CA-O 3.26Å; C476-L486 WeakPolarHBondContact CB-O 3.06Å; C476-L486 PolarHBondContact N-O 2.93Å; C476-L486 PolarHBondContact O-N 2.85Å; C476-C488 WeakPolarHBondContact CB-SG 3.5Å; C476-C488 WeakPolarHBondContact SG-CB 3.38Å; C476-C488 CovalentContact SG-SG 2.03Å; C476-C488 PolarHBondContact SG-SG 3.3Å; C476-C495 HydrophobicContact CB-CB 4.33Å; C476-C495 WeakPolarHBondContact CB-SG 2.99Å; C476-C495 PolarHBondContact SG-SG 3.44Å; C476-K534 HydrophobicContact CB-CD 3.66Å; C476-K534 HydrophobicContact CB-CG 4.39Å
477	S	82.3	Confident	78.1	Confident	93 Å²	93	51.5 Å²	51.5	65%	0.65	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	140.2	-178.5	-50.1	0	0	0	0	111.1	K534	S477-K534 PolarHBondContact O-NZ 3.34Å
478	N	74	Confident	78.7	Confident	28 Å²	28	46.5 Å²	46.5	15%	0.15	27%	0.272	C	S	.	.			trans	-83.5	128.9	168.9	-173.8	-6.6	0	0	0	109.1	C476 N480 D481 S484 L486	C476-N478 PolarHBondContact O-N 3.08Å; N478-N480 VanDerWaalsContact C-N 3.31Å; N478-N480 WeakPolarHBondContact OD1-CB 3.35Å; N478-N480 PolarHBondContact OD1-N 3.12Å; N478-D481 CarbonylContact O-C 3.59Å; N478-S484 WeakPolarHBondContact CB-O 3.42Å; N478-S484 WeakPolarHBondContact CB-OG 3.2Å; N478-S484 PolarHBondContact N-O 3.47Å; N478-S484 PolarHBondContact ND2-OG 3.27Å; N478-L486 HydrophobicContact CB-CD1 3.98Å; N478-L486 HydrophobicContact CB-CG 4.19Å
479	V	71.2	Confident	79	Confident	92 Å²	92	49 Å²	49	56%	0.558	29%	0.288	S	S	*	.	S	Bend	trans	-75.5	-23.9	179	175.8	0	0	0	0	111.4
480	N	68.6	Low	79	Confident	126 Å²	126	52 Å²	52	67%	0.674	30%	0.298	S	S	*	.	S	Bend	trans	-87	-22	-178.7	-60.3	-40.7	0	0	0	113.5	N478	N478-N480 VanDerWaalsContact C-N 3.31Å; N478-N480 WeakPolarHBondContact OD1-CB 3.35Å; N478-N480 PolarHBondContact OD1-N 3.12Å
481	D	68.6	Low	78.6	Confident	68 Å²	68	55.3 Å²	55.3	36%	0.364	31%	0.313	S	S	.	.			trans	-146.8	100.8	176.9	174.3	12	0	0	0	109	N478 L483 S484	N478-D481 CarbonylContact O-C 3.59Å; D481-L483 PolarHBondContact O-N 2.76Å; D481-L483 VanDerWaalsContact O-N 3.08Å; D481-L483 WeakPolarHBondContact OD1-CB 3.02Å; D481-L483 PolarHBondContact OD1-N 2.71Å; D481-S484 WeakPolarHBondContact CB-OG 3.07Å; D481-S484 PolarHBondContact O-N 3.47Å; D481-S484 PolarHBondContact O-OG 2.81Å; D481-S484 WeakPolarHBondContact OD2-CB 3.45Å
482	P	64.7	Low	78.7	Confident	118 Å²	118	55.6 Å²	55.6	77%	0.766	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.9	-180	-21.8	30.8	0	0	0	114.3	S484	P482-S484 VanDerWaalsContact C-N 3.34Å
483	L	61.1	Low	79.2	Confident	130 Å²	130	52.3 Å²	52.3	68%	0.681	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.1	176.8	-73.5	115.7	0	0	0	113.2	D481	D481-L483 PolarHBondContact O-N 2.76Å; D481-L483 VanDerWaalsContact O-N 3.08Å; D481-L483 WeakPolarHBondContact OD1-CB 3.02Å; D481-L483 PolarHBondContact OD1-N 2.71Å
484	S	70.5	Confident	79.5	Confident	29 Å²	29	54.9 Å²	54.9	20%	0.203	32%	0.315	C	S	.	.			trans	-109.9	132.6	178.8	72.4	0	0	0	0	111.4	N478 D481 P482	N478-S484 WeakPolarHBondContact CB-O 3.42Å; N478-S484 WeakPolarHBondContact CB-OG 3.2Å; N478-S484 PolarHBondContact N-O 3.47Å; N478-S484 PolarHBondContact ND2-OG 3.27Å; D481-S484 WeakPolarHBondContact CB-OG 3.07Å; D481-S484 PolarHBondContact O-N 3.47Å; D481-S484 PolarHBondContact O-OG 2.81Å; D481-S484 WeakPolarHBondContact OD2-CB 3.45Å; P482-S484 VanDerWaalsContact C-N 3.34Å
485	T	80	Confident	79.6	Confident	17 Å²	17	56.6 Å²	56.6	10%	0.104	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.2	171.5	-52	0	0	0	0	110.4	C463 D465 C475 A537	C463-T485 HydrophobicContact CB-CG2 3.65Å; C463-T485 WeakPolarHBondContact SG-CG2 3.22Å; D465-T485 WeakPolarHBondContact OD2-CB 3.36Å; D465-T485 PolarHBondContact OD2-OG1 3.3Å; C475-T485 HydrophobicContact CB-CG2 3.86Å; T485-A537 WeakPolarHBondContact O-CB 3.38Å; T485-A537 PolarHBondContact O-N 3.28Å
486	L	85.4	Confident	79.7	Confident	27 Å²	27	55.2 Å²	55.2	14%	0.141	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	151.1	168.5	-63.8	164.8	0	0	0	108.7	C476 N478 G499 K534 I535 R536	C476-L486 WeakPolarHBondContact CA-O 3.26Å; C476-L486 WeakPolarHBondContact CB-O 3.06Å; C476-L486 PolarHBondContact N-O 2.93Å; C476-L486 PolarHBondContact O-N 2.85Å; N478-L486 HydrophobicContact CB-CD1 3.98Å; N478-L486 HydrophobicContact CB-CG 4.19Å; L486-G499 WeakPolarHBondContact CD1-O 3.08Å; L486-K534 HydrophobicContact CB-CB 3.64Å; L486-K534 HydrophobicContact CB-CD 3.86Å; L486-K534 HydrophobicContact CB-CG 4.37Å; L486-K534 HydrophobicContact CD1-CB 4.18Å; L486-K534 HydrophobicContact CD1-CD 4Å; L486-K534 HydrophobicContact CG-CB 4.43Å; L486-I535 CarbonylContact C-O 3.43Å; L486-I535 WeakPolarHBondContact CA-O 3.48Å; L486-R536 HydrophobicContact CD2-CG 4.42Å
487	C	89.4	Confident	79.5	Confident	7 Å²	7	60 Å²	60	5%	0.047	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.9	176.2	-60.2	0	0	0	0	110.9	C470 T474 K534 I535 A537	C470-C487 WeakPolarHBondContact CA-SG 3.34Å; C470-C487 HydrophobicContact CB-CB 3.73Å; C470-C487 WeakPolarHBondContact CB-SG 3.06Å; C470-C487 WeakPolarHBondContact SG-CA 3.13Å; C470-C487 WeakPolarHBondContact SG-CB 3.42Å; C470-C487 CovalentContact SG-SG 2.01Å; C470-C487 PolarHBondContact SG-SG 3.29Å; T474-C487 CarbonylContact O-C 3.5Å; T474-C487 WeakPolarHBondContact O-CA 3.13Å; C487-K534 CarbonylContact O-C 3.56Å; C487-K534 WeakPolarHBondContact O-CA 3.13Å; C487-I535 HydrophobicContact CB-CD1 4.37Å; C487-I535 HydrophobicContact CB-CG1 3.76Å; C487-I535 PolarHBondContact N-O 3.17Å; C487-I535 WeakPolarHBondContact O-CG1 3.46Å; C487-I535 PolarHBondContact O-N 3.02Å; C487-A537 WeakPolarHBondContact SG-CA 3.22Å; C487-A537 WeakPolarHBondContact SG-CB 3.23Å
488	C	88.8	Confident	79.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.3	166.1	-61.7	0	0	0	0	108.4	G473 T474 C476 Y490 A493 C502	G473-C488 CarbonylContact C-O 3.59Å; G473-C488 WeakPolarHBondContact CA-O 3.5Å; T474-C488 PolarHBondContact N-O 3.3Å; T474-C488 PolarHBondContact O-N 3.3Å; C476-C488 WeakPolarHBondContact CB-SG 3.5Å; C476-C488 WeakPolarHBondContact SG-CB 3.38Å; C476-C488 CovalentContact SG-SG 2.03Å; C476-C488 PolarHBondContact SG-SG 3.3Å; C488-Y490 PolarHBondContact O-N 2.04Å; C488-Y490 VanDerWaalsContact O-N 3.09Å; C488-Y490 VanDerWaalsContact O-O 3.14Å; C488-A493 HydrophobicContact CB-CB 3.46Å; C488-A493 VanDerWaalsContact CB-CB 3.46Å; C488-C502 HydrophobicContact CB-CB 3.72Å; C488-C502 WeakPolarHBondContact CB-SG 3.08Å; C488-C502 WeakPolarHBondContact SG-CB 3.18Å
489	P	82.9	Confident	79.8	Confident	59 Å²	59	56.4 Å²	56.4	38%	0.383	32%	0.324	S	S	.	.	S	Bend	trans	-64.6	-12.3	-178.6	-23.1	33.8	0	0	0	114.5	L532 I535	P489-L532 HydrophobicContact CB-CD2 3.91Å; P489-L532 HydrophobicContact CG-CD2 3.72Å; P489-L532 HydrophobicContact CG-CG 4.4Å; P489-I535 HydrophobicContact CG-CD1 4.44Å; P489-I535 HydrophobicContact CG-CG2 4.36Å
490	Y	83.2	Confident	80.4	Confident	86 Å²	86	57.7 Å²	57.7	34%	0.337	32%	0.323	S	S	.	.	S	Bend	trans	-82.8	138	169.8	-62.8	-63.3	0	0	0	111.1	T474 C488 P504 L532	T474-Y490 PolarHBondContact N-O 2.99Å; T474-Y490 PolarHBondContact OG1-O 3.11Å; C488-Y490 PolarHBondContact O-N 2.04Å; C488-Y490 VanDerWaalsContact O-N 3.09Å; C488-Y490 VanDerWaalsContact O-O 3.14Å; Y490-P504 HydrophobicContact CD1-CB 4.19Å; Y490-P504 HydrophobicContact CD2-CB 4.16Å; Y490-P504 HydrophobicContact CE1-CB 4.31Å; Y490-P504 HydrophobicContact CE2-CB 4.27Å; Y490-P504 HydrophobicContact CG-CB 4.12Å; Y490-L532 HydrophobicContact CD2-CD2 3.9Å; Y490-L532 HydrophobicContact CE2-CB 3.9Å; Y490-L532 HydrophobicContact CE2-CD2 3.44Å; Y490-L532 VanDerWaalsContact CE2-CD2 3.44Å; Y490-L532 HydrophobicContact CE2-CG 4.32Å
491	E	75.2	Confident	81.4	Confident	69 Å²	69	53.9 Å²	53.9	32%	0.322	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	128.3	168.7	-164.5	173	-123.4	0	0	110	R459 A493	R459-E491 VanDerWaalsContact CD-OE1 3.27Å; R459-E491 WeakPolarHBondContact CD-OE1 3.12Å; R459-E491 IonicContact CZ-OE1 2.73Å; R459-E491 IonicContact CZ-OE2 3.1Å; R459-E491 IonicContact NE-OE1 2.91Å; R459-E491 PolarHBondContact NE-OE1 2.87Å; R459-E491 IonicContact NH1-OE1 3.03Å; R459-E491 PolarHBondContact NH1-OE1 2.8Å; R459-E491 IonicContact NH1-OE2 3.15Å; R459-E491 PolarHBondContact NH1-OE2 2.78Å; R459-E491 VanDerWaalsContact NH1-OE2 3.15Å; R459-E491 IonicContact NH2-OE1 3.07Å; R459-E491 PolarHBondContact NH2-OE1 2.98Å; R459-E491 IonicContact NH2-OE2 2.7Å; R459-E491 PolarHBondContact NH2-OE2 2.86Å; E491-A493 VanDerWaalsContact C-N 3.35Å; E491-A493 PolarHBondContact O-N 3.21Å
492	N	79.3	Confident	82.6	Confident	82 Å²	82	50.7 Å²	50.7	44%	0.439	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	42.7	-173.5	-51.7	-52.2	0	0	0	114.2	T474 K505	T474-N492 VanDerWaalsContact OG1-CA 3.31Å; T474-N492 WeakPolarHBondContact OG1-CA 3.33Å; T474-N492 PolarHBondContact OG1-N 2.94Å; N492-K505 HydrophobicContact CB-CD 4.18Å; N492-K505 WeakPolarHBondContact O-CB 3.46Å
493	A	86.8	Confident	83.9	Confident	12 Å²	12	45 Å²	45	10%	0.099	25%	0.247	C	C	.	.			trans	-63.9	151	178.6	0	0	0	0	0	112.7	T474 C488 E491 C502 C503	T474-A493 HydrophobicContact CG2-CB 4.46Å; T474-A493 PolarHBondContact OG1-N 3.45Å; C488-A493 HydrophobicContact CB-CB 3.46Å; C488-A493 VanDerWaalsContact CB-CB 3.46Å; E491-A493 VanDerWaalsContact C-N 3.35Å; E491-A493 PolarHBondContact O-N 3.21Å; A493-C502 HydrophobicContact CB-CB 4.37Å; A493-C503 CarbonylContact C-O 3.5Å; A493-C503 VanDerWaalsContact CA-O 3.3Å; A493-C503 WeakPolarHBondContact CA-O 3.03Å; A493-C503 WeakPolarHBondContact CB-O 3.25Å
494	V	90.2	Very high	85.1	Confident	55 Å²	55	39.9 Å²	39.9	33%	0.333	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.1	164.4	178.4	0	0	0	0	108.2	C496 C502 C503 T507	V494-C496 PolarHBondContact O-N 2.91Å; V494-C502 WeakPolarHBondContact O-CA 3.29Å; V494-C503 HydrophobicContact CB-CB 4.17Å; V494-C503 PolarHBondContact N-O 3.39Å; V494-C503 PolarHBondContact O-N 3.21Å; V494-T507 VanDerWaalsContact CG2-O 3.27Å; V494-T507 WeakPolarHBondContact CG2-O 3.39Å
495	C	91.3	Very high	85.8	Confident	57 Å²	57	46 Å²	46	39%	0.385	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.2	175.7	-56.5	0	0	0	0	109	C476	C476-C495 HydrophobicContact CB-CB 4.33Å; C476-C495 WeakPolarHBondContact CB-SG 2.99Å; C476-C495 PolarHBondContact SG-SG 3.44Å
496	C	90.4	Very high	85.9	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.034	27%	0.265	C	S	.	.			trans	-74.9	149.8	174.4	-55.2	0	0	0	0	111	V494 D498 G499 H501 C503 C509 M511 L531	V494-C496 PolarHBondContact O-N 2.91Å; C496-D498 PolarHBondContact O-N 3.18Å; C496-G499 PolarHBondContact O-N 3.13Å; C496-H501 HydrophobicContact CB-CB 4.23Å; C496-H501 VanDerWaalsContact CB-O 3.28Å; C496-H501 WeakPolarHBondContact CB-O 2.95Å; C496-H501 PolarHBondContact N-O 2.86Å; C496-C503 VanDerWaalsContact SG-SG 3.66Å; C496-C509 WeakPolarHBondContact CA-SG 3.36Å; C496-C509 HydrophobicContact CB-CB 3.74Å; C496-C509 WeakPolarHBondContact CB-SG 3.46Å; C496-C509 WeakPolarHBondContact SG-CB 3.39Å; C496-C509 CovalentContact SG-SG 2.04Å; C496-C509 PolarHBondContact SG-SG 3.09Å; C496-M511 HydrophobicContact CB-SD 3.87Å; C496-L531 HydrophobicContact CB-CD2 4.36Å; C496-L531 WeakPolarHBondContact SG-CD2 3.38Å
497	S	85.2	Confident	86	Confident	99 Å²	99	46.9 Å²	46.9	69%	0.692	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.8	-174.9	47.8	0	0	0	0	113.8	G499	S497-G499 PolarHBondContact O-N 3.26Å
498	D	84.4	Confident	85.9	Confident	45 Å²	45	49.8 Å²	49.8	24%	0.241	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.7	177.7	74.2	-14.1	0	0	0	114.4	C496 K500 H501 M511	C496-D498 PolarHBondContact O-N 3.18Å; D498-K500 PolarHBondContact O-N 2.78Å; D498-K500 VanDerWaalsContact O-N 3.1Å; D498-K500 PolarHBondContact OD1-N 2.86Å; D498-H501 PolarHBondContact OD1-N 3.24Å; D498-H501 IonicContact OD2-CE1 3.51Å; D498-H501 IonicContact OD2-CG 3.48Å; D498-H501 IonicContact OD2-ND1 2.69Å; D498-H501 PolarHBondContact OD2-ND1 3.44Å; D498-M511 HydrophobicContact CB-CE 3.54Å; D498-M511 HydrophobicContact CB-SD 4.44Å; D498-M511 WeakPolarHBondContact OD2-CE 2.96Å
499	G	79.3	Confident	85.9	Confident	1 Å²	1	51 Å²	51	1%	0.01	29%	0.287	C	S	.	.	S	Bend	trans	76.1	-10.9	179.2	0	0	0	0	0	114.9	L486 C496 S497 K534	L486-G499 WeakPolarHBondContact CD1-O 3.08Å; C496-G499 PolarHBondContact O-N 3.13Å; S497-G499 PolarHBondContact O-N 3.26Å; G499-K534 WeakPolarHBondContact O-CD 3.29Å; G499-K534 WeakPolarHBondContact O-CE 2.96Å; G499-K534 PolarHBondContact O-NZ 3.09Å
500	K	84.3	Confident	86.2	Confident	119 Å²	119	49.5 Å²	49.5	52%	0.517	28%	0.276	S	S	.	.	S	Bend	trans	-109.3	-28.6	-173.1	-65.6	179.1	-177.1	177.2	0	113	D498 T533 K534	D498-K500 PolarHBondContact O-N 2.78Å; D498-K500 VanDerWaalsContact O-N 3.1Å; D498-K500 PolarHBondContact OD1-N 2.86Å; K500-T533 WeakPolarHBondContact O-CA 3.33Å; K500-K534 WeakPolarHBondContact O-CG 3.2Å; K500-K534 PolarHBondContact O-N 3.09Å
501	H	89.5	Confident	86.2	Confident	47 Å²	47	49 Å²	49	22%	0.218	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	163.6	-172.2	-64.1	108.4	0	0	0	113.4	C496 D498 L531 L532 K534	C496-H501 HydrophobicContact CB-CB 4.23Å; C496-H501 VanDerWaalsContact CB-O 3.28Å; C496-H501 WeakPolarHBondContact CB-O 2.95Å; C496-H501 PolarHBondContact N-O 2.86Å; D498-H501 PolarHBondContact OD1-N 3.24Å; D498-H501 IonicContact OD2-CE1 3.51Å; D498-H501 IonicContact OD2-CG 3.48Å; D498-H501 IonicContact OD2-ND1 2.69Å; D498-H501 PolarHBondContact OD2-ND1 3.44Å; H501-L531 HydrophobicContact CB-CB 3.77Å; H501-L531 HydrophobicContact CB-CD1 4.39Å; H501-L531 HydrophobicContact CB-CD2 3.8Å; H501-L531 HydrophobicContact CB-CG 4.2Å; H501-L532 CarbonylContact C-O 3.4Å; H501-L532 VanDerWaalsContact CA-O 3.25Å; H501-L532 WeakPolarHBondContact CA-O 3.03Å; H501-K534 WeakPolarHBondContact O-CE 3.04Å
502	C	92.3	Very high	86.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.6	175.8	63.6	0	0	0	0	111.8	C488 A493 V494 L532 K534	C488-C502 HydrophobicContact CB-CB 3.72Å; C488-C502 WeakPolarHBondContact CB-SG 3.08Å; C488-C502 WeakPolarHBondContact SG-CB 3.18Å; A493-C502 HydrophobicContact CB-CB 4.37Å; V494-C502 WeakPolarHBondContact O-CA 3.29Å; C502-L532 PolarHBondContact N-O 3.48Å; C502-L532 PolarHBondContact O-N 3.02Å; C502-L532 PolarHBondContact SG-O 2.86Å; C502-K534 HydrophobicContact CB-CG 4.35Å
503	C	91.8	Very high	86.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	149	-178.3	-76.2	0	0	0	0	110	A493 V494 C496 T507 C509 C516	A493-C503 CarbonylContact C-O 3.5Å; A493-C503 VanDerWaalsContact CA-O 3.3Å; A493-C503 WeakPolarHBondContact CA-O 3.03Å; A493-C503 WeakPolarHBondContact CB-O 3.25Å; V494-C503 HydrophobicContact CB-CB 4.17Å; V494-C503 PolarHBondContact N-O 3.39Å; V494-C503 PolarHBondContact O-N 3.21Å; C496-C503 VanDerWaalsContact SG-SG 3.66Å; C503-T507 WeakPolarHBondContact CB-OG1 3.45Å; C503-C509 PolarHBondContact SG-SG 3.08Å; C503-C516 WeakPolarHBondContact CA-SG 3.32Å; C503-C516 HydrophobicContact CB-CB 3.7Å; C503-C516 WeakPolarHBondContact CB-SG 3.49Å; C503-C516 WeakPolarHBondContact SG-CB 3.37Å; C503-C516 CovalentContact SG-SG 2.02Å; C503-C516 PolarHBondContact SG-SG 2.89Å
504	P	86.8	Confident	86	Confident	22 Å²	22	56.4 Å²	56.4	14%	0.143	33%	0.325	C	S	.	.			trans	-63.7	158.4	175.5	27	-33.6	0	0	0	111.3	Y490 G506 T507 I529	Y490-P504 HydrophobicContact CD1-CB 4.19Å; Y490-P504 HydrophobicContact CD2-CB 4.16Å; Y490-P504 HydrophobicContact CE1-CB 4.31Å; Y490-P504 HydrophobicContact CE2-CB 4.27Å; Y490-P504 HydrophobicContact CG-CB 4.12Å; P504-G506 PolarHBondContact O-N 2.93Å; P504-T507 WeakPolarHBondContact CD-OG1 3.29Å; P504-T507 HydrophobicContact CG-CG2 4.18Å; P504-T507 PolarHBondContact O-N 3.29Å; P504-T507 PolarHBondContact O-OG1 2.87Å; P504-I529 HydrophobicContact CG-CD1 3.85Å
505	K	85.2	Confident	85.7	Confident	157 Å²	157	53.9 Å²	53.9	68%	0.683	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	132.2	175.7	-172.9	-174.1	176.5	-173.6	0	110.7	N492	N492-K505 HydrophobicContact CB-CD 4.18Å; N492-K505 WeakPolarHBondContact O-CB 3.46Å
506	G	81.9	Confident	85.5	Confident	52 Å²	52	51.1 Å²	51.1	54%	0.536	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	8.8	178.2	0	0	0	0	0	115.1	P504	P504-G506 PolarHBondContact O-N 2.93Å
507	T	88.6	Confident	85.2	Confident	10 Å²	10	54.5 Å²	54.5	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	153.2	172.2	58.8	0	0	0	0	111.1	V494 C503 P504 C516 I517 I518 I529	V494-T507 VanDerWaalsContact CG2-O 3.27Å; V494-T507 WeakPolarHBondContact CG2-O 3.39Å; C503-T507 WeakPolarHBondContact CB-OG1 3.45Å; P504-T507 WeakPolarHBondContact CD-OG1 3.29Å; P504-T507 HydrophobicContact CG-CG2 4.18Å; P504-T507 PolarHBondContact O-N 3.29Å; P504-T507 PolarHBondContact O-OG1 2.87Å; T507-C516 HydrophobicContact CG2-CB 4.33Å; T507-I517 CarbonylContact C-O 3.31Å; T507-I517 VanDerWaalsContact CA-O 3.24Å; T507-I517 WeakPolarHBondContact CA-O 3.41Å; T507-I517 WeakPolarHBondContact CB-O 3.14Å; T507-I518 HydrophobicContact CG2-CG1 3.82Å; T507-I529 HydrophobicContact CG2-CD1 4.48Å
508	T	87.2	Confident	84.8	Confident	69 Å²	69	54.5 Å²	54.5	42%	0.423	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.1	176.2	-54	0	0	0	0	108.8	D510 C516 I517	T508-D510 PolarHBondContact O-N 3.02Å; T508-C516 CarbonylContact O-C 3.46Å; T508-C516 WeakPolarHBondContact O-CA 3.32Å; T508-I517 PolarHBondContact N-O 3.07Å; T508-I517 WeakPolarHBondContact O-CG1 3.36Å; T508-I517 PolarHBondContact O-N 2.8Å
509	C	89.1	Confident	83.5	Confident	26 Å²	26	56.8 Å²	56.8	18%	0.176	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119.8	177.7	-54.1	0	0	0	0	110.6	C496 C503 M511 L531	C496-C509 WeakPolarHBondContact CA-SG 3.36Å; C496-C509 HydrophobicContact CB-CB 3.74Å; C496-C509 WeakPolarHBondContact CB-SG 3.46Å; C496-C509 WeakPolarHBondContact SG-CB 3.39Å; C496-C509 CovalentContact SG-SG 2.04Å; C496-C509 PolarHBondContact SG-SG 3.09Å; C503-C509 PolarHBondContact SG-SG 3.08Å; C509-M511 HydrophobicContact CB-SD 4Å; C509-L531 HydrophobicContact CB-CD2 4.35Å
510	D	88.1	Confident	82.4	Confident	27 Å²	27	64.6 Å²	64.6	14%	0.144	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	92.6	166.2	-177.7	-10	0	0	0	108.6	T508 I512 N513 G514 G515 I517	T508-D510 PolarHBondContact O-N 3.02Å; D510-I512 PolarHBondContact O-N 2.62Å; D510-I512 PolarHBondContact OD1-N 3.45Å; D510-N513 PolarHBondContact OD1-N 2.79Å; D510-N513 WeakPolarHBondContact OD2-CB 3.49Å; D510-N513 PolarHBondContact OD2-ND2 3.17Å; D510-G514 PolarHBondContact O-N 3.4Å; D510-G515 CarbonylContact C-O 3.58Å; D510-G515 WeakPolarHBondContact CA-O 3.36Å; D510-G515 WeakPolarHBondContact CB-O 3.4Å; D510-G515 PolarHBondContact N-O 3.25Å; D510-G515 PolarHBondContact O-N 3.45Å; D510-I517 HydrophobicContact CB-CD1 4.44Å; D510-I517 HydrophobicContact CB-CG1 4.32Å; D510-I517 HydrophobicContact CB-CG2 3.81Å
511	M	82.6	Confident	80.4	Confident	74 Å²	74	68.9 Å²	68.9	37%	0.365	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.1	-179.3	-60.9	-52.1	-46.4	0	0	113.2	C496 D498 C509 L531	C496-M511 HydrophobicContact CB-SD 3.87Å; D498-M511 HydrophobicContact CB-CE 3.54Å; D498-M511 HydrophobicContact CB-SD 4.44Å; D498-M511 WeakPolarHBondContact OD2-CE 2.96Å; C509-M511 HydrophobicContact CB-SD 4Å; M511-L531 HydrophobicContact CE-CD1 4.2Å; M511-L531 HydrophobicContact SD-CD1 4.34Å
512	I	81.6	Confident	78	Confident	157 Å²	157	70 Å²	70	81%	0.805	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-45.8	-177.8	-59.1	174.9	0	0	0	109.3	D510	D510-I512 PolarHBondContact O-N 2.62Å; D510-I512 PolarHBondContact OD1-N 3.45Å
513	N	78	Confident	75.6	Confident	126 Å²	126	78.2 Å²	78.2	67%	0.674	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.7	-179	-61.4	-53.7	0	0	0	113.7	D510	D510-N513 PolarHBondContact OD1-N 2.79Å; D510-N513 WeakPolarHBondContact OD2-CB 3.49Å; D510-N513 PolarHBondContact OD2-ND2 3.17Å
514	G	78.5	Confident	72.8	Confident	37 Å²	37	83.7 Å²	83.7	38%	0.381	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	30.8	178.8	0	0	0	0	0	113.7	D510 L531	D510-G514 PolarHBondContact O-N 3.4Å; G514-L531 PolarHBondContact O-N 2.92Å
515	G	83.6	Confident	70.7	Confident	1 Å²	1	92 Å²	92	1%	0.01	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	178	-171.7	0	0	0	0	0	114.6	D510 I529	D510-G515 CarbonylContact C-O 3.58Å; D510-G515 WeakPolarHBondContact CA-O 3.36Å; D510-G515 WeakPolarHBondContact CB-O 3.4Å; D510-G515 PolarHBondContact N-O 3.25Å; D510-G515 PolarHBondContact O-N 3.45Å; G515-I529 CarbonylContact C-O 3.51Å; G515-I529 VanDerWaalsContact CA-O 3.26Å; G515-I529 WeakPolarHBondContact CA-O 2.89Å
516	C	87.3	Confident	68.5	Low	0 Å²	0	89.5 Å²	89.5	0%	0	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.4	173.5	-53.5	0	0	0	0	108.1	C503 T507 T508 I529	C503-C516 WeakPolarHBondContact CA-SG 3.32Å; C503-C516 HydrophobicContact CB-CB 3.7Å; C503-C516 WeakPolarHBondContact CB-SG 3.49Å; C503-C516 WeakPolarHBondContact SG-CB 3.37Å; C503-C516 CovalentContact SG-SG 2.02Å; C503-C516 PolarHBondContact SG-SG 2.89Å; T507-C516 HydrophobicContact CG2-CB 4.33Å; T508-C516 CarbonylContact O-C 3.46Å; T508-C516 WeakPolarHBondContact O-CA 3.32Å; C516-I529 HydrophobicContact CB-CB 4.18Å; C516-I529 PolarHBondContact N-O 3.06Å; C516-I529 PolarHBondContact O-N 3.31Å
517	I	84.8	Confident	67	Low	76 Å²	76	93.7 Å²	93.7	39%	0.39	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.9	-177.2	58	170.9	0	0	0	110.7	T507 T508 D510	T507-I517 CarbonylContact C-O 3.31Å; T507-I517 VanDerWaalsContact CA-O 3.24Å; T507-I517 WeakPolarHBondContact CA-O 3.41Å; T507-I517 WeakPolarHBondContact CB-O 3.14Å; T508-I517 PolarHBondContact N-O 3.07Å; T508-I517 WeakPolarHBondContact O-CG1 3.36Å; T508-I517 PolarHBondContact O-N 2.8Å; D510-I517 HydrophobicContact CB-CD1 4.44Å; D510-I517 HydrophobicContact CB-CG1 4.32Å; D510-I517 HydrophobicContact CB-CG2 3.81Å
518	I	75.5	Confident	65.8	Low	99 Å²	99	96.7 Å²	96.7	51%	0.508	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	124.8	176.5	-61.3	164.8	0	0	0	108.2	T507 Q520	T507-I518 HydrophobicContact CG2-CG1 3.82Å; I518-Q520 HydrophobicContact CG2-CB 4.42Å; I518-Q520 HydrophobicContact CG2-CG 4.15Å; I518-Q520 PolarHBondContact O-N 3.29Å
519	S	57.9	Low	65	Low	93 Å²	93	96.5 Å²	96.5	65%	0.65	55%	0.545	S	S	*	.			trans	-80.1	64.2	179.2	60.7	0	0	0	0	111.9
520	Q	54.9	Low	64.5	Low	165 Å²	165	100 Å²	100	77%	0.771	57%	0.568	S	S	*	*			trans	-120.2	114.7	167.6	-71.8	-168.9	-22.9	0	0	109.6	I518 G522	I518-Q520 HydrophobicContact CG2-CB 4.42Å; I518-Q520 HydrophobicContact CG2-CG 4.15Å; I518-Q520 PolarHBondContact O-N 3.29Å; Q520-G522 PolarHBondContact O-N 2.7Å; Q520-G522 VanDerWaalsContact O-N 3.12Å
521	E	43.9	Very low	64.2	Low	209 Å²	209	99.9 Å²	99.9	98%	0.977	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	109	166.8	-66.2	176.4	155.4	0	0	108.5
522	G	38.1	Very low	64.1	Low	70 Å²	70	99.2 Å²	99.2	72%	0.722	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.9	-3.4	166.4	0	0	0	0	0	120.4	Q520	Q520-G522 PolarHBondContact O-N 2.7Å; Q520-G522 VanDerWaalsContact O-N 3.12Å
523	L	42.5	Very low	64.2	Low	173 Å²	173	95.8 Å²	95.8	91%	0.906	55%	0.551	S	S	*	*			trans	-146.6	101.4	174.5	-142	71.5	0	0	0	114.6	K525	L523-K525 PolarHBondContact O-N 3.05Å
524	S	33.4	Very low	64.5	Low	114 Å²	114	90.5 Å²	90.5	80%	0.797	52%	0.522	S	S	*	.			trans	-75	96.3	169.8	34	0	0	0	0	111.4
525	K	42.7	Very low	64.7	Low	196 Å²	196	93.5 Å²	93.5	85%	0.852	53%	0.528	S	S	*	.	S	Bend	trans	174	100.4	141.9	-97.4	164.3	-177.9	178.4	0	112.4	L523	L523-K525 PolarHBondContact O-N 3.05Å
526	S	38.1	Very low	64.6	Low	105 Å²	105	104.2 Å²	104.2	73%	0.734	57%	0.569	S	S	*	*			trans	37.6	86.2	152.5	67.5	0	0	0	0	120
527	N	49.9	Very low	64	Low	141 Å²	141	105 Å²	105	75%	0.754	58%	0.575	S	S	*	*			trans	-127.2	69.3	148.3	-81.9	-25.4	0	0	0	108.6	I529	N527-I529 PolarHBondContact O-N 2.73Å
528	S	64.5	Low	63.3	Low	73 Å²	73	106.2 Å²	106.2	51%	0.51	58%	0.582	S	S	.	*			trans	-75.4	109.7	169.1	52.7	0	0	0	0	108.4
529	I	70.4	Confident	62.6	Low	64 Å²	64	107 Å²	107	33%	0.328	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	128.7	168.3	-58.4	170.8	0	0	0	106.3	P504 T507 G515 C516 N527 L531	P504-I529 HydrophobicContact CG-CD1 3.85Å; T507-I529 HydrophobicContact CG2-CD1 4.48Å; G515-I529 CarbonylContact C-O 3.51Å; G515-I529 VanDerWaalsContact CA-O 3.26Å; G515-I529 WeakPolarHBondContact CA-O 2.89Å; C516-I529 HydrophobicContact CB-CB 4.18Å; C516-I529 PolarHBondContact N-O 3.06Å; C516-I529 PolarHBondContact O-N 3.31Å; N527-I529 PolarHBondContact O-N 2.73Å; I529-L531 PolarHBondContact O-N 2.88Å
530	P	78.3	Confident	62.4	Low	99 Å²	99	106.5 Å²	106.5	64%	0.643	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-59.5	143.1	177.5	24.3	-32.9	0	0	0	110.3	L532	P530-L532 PolarHBondContact O-N 2.62Å
531	L	81.8	Confident	62	Low	26 Å²	26	104 Å²	104	14%	0.136	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-54.8	126.2	172.1	-76.6	165.9	0	0	0	110.5	C496 H501 C509 M511 G514 I529	C496-L531 HydrophobicContact CB-CD2 4.36Å; C496-L531 WeakPolarHBondContact SG-CD2 3.38Å; H501-L531 HydrophobicContact CB-CB 3.77Å; H501-L531 HydrophobicContact CB-CD1 4.39Å; H501-L531 HydrophobicContact CB-CD2 3.8Å; H501-L531 HydrophobicContact CB-CG 4.2Å; C509-L531 HydrophobicContact CB-CD2 4.35Å; M511-L531 HydrophobicContact CE-CD1 4.2Å; M511-L531 HydrophobicContact SD-CD1 4.34Å; G514-L531 PolarHBondContact O-N 2.92Å; I529-L531 PolarHBondContact O-N 2.88Å
532	L	81.3	Confident	61.7	Low	59 Å²	59	99.5 Å²	99.5	31%	0.309	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.5	131.8	177.8	-175.9	64	0	0	0	110.5	P489 Y490 H501 C502 P530	P489-L532 HydrophobicContact CB-CD2 3.91Å; P489-L532 HydrophobicContact CG-CD2 3.72Å; P489-L532 HydrophobicContact CG-CG 4.4Å; Y490-L532 HydrophobicContact CD2-CD2 3.9Å; Y490-L532 HydrophobicContact CE2-CB 3.9Å; Y490-L532 HydrophobicContact CE2-CD2 3.44Å; Y490-L532 VanDerWaalsContact CE2-CD2 3.44Å; Y490-L532 HydrophobicContact CE2-CG 4.32Å; H501-L532 CarbonylContact C-O 3.4Å; H501-L532 VanDerWaalsContact CA-O 3.25Å; H501-L532 WeakPolarHBondContact CA-O 3.03Å; C502-L532 PolarHBondContact N-O 3.48Å; C502-L532 PolarHBondContact O-N 3.02Å; C502-L532 PolarHBondContact SG-O 2.86Å; P530-L532 PolarHBondContact O-N 2.62Å
533	T	83.8	Confident	61.8	Low	85 Å²	85	105.6 Å²	105.6	52%	0.521	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.7	133.6	177.8	-42.3	0	0	0	0	111	K500	K500-T533 WeakPolarHBondContact O-CA 3.33Å
534	K	84	Confident	61.6	Low	16 Å²	16	104.3 Å²	104.3	7%	0.07	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-68.1	142.3	174.8	-53.9	173.3	-173.3	173.1	0	110.1	C476 S477 L486 C487 G499 K500 H501 C502	C476-K534 HydrophobicContact CB-CD 3.66Å; C476-K534 HydrophobicContact CB-CG 4.39Å; S477-K534 PolarHBondContact O-NZ 3.34Å; L486-K534 HydrophobicContact CB-CB 3.64Å; L486-K534 HydrophobicContact CB-CD 3.86Å; L486-K534 HydrophobicContact CB-CG 4.37Å; L486-K534 HydrophobicContact CD1-CB 4.18Å; L486-K534 HydrophobicContact CD1-CD 4Å; L486-K534 HydrophobicContact CG-CB 4.43Å; C487-K534 CarbonylContact O-C 3.56Å; C487-K534 WeakPolarHBondContact O-CA 3.13Å; G499-K534 WeakPolarHBondContact O-CD 3.29Å; G499-K534 WeakPolarHBondContact O-CE 2.96Å; G499-K534 PolarHBondContact O-NZ 3.09Å; K500-K534 WeakPolarHBondContact O-CG 3.2Å; K500-K534 PolarHBondContact O-N 3.09Å; H501-K534 WeakPolarHBondContact O-CE 3.04Å; C502-K534 HydrophobicContact CB-CG 4.35Å
535	I	82.5	Confident	61.5	Low	99 Å²	99	106.6 Å²	106.6	51%	0.508	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.8	163.7	174.7	62.4	178.2	0	0	0	110.9	L486 C487 P489	L486-I535 CarbonylContact C-O 3.43Å; L486-I535 WeakPolarHBondContact CA-O 3.48Å; C487-I535 HydrophobicContact CB-CD1 4.37Å; C487-I535 HydrophobicContact CB-CG1 3.76Å; C487-I535 PolarHBondContact N-O 3.17Å; C487-I535 WeakPolarHBondContact O-CG1 3.46Å; C487-I535 PolarHBondContact O-N 3.02Å; P489-I535 HydrophobicContact CG-CD1 4.44Å; P489-I535 HydrophobicContact CG-CG2 4.36Å
536	R	80.3	Confident	60.9	Low	226 Å²	226	101.7 Å²	101.7	85%	0.853	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.8	137.1	176.7	-69.1	-176.5	-177.7	-179.3	1.4	110.8	L486	L486-R536 HydrophobicContact CD2-CG 4.42Å
537	A	75.2	Confident	60.5	Low	17 Å²	17	103.8 Å²	103.8	14%	0.14	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-74.4	151.5	172.1	0	0	0	0	0	111.6	T485 C487 H539	T485-A537 WeakPolarHBondContact O-CB 3.38Å; T485-A537 PolarHBondContact O-N 3.28Å; C487-A537 WeakPolarHBondContact SG-CA 3.22Å; C487-A537 WeakPolarHBondContact SG-CB 3.23Å; A537-H539 PolarHBondContact O-N 2.64Å
538	L	71.2	Confident	59.9	Low	101 Å²	101	102.7 Å²	102.7	53%	0.529	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.9	121.5	179.8	-147.2	80.8	0	0	0	109.3	S468 V469	S468-L538 CarbonylContact C-O 3.54Å; S468-L538 VanDerWaalsContact CA-O 3.31Å; S468-L538 WeakPolarHBondContact CA-O 3.43Å; V469-L538 HydrophobicContact CB-CB 4.28Å; V469-L538 PolarHBondContact N-O 3.33Å; V469-L538 PolarHBondContact O-N 2.87Å
539	H	60.1	Low	58.4	Low	116 Å²	116	102.1 Å²	102.1	54%	0.537	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.3	-176.7	-168.9	-88.3	0	0	0	111.7	K467 A537 T541	K467-H539 CarbonylContact O-C 3.55Å; K467-H539 VanDerWaalsContact O-CA 3.28Å; K467-H539 WeakPolarHBondContact O-CA 3.18Å; A537-H539 PolarHBondContact O-N 2.64Å; H539-T541 VanDerWaalsContact ND1-CG2 3.33Å; H539-T541 WeakPolarHBondContact ND1-CG2 3.26Å; H539-T541 PolarHBondContact O-N 2.99Å
540	V	53.1	Low	56.7	Low	83 Å²	83	103 Å²	103	50%	0.503	56%	0.555	S	S	.	*			trans	-87	93.6	175.6	-173.5	0	0	0	0	108.6	K467 V469 S542	K467-V540 PolarHBondContact O-N 3.36Å; V469-V540 HydrophobicContact CG2-CG2 3.69Å; V540-S542 PolarHBondContact O-N 2.71Å
541	T	46.9	Very low	54.8	Low	111 Å²	111	103.6 Å²	103.6	68%	0.681	55%	0.548	S	S	*	.			trans	-79.1	105.2	170	51.9	0	0	0	0	110.3	H539 K543	H539-T541 VanDerWaalsContact ND1-CG2 3.33Å; H539-T541 WeakPolarHBondContact ND1-CG2 3.26Å; H539-T541 PolarHBondContact O-N 2.99Å; T541-K543 PolarHBondContact O-N 3.33Å; T541-K543 VanDerWaalsContact O-N 3.15Å
542	S	38	Very low	53.2	Low	115 Å²	115	103.5 Å²	103.5	80%	0.804	55%	0.548	S	S	*	.			trans	-69.2	102.2	170.1	-176.1	0	0	0	0	110.4	V540	V540-S542 PolarHBondContact O-N 2.71Å
543	K	40.8	Very low	52.6	Low	198 Å²	198	104.3 Å²	104.3	86%	0.861	55%	0.55	S	S	*	*			trans	-113	108.3	155.6	-90.5	-172.2	175.7	179.6	0	108.2	T541	T541-K543 PolarHBondContact O-N 3.33Å; T541-K543 VanDerWaalsContact O-N 3.15Å
544	N	36.7	Very low	52.4	Low	146 Å²	146	105.4 Å²	105.4	78%	0.781	55%	0.552	S	S	*	*			trans	62.6	110.2	160	-68	-7.5	0	0	0	119.5	T546	N544-T546 PolarHBondContact O-N 2.84Å; N544-T546 VanDerWaalsContact O-N 3.08Å
545	N	31.4	Very low	52.4	Low	163 Å²	163	104.8 Å²	104.8	87%	0.872	55%	0.549	S	S	*	.			trans	-43	97	165.9	-168.6	15.8	0	0	0	113.9
546	T	29.7	Very low	52.2	Low	92 Å²	92	103.8 Å²	103.8	56%	0.564	55%	0.549	S	S	*	.			trans	-158.8	96.6	151.6	26.6	0	0	0	0	105.6	N544 S548	N544-T546 PolarHBondContact O-N 2.84Å; N544-T546 VanDerWaalsContact O-N 3.08Å; T546-S548 PolarHBondContact O-N 3.37Å
547	Q	30.9	Very low	51.7	Low	149 Å²	149	96.4 Å²	96.4	70%	0.696	54%	0.544	S	S	*	.			trans	37.6	79.7	138.2	-110	-174.1	3.9	0	0	114.2	I549	Q547-I549 HydrophobicContact CB-CD1 3.4Å; Q547-I549 HydrophobicContact CB-CG1 3.44Å; Q547-I549 VanDerWaalsContact CB-CG1 3.44Å; Q547-I549 HydrophobicContact CG-CD1 3.18Å; Q547-I549 HydrophobicContact CG-CG1 3.36Å; Q547-I549 WeakPolarHBondContact O-CG1 3.34Å; Q547-I549 PolarHBondContact O-N 2.03Å
548	S	37.1	Very low	51.4	Low	118 Å²	118	98.1 Å²	98.1	83%	0.825	56%	0.562	S	S	*	*			trans	-92.2	45.1	165.1	-76.9	0	0	0	0	110.2	T546	T546-S548 PolarHBondContact O-N 3.37Å
549	I	33.1	Very low	51.4	Low	61 Å²	61	102.4 Å²	102.4	31%	0.313	58%	0.577	S	S	.	*	S	Bend		-14	134.6	107.5	-25.4	172.4	0	0	0	111.4	Q547 F551 T552	Q547-I549 HydrophobicContact CB-CD1 3.4Å; Q547-I549 HydrophobicContact CB-CG1 3.44Å; Q547-I549 VanDerWaalsContact CB-CG1 3.44Å; Q547-I549 HydrophobicContact CG-CD1 3.18Å; Q547-I549 HydrophobicContact CG-CG1 3.36Å; Q547-I549 WeakPolarHBondContact O-CG1 3.34Å; Q547-I549 PolarHBondContact O-N 2.03Å; I549-F551 PolarHBondContact O-N 3.48Å; I549-T552 HydrophobicContact CG2-CG2 4.18Å
550	V	35.1	Very low	52	Low	84 Å²	84	97.8 Å²	97.8	51%	0.509	56%	0.559	S	S	.	*			trans	-33.9	114.5	143.3	177.1	0	0	0	0	104.5	T552 P563	V550-T552 HydrophobicContact CB-CG2 3.58Å; V550-T552 HydrophobicContact CG1-CG2 3.55Å; V550-T552 WeakPolarHBondContact O-CA 3.41Å; V550-T552 WeakPolarHBondContact O-CB 3.16Å; V550-T552 WeakPolarHBondContact O-CG2 3.36Å; V550-T552 PolarHBondContact O-N 2.05Å; V550-P563 HydrophobicContact CG1-CB 3.74Å; V550-P563 HydrophobicContact CG1-CG 3.71Å
551	F	37	Very low	53.4	Low	111 Å²	111	100 Å²	100	49%	0.487	56%	0.562	S	S	.	*			trans	-58.3	103.6	177.4	-112.4	-92.6	0	0	0	102.9	I549 Q553 C562 P563 D564	I549-F551 PolarHBondContact O-N 3.48Å; F551-Q553 PolarHBondContact O-N 2.89Å; F551-C562 VanDerWaalsContact O-O 3.09Å; F551-P563 CarbonylContact O-C 3.52Å; F551-P563 VanDerWaalsContact O-C 3.3Å; F551-P563 WeakPolarHBondContact O-CA 3.11Å; F551-D564 HydrophobicContact CB-CB 4.09Å; F551-D564 WeakPolarHBondContact CB-OD1 3.1Å; F551-D564 WeakPolarHBondContact CB-OD2 3.33Å; F551-D564 WeakPolarHBondContact CD1-OD2 3.06Å; F551-D564 WeakPolarHBondContact CG-OD2 3.23Å; F551-D564 PolarHBondContact O-N 3.18Å
552	T	49.5	Very low	55	Low	23 Å²	23	94.7 Å²	94.7	14%	0.141	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	97.6	-168.2	46.6	0	0	0	0	101.2	I549 V550 I554 K561 C562	I549-T552 HydrophobicContact CG2-CG2 4.18Å; V550-T552 HydrophobicContact CB-CG2 3.58Å; V550-T552 HydrophobicContact CG1-CG2 3.55Å; V550-T552 WeakPolarHBondContact O-CA 3.41Å; V550-T552 WeakPolarHBondContact O-CB 3.16Å; V550-T552 WeakPolarHBondContact O-CG2 3.36Å; V550-T552 PolarHBondContact O-N 2.05Å; T552-I554 VanDerWaalsContact C-N 3.32Å; T552-I554 PolarHBondContact O-N 3.47Å; T552-K561 HydrophobicContact CG2-CB 3.46Å; T552-K561 VanDerWaalsContact CG2-CB 3.46Å; T552-K561 HydrophobicContact CG2-CD 4.22Å; T552-K561 HydrophobicContact CG2-CG 4.11Å; T552-C562 CarbonylContact C-O 3.54Å; T552-C562 WeakPolarHBondContact CA-O 3.2Å
553	Q	68.1	Low	57.1	Low	76 Å²	76	91.4 Å²	91.4	36%	0.355	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	116.1	156.3	60.5	175.3	14.3	0	0	105.3	F551 C555 C562 S566 C568	F551-Q553 PolarHBondContact O-N 2.89Å; Q553-C555 PolarHBondContact O-N 3.47Å; Q553-C562 HydrophobicContact CG-CB 4.01Å; Q553-C562 PolarHBondContact N-O 3.06Å; Q553-C562 PolarHBondContact O-N 2.89Å; Q553-S566 PolarHBondContact NE2-O 2.03Å; Q553-C568 VanDerWaalsContact NE2-N 3.17Å; Q553-C568 PolarHBondContact NE2-SG 3.3Å
554	I	79.4	Confident	58.5	Low	109 Å²	109	86.6 Å²	86.6	56%	0.559	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	114.1	176	-65	174.7	0	0	0	103.5	T552	T552-I554 VanDerWaalsContact C-N 3.32Å; T552-I554 PolarHBondContact O-N 3.47Å
555	C	84.4	Confident	60.2	Low	2 Å²	2	83.3 Å²	83.3	1%	0.014	48%	0.477	C	S	.	.			trans	-61.2	149.5	178.6	-58	0	0	0	0	109.4	Q553 G557 G558 A560 C562 C568 Y576	Q553-C555 PolarHBondContact O-N 3.47Å; C555-G557 PolarHBondContact O-N 3.24Å; C555-G558 PolarHBondContact O-N 3.16Å; C555-A560 HydrophobicContact CB-CB 4.12Å; C555-A560 PolarHBondContact N-O 2.03Å; C555-C562 PolarHBondContact SG-SG 3.2Å; C555-C568 WeakPolarHBondContact CA-SG 3.13Å; C555-C568 HydrophobicContact CB-CB 3.64Å; C555-C568 WeakPolarHBondContact CB-SG 3.33Å; C555-C568 WeakPolarHBondContact SG-CB 3.4Å; C555-C568 CovalentContact SG-SG 2.04Å; C555-C568 PolarHBondContact SG-SG 2.94Å; C555-Y576 HydrophobicContact CB-CD1 3.63Å; C555-Y576 HydrophobicContact CB-CD2 4.24Å; C555-Y576 HydrophobicContact CB-CE1 4.45Å; C555-Y576 HydrophobicContact CB-CG 3.48Å; C555-Y576 VanDerWaalsContact CB-CG 3.48Å
556	P	77.9	Confident	62.9	Low	79 Å²	79	75.9 Å²	75.9	51%	0.513	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	129	178.2	-16.3	22.3	0	0	0	109.5	Y576	P556-Y576 HydrophobicContact CB-CE1 4.19Å; P556-Y576 HydrophobicContact CB-CE2 4.41Å; P556-Y576 WeakPolarHBondContact CB-OH 3.35Å; P556-Y576 HydrophobicContact CG-CE1 3.84Å; P556-Y576 WeakPolarHBondContact O-CD2 3.5Å; P556-Y576 WeakPolarHBondContact O-CE2 3.36Å
557	G	70	Confident	65.6	Low	71 Å²	71	72.6 Å²	72.6	73%	0.732	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	1.7	-172.4	0	0	0	0	0	116.1	C555 K559	C555-G557 PolarHBondContact O-N 3.24Å; G557-K559 PolarHBondContact O-N 2.99Å
558	G	69.2	Low	68.5	Low	52 Å²	52	66.6 Å²	66.6	54%	0.536	39%	0.392	S	S	.	.	S	Bend	trans	76.3	-15.7	154.1	0	0	0	0	0	117.4	C555	C555-G558 PolarHBondContact O-N 3.16Å
559	K	70.5	Confident	71	Confident	192 Å²	192	61.4 Å²	61.4	84%	0.835	36%	0.356	S	S	*	.	S	Bend	trans	-91.1	-21.9	-173.8	-67.6	-178.5	-178.5	177.7	0	114.2	G557	G557-K559 PolarHBondContact O-N 2.99Å
560	A	73.3	Confident	73.6	Confident	18 Å²	18	64.1 Å²	64.1	15%	0.149	37%	0.365	C	S	.	.			trans	-112.1	146.6	-178.7	0	0	0	0	0	111.4	C555 Y576	C555-A560 HydrophobicContact CB-CB 4.12Å; C555-A560 PolarHBondContact N-O 2.03Å; A560-Y576 VanDerWaalsContact CB-O 3.25Å; A560-Y576 WeakPolarHBondContact CB-O 3.33Å
561	K	82.2	Confident	75.9	Confident	130 Å²	130	62.8 Å²	62.8	57%	0.565	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	112.9	-169.8	-85	-168.9	-175.8	-173.6	0	108.2	T552	T552-K561 HydrophobicContact CG2-CB 3.46Å; T552-K561 VanDerWaalsContact CG2-CB 3.46Å; T552-K561 HydrophobicContact CG2-CD 4.22Å; T552-K561 HydrophobicContact CG2-CG 4.11Å
562	C	81.4	Confident	78	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.7	-174.1	-64.1	0	0	0	0	112.9	F551 T552 Q553 C555 C568 C578	F551-C562 VanDerWaalsContact O-O 3.09Å; T552-C562 CarbonylContact C-O 3.54Å; T552-C562 WeakPolarHBondContact CA-O 3.2Å; Q553-C562 HydrophobicContact CG-CB 4.01Å; Q553-C562 PolarHBondContact N-O 3.06Å; Q553-C562 PolarHBondContact O-N 2.89Å; C555-C562 PolarHBondContact SG-SG 3.2Å; C562-C568 VanDerWaalsContact SG-SG 3.69Å; C562-C578 WeakPolarHBondContact CA-SG 3.05Å; C562-C578 HydrophobicContact CB-CB 3.66Å; C562-C578 WeakPolarHBondContact CB-SG 3.28Å; C562-C578 WeakPolarHBondContact SG-CA 3.33Å; C562-C578 WeakPolarHBondContact SG-CB 3.37Å; C562-C578 CovalentContact SG-SG 2.02Å; C562-C578 PolarHBondContact SG-SG 3.4Å
563	P	80.5	Confident	79.2	Confident	46 Å²	46	65.1 Å²	65.1	30%	0.299	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.1	147.4	173.5	-18.3	26.1	0	0	0	112.9	V550 F551 S565 S566	V550-P563 HydrophobicContact CG1-CB 3.74Å; V550-P563 HydrophobicContact CG1-CG 3.71Å; F551-P563 CarbonylContact O-C 3.52Å; F551-P563 VanDerWaalsContact O-C 3.3Å; F551-P563 WeakPolarHBondContact O-CA 3.11Å; P563-S565 PolarHBondContact O-N 2.02Å; P563-S566 WeakPolarHBondContact CB-OG 3.04Å; P563-S566 WeakPolarHBondContact CD-OG 3.17Å; P563-S566 WeakPolarHBondContact CG-OG 2.84Å; P563-S566 WeakPolarHBondContact O-CA 2.95Å; P563-S566 WeakPolarHBondContact O-CB 3.37Å; P563-S566 PolarHBondContact O-N 3.3Å; P563-S566 PolarHBondContact O-OG 2.79Å
564	D	71.3	Confident	79.6	Confident	97 Å²	97	63.6 Å²	63.6	52%	0.519	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-31.2	176	-89.4	-12.3	0	0	0	114.1	F551 S566	F551-D564 HydrophobicContact CB-CB 4.09Å; F551-D564 WeakPolarHBondContact CB-OD1 3.1Å; F551-D564 WeakPolarHBondContact CB-OD2 3.33Å; F551-D564 WeakPolarHBondContact CD1-OD2 3.06Å; F551-D564 WeakPolarHBondContact CG-OD2 3.23Å; F551-D564 PolarHBondContact O-N 3.18Å; D564-S566 PolarHBondContact O-N 3.45Å
565	S	72.9	Confident	79.7	Confident	76 Å²	76	63.9 Å²	63.9	53%	0.531	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	10.3	177.5	67.1	0	0	0	0	113.5	P563 P582	P563-S565 PolarHBondContact O-N 2.02Å; S565-P582 WeakPolarHBondContact O-CD 2.98Å
566	S	86.7	Confident	79.9	Confident	7 Å²	7	66.6 Å²	66.6	5%	0.049	40%	0.398	C	S	.	.	S	Bend	trans	-120	160.5	-174.8	-50.2	0	0	0	0	112	Q553 P563 D564 C579	Q553-S566 PolarHBondContact NE2-O 2.03Å; P563-S566 WeakPolarHBondContact CB-OG 3.04Å; P563-S566 WeakPolarHBondContact CD-OG 3.17Å; P563-S566 WeakPolarHBondContact CG-OG 2.84Å; P563-S566 WeakPolarHBondContact O-CA 2.95Å; P563-S566 WeakPolarHBondContact O-CB 3.37Å; P563-S566 PolarHBondContact O-N 3.3Å; P563-S566 PolarHBondContact O-OG 2.79Å; D564-S566 PolarHBondContact O-N 3.45Å; S566-C579 CarbonylContact C-O 3.45Å; S566-C579 VanDerWaalsContact C-O 3.31Å; S566-C579 WeakPolarHBondContact CA-O 3.44Å; S566-C579 WeakPolarHBondContact CB-O 3.14Å
567	T	88.1	Confident	80.1	Confident	23 Å²	23	64.2 Å²	64.2	14%	0.141	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.7	174.8	-53.2	0	0	0	0	110.9	C569 C579 I581 N583 A584	T567-C569 PolarHBondContact O-N 2.91Å; T567-C579 PolarHBondContact N-O 2.78Å; T567-C579 WeakPolarHBondContact O-CB 3.43Å; T567-C579 PolarHBondContact O-N 3.22Å; T567-I581 PolarHBondContact N-O 2.87Å; T567-I581 PolarHBondContact OG1-O 2.81Å; T567-N583 PolarHBondContact OG1-N 3.38Å; T567-A584 HydrophobicContact CG2-CB 4.3Å; T567-A584 PolarHBondContact OG1-N 3.29Å
568	C	90.2	Very high	81.1	Confident	24 Å²	24	62 Å²	62	16%	0.162	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	110.6	174.9	-77.3	0	0	0	0	111.1	Q553 C555 C562 Y576	Q553-C568 VanDerWaalsContact NE2-N 3.17Å; Q553-C568 PolarHBondContact NE2-SG 3.3Å; C555-C568 WeakPolarHBondContact CA-SG 3.13Å; C555-C568 HydrophobicContact CB-CB 3.64Å; C555-C568 WeakPolarHBondContact CB-SG 3.33Å; C555-C568 WeakPolarHBondContact SG-CB 3.4Å; C555-C568 CovalentContact SG-SG 2.04Å; C555-C568 PolarHBondContact SG-SG 2.94Å; C562-C568 VanDerWaalsContact SG-SG 3.69Å; C568-Y576 HydrophobicContact CB-CD1 4.12Å
569	C	90.5	Very high	82	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.061	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136.8	174.4	-67.1	0	0	0	0	111.1	T567 Y576 A577 C586	T567-C569 PolarHBondContact O-N 2.91Å; C569-Y576 CarbonylContact O-C 3.56Å; C569-Y576 VanDerWaalsContact O-CA 3.25Å; C569-Y576 WeakPolarHBondContact O-CA 3.24Å; C569-A577 PolarHBondContact N-O 3.1Å; C569-A577 PolarHBondContact O-N 2.9Å; C569-C586 WeakPolarHBondContact CA-SG 3.4Å; C569-C586 HydrophobicContact CB-CB 3.68Å; C569-C586 WeakPolarHBondContact CB-SG 3.01Å; C569-C586 WeakPolarHBondContact SG-CB 3.01Å; C569-C586 CovalentContact SG-SG 2.04Å; C569-C586 PolarHBondContact SG-SG 3.06Å
570	K	87.4	Confident	82.8	Confident	117 Å²	117	52 Å²	52	51%	0.509	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	139.2	177.5	-167	177.1	177.6	-174.4	0	109.4	Y576	K570-Y576 HydrophobicContact CB-CD1 4.34Å; K570-Y576 HydrophobicContact CB-CE1 4.02Å; K570-Y576 HydrophobicContact CG-CE1 4.47Å; K570-Y576 HydrophobicContact CG-CE2 4.2Å
571	L	83.5	Confident	83.3	Confident	57 Å²	57	52.5 Å²	52.5	30%	0.298	30%	0.303	S	S	.	.			trans	-95.9	160.5	174	-63.7	175.6	0	0	0	110.2	S573 G574 K575 A577 D590	L571-S573 PolarHBondContact O-N 2.9Å; L571-S573 VanDerWaalsContact O-N 3.09Å; L571-G574 PolarHBondContact O-N 2.04Å; L571-K575 HydrophobicContact CD1-CB 4.42Å; L571-K575 PolarHBondContact N-O 3.44Å; L571-A577 HydrophobicContact CD1-CB 4.12Å; L571-A577 HydrophobicContact CD2-CB 3.84Å; L571-A577 HydrophobicContact CG-CB 3.99Å; L571-D590 WeakPolarHBondContact CD2-O 3.35Å
572	S	80.2	Confident	83.3	Confident	107 Å²	107	49.5 Å²	49.5	75%	0.748	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.5	172.9	54.8	0	0	0	0	113.3	G574 D590	S572-G574 PolarHBondContact O-N 2.58Å; S572-D590 WeakPolarHBondContact CA-OD2 3.22Å; S572-D590 WeakPolarHBondContact CB-OD2 3.49Å; S572-D590 VanDerWaalsContact N-CB 3.3Å; S572-D590 PolarHBondContact N-OD2 3.05Å; S572-D590 VanDerWaalsContact N-OD2 3.09Å
573	S	74.7	Confident	83.5	Confident	75 Å²	75	55.9 Å²	55.9	52%	0.524	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-2.1	173.9	65.7	0	0	0	0	114.8	L571 K575	L571-S573 PolarHBondContact O-N 2.9Å; L571-S573 VanDerWaalsContact O-N 3.09Å; S573-K575 PolarHBondContact O-N 3.32Å
574	G	77.6	Confident	83.8	Confident	44 Å²	44	54.2 Å²	54.2	45%	0.454	32%	0.321	S	S	.	.	S	Bend	trans	75.9	-2.7	-172.9	0	0	0	0	0	114.6	L571 S572	L571-G574 PolarHBondContact O-N 2.04Å; S572-G574 PolarHBondContact O-N 2.58Å
575	K	81.8	Confident	84.7	Confident	115 Å²	115	52.9 Å²	52.9	50%	0.5	31%	0.313	S	S	.	.			trans	-82.4	176.7	172.2	-58.9	-178	-179	176.2	0	110.5	L571 S573	L571-K575 HydrophobicContact CD1-CB 4.42Å; L571-K575 PolarHBondContact N-O 3.44Å; S573-K575 PolarHBondContact O-N 3.32Å
576	Y	87	Confident	85.5	Confident	59 Å²	59	51.8 Å²	51.8	23%	0.231	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	148	177.5	-74.7	-105.8	0	0	0	111.1	C555 P556 A560 C568 C569 K570	C555-Y576 HydrophobicContact CB-CD1 3.63Å; C555-Y576 HydrophobicContact CB-CD2 4.24Å; C555-Y576 HydrophobicContact CB-CE1 4.45Å; C555-Y576 HydrophobicContact CB-CG 3.48Å; C555-Y576 VanDerWaalsContact CB-CG 3.48Å; P556-Y576 HydrophobicContact CB-CE1 4.19Å; P556-Y576 HydrophobicContact CB-CE2 4.41Å; P556-Y576 WeakPolarHBondContact CB-OH 3.35Å; P556-Y576 HydrophobicContact CG-CE1 3.84Å; P556-Y576 WeakPolarHBondContact O-CD2 3.5Å; P556-Y576 WeakPolarHBondContact O-CE2 3.36Å; A560-Y576 VanDerWaalsContact CB-O 3.25Å; A560-Y576 WeakPolarHBondContact CB-O 3.33Å; C568-Y576 HydrophobicContact CB-CD1 4.12Å; C569-Y576 CarbonylContact O-C 3.56Å; C569-Y576 VanDerWaalsContact O-CA 3.25Å; C569-Y576 WeakPolarHBondContact O-CA 3.24Å; K570-Y576 HydrophobicContact CB-CD1 4.34Å; K570-Y576 HydrophobicContact CB-CE1 4.02Å; K570-Y576 HydrophobicContact CG-CE1 4.47Å; K570-Y576 HydrophobicContact CG-CE2 4.2Å
577	A	83.8	Confident	85.6	Confident	29 Å²	29	51.7 Å²	51.7	24%	0.24	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	163.1	174.5	0	0	0	0	0	110.6	C569 L571	C569-A577 PolarHBondContact N-O 3.1Å; C569-A577 PolarHBondContact O-N 2.9Å; L571-A577 HydrophobicContact CD1-CB 4.12Å; L571-A577 HydrophobicContact CD2-CB 3.84Å; L571-A577 HydrophobicContact CG-CB 3.99Å
578	C	89.4	Confident	85.4	Confident	24 Å²	24	54.6 Å²	54.6	16%	0.162	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	110.3	-173.1	-52.1	0	0	0	0	111.4	C562 F632	C562-C578 WeakPolarHBondContact CA-SG 3.05Å; C562-C578 HydrophobicContact CB-CB 3.66Å; C562-C578 WeakPolarHBondContact CB-SG 3.28Å; C562-C578 WeakPolarHBondContact SG-CA 3.33Å; C562-C578 WeakPolarHBondContact SG-CB 3.37Å; C562-C578 CovalentContact SG-SG 2.02Å; C562-C578 PolarHBondContact SG-SG 3.4Å; C578-F632 VanDerWaalsContact C-CE1 3.48Å; C578-F632 WeakPolarHBondContact O-CD1 3.03Å; C578-F632 VanDerWaalsContact O-CE1 3.29Å; C578-F632 WeakPolarHBondContact O-CE1 3.31Å
579	C	89.4	Confident	85	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.7	167.9	171.3	0	0	0	0	110.3	S566 T567 I581 A584 C593 F632	S566-C579 CarbonylContact C-O 3.45Å; S566-C579 VanDerWaalsContact C-O 3.31Å; S566-C579 WeakPolarHBondContact CA-O 3.44Å; S566-C579 WeakPolarHBondContact CB-O 3.14Å; T567-C579 PolarHBondContact N-O 2.78Å; T567-C579 WeakPolarHBondContact O-CB 3.43Å; T567-C579 PolarHBondContact O-N 3.22Å; C579-I581 PolarHBondContact O-N 3.29Å; C579-I581 VanDerWaalsContact O-N 3.11Å; C579-A584 HydrophobicContact CB-CB 4.13Å; C579-A584 WeakPolarHBondContact SG-CB 3.25Å; C579-C593 HydrophobicContact CB-CB 3.67Å; C579-C593 WeakPolarHBondContact CB-SG 3.04Å; C579-C593 WeakPolarHBondContact SG-CB 3.29Å; C579-C593 CovalentContact SG-SG 2.02Å; C579-C593 PolarHBondContact SG-SG 2.85Å; C579-F632 HydrophobicContact CB-CD1 4.43Å; C579-F632 HydrophobicContact CB-CE1 3.49Å; C579-F632 VanDerWaalsContact CB-CE1 3.49Å; C579-F632 HydrophobicContact CB-CE2 4.12Å; C579-F632 HydrophobicContact CB-CZ 3.29Å; C579-F632 VanDerWaalsContact N-CE1 3.3Å
580	P	86	Confident	84.6	Confident	34 Å²	34	57.2 Å²	57.2	22%	0.221	34%	0.342	C	S	.	.	S	Bend	trans	-74.1	-3.4	-175.3	33.2	-37.5	0	0	0	112.7	F632	P580-F632 HydrophobicContact CG-CG 4.47Å; P580-F632 VanDerWaalsContact CG-N 3.31Å
581	I	85.3	Confident	84.3	Confident	30 Å²	30	57.5 Å²	57.5	15%	0.154	35%	0.348	C	S	.	.	S	Bend	trans	-90.2	126.5	174.1	-48.3	172.3	0	0	0	107.5	T567 C579 A584 P595	T567-I581 PolarHBondContact N-O 2.87Å; T567-I581 PolarHBondContact OG1-O 2.81Å; C579-I581 PolarHBondContact O-N 3.29Å; C579-I581 VanDerWaalsContact O-N 3.11Å; I581-A584 HydrophobicContact CB-CB 4.04Å; I581-A584 HydrophobicContact CG2-CB 4.45Å; I581-P595 HydrophobicContact CD1-CG 4.24Å
582	P	82.2	Confident	84.3	Confident	67 Å²	67	57.6 Å²	57.6	44%	0.435	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	140.4	172.4	27.8	-33.2	0	0	0	110	S565 A584	S565-P582 WeakPolarHBondContact O-CD 2.98Å; P582-A584 VanDerWaalsContact C-N 3.32Å; P582-A584 PolarHBondContact O-N 3.15Å
583	N	84.4	Confident	84.8	Confident	134 Å²	134	52.9 Å²	52.9	72%	0.717	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	39.3	179.9	-55.3	-39.5	0	0	0	114.7	T567 P596	T567-N583 PolarHBondContact OG1-N 3.38Å; N583-P596 HydrophobicContact CB-CB 4.41Å; N583-P596 WeakPolarHBondContact O-CB 3.46Å
584	A	88	Confident	85.6	Confident	11 Å²	11	49.3 Å²	49.3	9%	0.091	29%	0.289	C	S	.	.			trans	-75.8	152.2	-178.5	0	0	0	0	0	113.1	T567 C579 I581 P582 C593 C594	T567-A584 HydrophobicContact CG2-CB 4.3Å; T567-A584 PolarHBondContact OG1-N 3.29Å; C579-A584 HydrophobicContact CB-CB 4.13Å; C579-A584 WeakPolarHBondContact SG-CB 3.25Å; I581-A584 HydrophobicContact CB-CB 4.04Å; I581-A584 HydrophobicContact CG2-CB 4.45Å; P582-A584 VanDerWaalsContact C-N 3.32Å; P582-A584 PolarHBondContact O-N 3.15Å; A584-C593 HydrophobicContact CB-CB 3.81Å; A584-C594 CarbonylContact C-O 3.5Å; A584-C594 VanDerWaalsContact CA-O 3.25Å; A584-C594 WeakPolarHBondContact CA-O 3.22Å; A584-C594 WeakPolarHBondContact CB-O 3.21Å
585	I	89.2	Confident	86	Confident	69 Å²	69	49.9 Å²	49.9	35%	0.354	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	108.9	173	-70.1	164.7	0	0	0	107.8	C587 C593 C594 T598	I585-C587 PolarHBondContact O-N 3.04Å; I585-C593 CarbonylContact O-C 3.47Å; I585-C593 VanDerWaalsContact O-CA 3.3Å; I585-C593 WeakPolarHBondContact O-CA 2.98Å; I585-C594 HydrophobicContact CB-CB 4.29Å; I585-C594 PolarHBondContact N-O 2.98Å; I585-C594 PolarHBondContact O-N 2.76Å; I585-T598 WeakPolarHBondContact CD1-O 3.32Å
586	C	90.7	Very high	86.2	Confident	52 Å²	52	48 Å²	48	35%	0.351	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.4	177.1	-54.3	0	0	0	0	109.7	C569	C569-C586 WeakPolarHBondContact CA-SG 3.4Å; C569-C586 HydrophobicContact CB-CB 3.68Å; C569-C586 WeakPolarHBondContact CB-SG 3.01Å; C569-C586 WeakPolarHBondContact SG-CB 3.01Å; C569-C586 CovalentContact SG-SG 2.04Å; C569-C586 PolarHBondContact SG-SG 3.06Å
587	C	88.5	Confident	85.9	Confident	6 Å²	6	48 Å²	48	4%	0.041	30%	0.302	C	S	.	.			trans	-69.7	154	179.6	-63.6	0	0	0	0	111.4	I585 D589 D590 H592 C600	I585-C587 PolarHBondContact O-N 3.04Å; C587-D589 WeakPolarHBondContact CB-OD1 3.27Å; C587-D589 PolarHBondContact O-N 3.2Å; C587-D590 PolarHBondContact O-N 3.09Å; C587-H592 HydrophobicContact CB-CB 3.91Å; C587-H592 VanDerWaalsContact CB-O 3.24Å; C587-H592 WeakPolarHBondContact CB-O 3.32Å; C587-H592 PolarHBondContact N-O 2.84Å; C587-H592 VanDerWaalsContact SG-C 3.57Å; C587-H592 WeakPolarHBondContact SG-CB 3.49Å; C587-H592 PolarHBondContact SG-O 3.19Å; C587-H592 VanDerWaalsContact SG-O 3.4Å; C587-C600 HydrophobicContact CB-CB 3.87Å; C587-C600 WeakPolarHBondContact CB-SG 2.98Å; C587-C600 WeakPolarHBondContact SG-CB 2.66Å; C587-C600 CovalentContact SG-SG 2.01Å; C587-C600 PolarHBondContact SG-SG 2.82Å
588	A	83.8	Confident	86.1	Confident	83 Å²	83	47.4 Å²	47.4	69%	0.686	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-8.4	179.2	0	0	0	0	0	114	D590 Y602	A588-D590 VanDerWaalsContact C-N 3.26Å; A588-Y602 HydrophobicContact CB-CD1 4.43Å; A588-Y602 HydrophobicContact CB-CE1 4.45Å
589	D	80.8	Confident	85.9	Confident	36 Å²	36	49.2 Å²	49.2	19%	0.193	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	2.8	175.6	67.7	1.4	0	0	0	113.7	C587 I591 H592 Y602	C587-D589 WeakPolarHBondContact CB-OD1 3.27Å; C587-D589 PolarHBondContact O-N 3.2Å; D589-I591 WeakPolarHBondContact O-CG1 3.21Å; D589-I591 PolarHBondContact O-N 3.5Å; D589-I591 PolarHBondContact OD1-N 2.6Å; D589-I591 VanDerWaalsContact OD1-N 3.08Å; D589-H592 PolarHBondContact OD1-N 3.36Å; D589-H592 VanDerWaalsContact OD1-N 3.07Å; D589-H592 IonicContact OD1-ND1 3.47Å; D589-H592 IonicContact OD2-CE1 3.7Å; D589-H592 PolarHBondContact OD2-CE1 2.87Å; D589-H592 IonicContact OD2-CG 3.86Å; D589-H592 IonicContact OD2-ND1 2.64Å; D589-H592 PolarHBondContact OD2-ND1 2.69Å; D589-Y602 HydrophobicContact CB-CD2 4.03Å; D589-Y602 HydrophobicContact CB-CG 4.13Å; D589-Y602 WeakPolarHBondContact OD2-CB 3.37Å
590	D	82.7	Confident	85.7	Confident	53 Å²	53	50.5 Å²	50.5	28%	0.283	32%	0.317	S	S	.	.	S	Bend	trans	62.8	8.6	176.9	-62.7	-45.3	0	0	0	115	L571 S572 C587 A588	L571-D590 WeakPolarHBondContact CD2-O 3.35Å; S572-D590 WeakPolarHBondContact CA-OD2 3.22Å; S572-D590 WeakPolarHBondContact CB-OD2 3.49Å; S572-D590 VanDerWaalsContact N-CB 3.3Å; S572-D590 PolarHBondContact N-OD2 3.05Å; S572-D590 VanDerWaalsContact N-OD2 3.09Å; C587-D590 PolarHBondContact O-N 3.09Å; A588-D590 VanDerWaalsContact C-N 3.26Å
591	I	80.4	Confident	85.6	Confident	122 Å²	122	51.4 Å²	51.4	63%	0.626	32%	0.32	S	S	*	.	S	Bend	trans	-120.6	-34.6	-173.5	-63.5	164.1	0	0	0	111.1	D589	D589-I591 WeakPolarHBondContact O-CG1 3.21Å; D589-I591 PolarHBondContact O-N 3.5Å; D589-I591 PolarHBondContact OD1-N 2.6Å; D589-I591 VanDerWaalsContact OD1-N 3.08Å
592	H	85.5	Confident	85.1	Confident	60 Å²	60	55 Å²	55	28%	0.278	33%	0.332	S	S	.	.			trans	-105	153.6	-174.3	-59.8	93.2	0	0	0	112.3	C587 D589 L605	C587-H592 HydrophobicContact CB-CB 3.91Å; C587-H592 VanDerWaalsContact CB-O 3.24Å; C587-H592 WeakPolarHBondContact CB-O 3.32Å; C587-H592 PolarHBondContact N-O 2.84Å; C587-H592 VanDerWaalsContact SG-C 3.57Å; C587-H592 WeakPolarHBondContact SG-CB 3.49Å; C587-H592 PolarHBondContact SG-O 3.19Å; C587-H592 VanDerWaalsContact SG-O 3.4Å; D589-H592 PolarHBondContact OD1-N 3.36Å; D589-H592 VanDerWaalsContact OD1-N 3.07Å; D589-H592 IonicContact OD1-ND1 3.47Å; D589-H592 IonicContact OD2-CE1 3.7Å; D589-H592 PolarHBondContact OD2-CE1 2.87Å; D589-H592 IonicContact OD2-CG 3.86Å; D589-H592 IonicContact OD2-ND1 2.64Å; D589-H592 PolarHBondContact OD2-ND1 2.69Å; H592-L605 WeakPolarHBondContact CE1-CD2 3.39Å
593	C	89.6	Confident	84.7	Confident	7 Å²	7	59.4 Å²	59.4	5%	0.047	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.9	162.4	71.1	0	0	0	0	109.6	C579 A584 I585 F632	C579-C593 HydrophobicContact CB-CB 3.67Å; C579-C593 WeakPolarHBondContact CB-SG 3.04Å; C579-C593 WeakPolarHBondContact SG-CB 3.29Å; C579-C593 CovalentContact SG-SG 2.02Å; C579-C593 PolarHBondContact SG-SG 2.85Å; A584-C593 HydrophobicContact CB-CB 3.81Å; I585-C593 CarbonylContact O-C 3.47Å; I585-C593 VanDerWaalsContact O-CA 3.3Å; I585-C593 WeakPolarHBondContact O-CA 2.98Å; C593-F632 HydrophobicContact CB-CE2 3.83Å; C593-F632 HydrophobicContact CB-CZ 3.59Å; C593-F632 WeakPolarHBondContact SG-CE2 3.25Å; C593-F632 WeakPolarHBondContact SG-CZ 2.88Å
594	C	91.4	Very high	84.3	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	148.2	178.6	-79.2	0	0	0	0	110.8	A584 I585 T598 C600 C607	A584-C594 CarbonylContact C-O 3.5Å; A584-C594 VanDerWaalsContact CA-O 3.25Å; A584-C594 WeakPolarHBondContact CA-O 3.22Å; A584-C594 WeakPolarHBondContact CB-O 3.21Å; I585-C594 HydrophobicContact CB-CB 4.29Å; I585-C594 PolarHBondContact N-O 2.98Å; I585-C594 PolarHBondContact O-N 2.76Å; C594-T598 WeakPolarHBondContact CB-OG1 3.42Å; C594-C600 HydrophobicContact CB-CB 4.47Å; C594-C607 WeakPolarHBondContact CA-SG 3.01Å; C594-C607 HydrophobicContact CB-CB 3.74Å; C594-C607 WeakPolarHBondContact CB-SG 3.44Å; C594-C607 VanDerWaalsContact SG-CA 3.55Å; C594-C607 WeakPolarHBondContact SG-CB 3.29Å; C594-C607 CovalentContact SG-SG 2.04Å; C594-C607 PolarHBondContact SG-SG 3.15Å
595	P	86.6	Confident	83.5	Confident	55 Å²	55	62.2 Å²	62.2	36%	0.357	36%	0.36	S	S	.	.			trans	-55.5	152.8	173.9	-21.9	31.1	0	0	0	112.4	I581 G597 T598	I581-P595 HydrophobicContact CD1-CG 4.24Å; P595-G597 PolarHBondContact O-N 3.19Å; P595-T598 PolarHBondContact O-N 2.04Å; P595-T598 PolarHBondContact O-OG1 2.89Å
596	P	85.3	Confident	82.8	Confident	76 Å²	76	61.5 Å²	61.5	49%	0.494	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	136.7	172.4	18.2	-29.3	0	0	0	111.3	N583	N583-P596 HydrophobicContact CB-CB 4.41Å; N583-P596 WeakPolarHBondContact O-CB 3.46Å
597	G	81.6	Confident	82.5	Confident	58 Å²	58	61.3 Å²	61.3	60%	0.598	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	7.3	-178.7	0	0	0	0	0	115.6	P595 A610	P595-G597 PolarHBondContact O-N 3.19Å; G597-A610 PolarHBondContact O-N 3.34Å
598	T	88.2	Confident	82.3	Confident	18 Å²	18	64.5 Å²	64.5	11%	0.11	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.4	176.6	61.2	0	0	0	0	112.1	I585 C594 P595 C607 V608 K609	I585-T598 WeakPolarHBondContact CD1-O 3.32Å; C594-T598 WeakPolarHBondContact CB-OG1 3.42Å; P595-T598 PolarHBondContact O-N 2.04Å; P595-T598 PolarHBondContact O-OG1 2.89Å; T598-C607 HydrophobicContact CG2-CB 4.45Å; T598-V608 CarbonylContact C-O 3.59Å; T598-V608 WeakPolarHBondContact CA-O 3.2Å; T598-V608 WeakPolarHBondContact CB-O 3.23Å; T598-K609 HydrophobicContact CG2-CG 4.29Å
599	S	84	Confident	81.8	Confident	62 Å²	62	69.3 Å²	69.3	43%	0.434	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	138.1	170.1	-175.3	0	0	0	0	110.2	C607 V608	S599-C607 CarbonylContact O-C 3.58Å; S599-V608 PolarHBondContact N-O 3.32Å; S599-V608 WeakPolarHBondContact O-CG2 3.34Å; S599-V608 PolarHBondContact O-N 3.07Å
600	C	84.7	Confident	80.7	Confident	27 Å²	27	70.5 Å²	70.5	18%	0.182	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	122.8	178.2	-173.2	0	0	0	0	111.6	C587 C594	C587-C600 HydrophobicContact CB-CB 3.87Å; C587-C600 WeakPolarHBondContact CB-SG 2.98Å; C587-C600 WeakPolarHBondContact SG-CB 2.66Å; C587-C600 CovalentContact SG-SG 2.01Å; C587-C600 PolarHBondContact SG-SG 2.82Å; C594-C600 HydrophobicContact CB-CB 4.47Å
601	D	84.1	Confident	79.2	Confident	52 Å²	52	75.5 Å²	75.5	28%	0.278	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	86.6	161.8	-176.3	3.4	0	0	0	109.1	K603 T604 L605 S606	D601-K603 PolarHBondContact O-N 2.9Å; D601-K603 WeakPolarHBondContact OD1-CB 3.49Å; D601-K603 PolarHBondContact OD1-N 2.73Å; D601-K603 VanDerWaalsContact OD1-N 3.12Å; D601-T604 WeakPolarHBondContact CB-OG1 3.28Å; D601-T604 PolarHBondContact O-N 2.74Å; D601-T604 PolarHBondContact O-OG1 2.78Å; D601-T604 PolarHBondContact OD1-N 2.02Å; D601-T604 WeakPolarHBondContact OD2-CB 3.47Å; D601-T604 WeakPolarHBondContact OD2-CG2 3.29Å; D601-T604 PolarHBondContact OD2-OG1 3.44Å; D601-L605 PolarHBondContact O-N 3.38Å; D601-S606 CarbonylContact C-O 3.47Å; D601-S606 WeakPolarHBondContact CA-O 2.99Å; D601-S606 PolarHBondContact N-O 2.98Å; D601-S606 PolarHBondContact O-N 3.12Å
602	Y	75	Confident	77.4	Confident	105 Å²	105	77.6 Å²	77.6	41%	0.412	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.3	179.3	69	-88	0	0	0	113	A588 D589	A588-Y602 HydrophobicContact CB-CD1 4.43Å; A588-Y602 HydrophobicContact CB-CE1 4.45Å; D589-Y602 HydrophobicContact CB-CD2 4.03Å; D589-Y602 HydrophobicContact CB-CG 4.13Å; D589-Y602 WeakPolarHBondContact OD2-CB 3.37Å
603	K	74.9	Confident	75.4	Confident	161 Å²	161	81.5 Å²	81.5	70%	0.7	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-32.8	178.2	-63	-179.1	-179.4	178.3	0	111.6	D601	D601-K603 PolarHBondContact O-N 2.9Å; D601-K603 WeakPolarHBondContact OD1-CB 3.49Å; D601-K603 PolarHBondContact OD1-N 2.73Å; D601-K603 VanDerWaalsContact OD1-N 3.12Å
604	T	75	Confident	73.2	Confident	79 Å²	79	89 Å²	89	49%	0.485	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	5	179.1	62.7	0	0	0	0	112.9	D601 S606	D601-T604 WeakPolarHBondContact CB-OG1 3.28Å; D601-T604 PolarHBondContact O-N 2.74Å; D601-T604 PolarHBondContact O-OG1 2.78Å; D601-T604 PolarHBondContact OD1-N 2.02Å; D601-T604 WeakPolarHBondContact OD2-CB 3.47Å; D601-T604 WeakPolarHBondContact OD2-CG2 3.29Å; D601-T604 PolarHBondContact OD2-OG1 3.44Å; T604-S606 PolarHBondContact O-N 2.68Å; T604-S606 PolarHBondContact O-OG 3.48Å; T604-S606 VanDerWaalsContact O-OG 3.04Å; T604-S606 WeakPolarHBondContact OG1-CB 3.37Å
605	L	71.7	Confident	70.5	Confident	125 Å²	125	94.5 Å²	94.5	65%	0.654	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.5	-175.1	-57.8	169.3	0	0	0	112.1	H592 D601	H592-L605 WeakPolarHBondContact CE1-CD2 3.39Å; D601-L605 PolarHBondContact O-N 3.38Å
606	S	75.2	Confident	68.1	Low	54 Å²	54	100.1 Å²	100.1	38%	0.378	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	149.6	-171.3	-63.3	0	0	0	0	112.5	D601 T604	D601-S606 CarbonylContact C-O 3.47Å; D601-S606 WeakPolarHBondContact CA-O 2.99Å; D601-S606 PolarHBondContact N-O 2.98Å; D601-S606 PolarHBondContact O-N 3.12Å; T604-S606 PolarHBondContact O-N 2.68Å; T604-S606 PolarHBondContact O-OG 3.48Å; T604-S606 VanDerWaalsContact O-OG 3.04Å; T604-S606 WeakPolarHBondContact OG1-CB 3.37Å
607	C	84.3	Confident	65.6	Low	48 Å²	48	99.8 Å²	99.8	32%	0.324	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.1	112.7	173.2	-57.8	0	0	0	0	108.8	C594 T598 S599	C594-C607 WeakPolarHBondContact CA-SG 3.01Å; C594-C607 HydrophobicContact CB-CB 3.74Å; C594-C607 WeakPolarHBondContact CB-SG 3.44Å; C594-C607 VanDerWaalsContact SG-CA 3.55Å; C594-C607 WeakPolarHBondContact SG-CB 3.29Å; C594-C607 CovalentContact SG-SG 2.04Å; C594-C607 PolarHBondContact SG-SG 3.15Å; T598-C607 HydrophobicContact CG2-CB 4.45Å; S599-C607 CarbonylContact O-C 3.58Å
608	V	83	Confident	63	Low	72 Å²	72	102.7 Å²	102.7	44%	0.436	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.6	137.5	-178	-61.9	0	0	0	0	110.1	T598 S599 A610	T598-V608 CarbonylContact C-O 3.59Å; T598-V608 WeakPolarHBondContact CA-O 3.2Å; T598-V608 WeakPolarHBondContact CB-O 3.23Å; S599-V608 PolarHBondContact N-O 3.32Å; S599-V608 WeakPolarHBondContact O-CG2 3.34Å; S599-V608 PolarHBondContact O-N 3.07Å; V608-A610 PolarHBondContact O-N 2.71Å
609	K	73.8	Confident	60.4	Low	185 Å²	185	107.6 Å²	107.6	80%	0.804	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-63.2	128.8	175.9	-72.7	-179	179.6	177.7	0	109.5	T598 N611	T598-K609 HydrophobicContact CG2-CG 4.29Å; K609-N611 VanDerWaalsContact C-N 3.33Å; K609-N611 PolarHBondContact O-N 3.11Å
610	A	57.4	Low	57.9	Low	61 Å²	61	108.9 Å²	108.9	50%	0.504	62%	0.622	S	S	.	*	S	Bend	trans	-78.8	84.4	176.3	0	0	0	0	0	108.9	G597 V608	G597-A610 PolarHBondContact O-N 3.34Å; V608-A610 PolarHBondContact O-N 2.71Å
611	N	51.3	Low	55.5	Low	158 Å²	158	112.1 Å²	112.1	85%	0.845	65%	0.651	S	S	*	*			trans	-165	122.5	157.4	-87.4	-26.2	0	0	0	111.1	K609	K609-N611 VanDerWaalsContact C-N 3.33Å; K609-N611 PolarHBondContact O-N 3.11Å
612	N	43.5	Very low	53.1	Low	165 Å²	165	115.6 Å²	115.6	88%	0.882	67%	0.669	S	S	*	*			trans	-73.3	116.9	172.6	-67.4	-43.6	0	0	0	110.4
613	D	42.8	Very low	51.4	Low	143 Å²	143	119.1 Å²	119.1	77%	0.765	69%	0.69	S	S	*	*			trans	-174.1	125.6	130.5	-122.5	-20.4	0	0	0	113
614	H	42.8	Very low	49.6	Very low	164 Å²	164	119.5 Å²	119.5	76%	0.759	70%	0.698	S	S	*	*			trans	64.4	97.6	155	-75.7	51.7	0	0	0	122.5
615	S	34.6	Very low	47.9	Very low	116 Å²	116	122.7 Å²	122.7	81%	0.811	71%	0.711	S	S	*	*			trans	29	93.2	132.8	-51.1	0	0	0	0	121.2
616	I	36.8	Very low	46.4	Very low	173 Å²	173	128.2 Å²	128.2	89%	0.887	72%	0.724	S	S	*	*			trans	-145.1	126.5	139.8	-60.5	-173.6	0	0	0	108.5
617	G	33.7	Very low	44.7	Very low	69 Å²	69	130.4 Å²	130.4	71%	0.711	73%	0.731	S	S	*	*			trans	-58.1	142	-167.2	0	0	0	0	0	117.2
618	S	26.3	Very low	42.4	Very low	119 Å²	119	134.5 Å²	134.5	83%	0.832	76%	0.757	S	S	*	*			trans	27.1	95.3	154	-150.8	0	0	0	0	117.7
619	P	33.5	Very low	40.1	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	77%	0.774	S	S	*	*			trans	-88.4	119.6	150.9	16.3	1.2	0	0	0	109.3
620	S	31.2	Very low	38.1	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	76%	0.764	S	S	*	*			trans	-41.2	145.3	170.6	177	0	0	0	0	113.5	N622	S620-N622 PolarHBondContact O-N 3.35Å
621	A	33.9	Very low	36.9	Very low	94 Å²	94	139 Å²	139	78%	0.777	77%	0.77	S	S	*	*	S	Bend	trans	-60.8	46.4	-179.7	0	0	0	0	0	115.8
622	N	35.2	Very low	36	Very low	125 Å²	125	134 Å²	134	67%	0.668	74%	0.74	S	S	*	*			trans	-131.2	52.3	-168.7	-98.3	-12.7	0	0	0	111.4	S620	S620-N622 PolarHBondContact O-N 3.35Å
623	E	38.5	Very low	35.3	Very low	180 Å²	180	131.3 Å²	131.3	84%	0.841	73%	0.73	S	S	*	*	S	Bend	trans	-148.4	5.8	169.6	-145.8	154.6	-179	0	0	115.2
624	L	36.8	Very low	34.7	Very low	168 Å²	168	127.1 Å²	127.1	88%	0.88	72%	0.721	S	S	*	*	S	Bend	trans	-116	8.9	171.9	-75.8	166.2	0	0	0	113.7
625	L	40.6	Very low	34.3	Very low	146 Å²	146	124 Å²	124	76%	0.764	71%	0.713	S	S	*	*	S	Bend	trans	-97.5	12.7	179.9	-114.9	144.7	0	0	0	113.7
626	R	40	Very low	34.5	Very low	241 Å²	241	127.1 Å²	127.1	91%	0.909	71%	0.707	S	S	*	*	S	Bend	trans	-109.5	8.3	-176.6	-80.3	-171	-176.4	-136	-0.8	116
627	N	38.8	Very low	35.1	Very low	101 Å²	101	121.8 Å²	121.8	54%	0.54	68%	0.68	S	S	.	*			trans	-145.9	94.2	169.5	-151.4	-8.8	0	0	0	112.1	K629	N627-K629 PolarHBondContact O-N 3.03Å
628	P	35.8	Very low	36.6	Very low	134 Å²	134	121.4 Å²	121.4	87%	0.87	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	23.4	179.7	30.4	-32.4	0	0	0	113.5
629	K	34.1	Very low	38.9	Very low	180 Å²	180	118.6 Å²	118.6	78%	0.783	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	14.1	-175.3	-72	-170.9	173.9	178.9	0	115	N627	N627-K629 PolarHBondContact O-N 3.03Å
630	L	33.5	Very low	41.2	Very low	116 Å²	116	112.9 Å²	112.9	61%	0.607	60%	0.601	S	S	*	*	S	Bend	trans	-135.7	60	179.1	-70.2	173.7	0	0	0	112.5
631	L	31.6	Very low	43.4	Very low	117 Å²	117	113.2 Å²	113.2	61%	0.613	60%	0.601	S	S	*	*	S	Bend	trans	-156.5	117.9	162.6	-97.8	165	0	0	0	109.2
632	F	31.8	Very low	45	Very low	52 Å²	52	110 Å²	110	23%	0.228	58%	0.576	C	S	.	*			trans	24.2	117	174.6	-69.3	-106.1	0	0	0	122	C578 C579 P580 C593 G634	C578-F632 VanDerWaalsContact C-CE1 3.48Å; C578-F632 WeakPolarHBondContact O-CD1 3.03Å; C578-F632 VanDerWaalsContact O-CE1 3.29Å; C578-F632 WeakPolarHBondContact O-CE1 3.31Å; C579-F632 HydrophobicContact CB-CD1 4.43Å; C579-F632 HydrophobicContact CB-CE1 3.49Å; C579-F632 VanDerWaalsContact CB-CE1 3.49Å; C579-F632 HydrophobicContact CB-CE2 4.12Å; C579-F632 HydrophobicContact CB-CZ 3.29Å; C579-F632 VanDerWaalsContact N-CE1 3.3Å; P580-F632 HydrophobicContact CG-CG 4.47Å; P580-F632 VanDerWaalsContact CG-N 3.31Å; C593-F632 HydrophobicContact CB-CE2 3.83Å; C593-F632 HydrophobicContact CB-CZ 3.59Å; C593-F632 WeakPolarHBondContact SG-CE2 3.25Å; C593-F632 WeakPolarHBondContact SG-CZ 2.88Å; F632-G634 PolarHBondContact O-N 3.22Å
633	T	28.3	Very low	46.5	Very low	108 Å²	108	111 Å²	111	66%	0.663	58%	0.577	S	S	*	*	S	Bend	trans	-58	93.9	148.9	51	0	0	0	0	110.5
634	G	31.1	Very low	47.8	Very low	56 Å²	56	109.4 Å²	109.4	58%	0.577	57%	0.569	S	S	*	*	S	Bend	trans	-174.5	108.1	166.9	0	0	0	0	0	103	F632 R636	F632-G634 PolarHBondContact O-N 3.22Å; G634-R636 PolarHBondContact O-N 2.98Å
635	V	33.6	Very low	49.2	Very low	99 Å²	99	101.6 Å²	101.6	60%	0.6	53%	0.529	S	S	*	.			trans	-34.2	115	178.9	-176.6	0	0	0	0	108.1	D637	V635-D637 VanDerWaalsContact CG1-OD1 3.24Å; V635-D637 WeakPolarHBondContact CG1-OD1 3.18Å; V635-D637 PolarHBondContact O-N 3.42Å
636	R	39.1	Very low	50.9	Low	181 Å²	181	95.5 Å²	95.5	68%	0.683	50%	0.497	S	S	*	.			trans	-62.5	103.3	164.6	-80.2	177.3	-178.3	-170.2	-0.8	102.9	G634 D649	G634-R636 PolarHBondContact O-N 2.98Å; R636-D649 WeakPolarHBondContact CB-OD1 3.3Å; R636-D649 WeakPolarHBondContact CB-OD2 3.45Å; R636-D649 WeakPolarHBondContact O-CA 3.47Å; R636-D649 WeakPolarHBondContact O-CB 3.44Å; R636-D649 PolarHBondContact O-N 2.83Å
637	D	49.1	Very low	52.8	Low	60 Å²	60	84.1 Å²	84.1	32%	0.321	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120.6	166.7	-66.9	-34.7	0	0	0	105.8	V635 V639 T646 C647 S648	V635-D637 VanDerWaalsContact CG1-OD1 3.24Å; V635-D637 WeakPolarHBondContact CG1-OD1 3.18Å; V635-D637 PolarHBondContact O-N 3.42Å; D637-V639 PolarHBondContact O-N 3.02Å; D637-T646 HydrophobicContact CB-CG2 4.23Å; D637-C647 CarbonylContact C-O 3.29Å; D637-C647 VanDerWaalsContact C-O 3.27Å; D637-C647 WeakPolarHBondContact CA-O 3.48Å; D637-C647 WeakPolarHBondContact CB-O 3.25Å; D637-S648 WeakPolarHBondContact OD1-CA 3.4Å; D637-S648 PolarHBondContact OD1-N 3.03Å; D637-S648 PolarHBondContact OD1-OG 3.22Å
638	H	66.7	Low	54.6	Low	61 Å²	61	80.8 Å²	80.8	28%	0.282	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	127	168.7	60.9	-66.9	0	0	0	108	C640 C647 S648 Q651 C653	H638-C640 PolarHBondContact O-N 3.47Å; H638-C647 WeakPolarHBondContact CE1-CB 3.48Å; H638-C647 PolarHBondContact CE1-O 3.02Å; H638-C647 PolarHBondContact N-O 2.74Å; H638-C647 PolarHBondContact ND1-O 2.58Å; H638-C647 VanDerWaalsContact ND1-O 3.08Å; H638-C647 PolarHBondContact O-N 2.82Å; H638-S648 PolarHBondContact CE1-O 2.95Å; H638-S648 PolarHBondContact ND1-O 2.98Å; H638-Q651 PolarHBondContact CE1-O 2.89Å; H638-Q651 PolarHBondContact NE2-O 3.07Å; H638-C653 PolarHBondContact CD2-SG 3.18Å; H638-C653 PolarHBondContact NE2-N 2.96Å; H638-C653 PolarHBondContact NE2-SG 3.08Å
639	V	74.6	Confident	56	Low	61 Å²	61	79 Å²	79	37%	0.37	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.1	175	178.9	0	0	0	0	107.3	D637 H643 T646	D637-V639 PolarHBondContact O-N 3.02Å; V639-H643 HydrophobicContact CG1-CB 4.39Å; V639-T646 HydrophobicContact CG2-CG2 4.28Å
640	C	81.3	Confident	57.7	Low	1 Å²	1	74.1 Å²	74.1	1%	0.007	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-63.7	153.7	177.1	-60	0	0	0	0	110.3	H638 G642 H643 S645 C653 W661	H638-C640 PolarHBondContact O-N 3.47Å; C640-G642 PolarHBondContact O-N 2.68Å; C640-H643 PolarHBondContact O-N 3.14Å; C640-S645 WeakPolarHBondContact CB-OG 3.25Å; C640-S645 PolarHBondContact N-O 3.4Å; C640-C653 WeakPolarHBondContact CA-SG 3.47Å; C640-C653 HydrophobicContact CB-CB 3.73Å; C640-C653 WeakPolarHBondContact CB-SG 3.4Å; C640-C653 WeakPolarHBondContact SG-CB 3.1Å; C640-C653 CovalentContact SG-SG 2.04Å; C640-C653 PolarHBondContact SG-SG 2.9Å; C640-W661 HydrophobicContact CB-CB 3.89Å; C640-W661 HydrophobicContact CB-CD2 3.51Å; C640-W661 HydrophobicContact CB-CE3 3.87Å; C640-W661 HydrophobicContact CB-CG 3.49Å; C640-W661 VanDerWaalsContact CB-CG 3.49Å
641	P	77.1	Confident	60	Low	97 Å²	97	70.9 Å²	70.9	63%	0.63	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-10.3	-174.2	-25.2	30	0	0	0	116.8	W661	P641-W661 HydrophobicContact CB-CH2 3.77Å; P641-W661 HydrophobicContact CB-CZ2 3.53Å; P641-W661 VanDerWaalsContact CD-CH2 3.42Å; P641-W661 HydrophobicContact CG-CH2 3.43Å; P641-W661 VanDerWaalsContact CG-CH2 3.43Å; P641-W661 HydrophobicContact CG-CZ2 3.72Å; P641-W661 HydrophobicContact CG-CZ3 4.1Å
642	G	66.8	Low	62.5	Low	26 Å²	26	67.2 Å²	67.2	27%	0.268	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.1	172	0	0	0	0	0	115.8	C640 Q644 W661	C640-G642 PolarHBondContact O-N 2.68Å; G642-Q644 WeakPolarHBondContact O-CG 2.98Å; G642-Q644 PolarHBondContact O-N 2.89Å; G642-W661 VanDerWaalsContact N-NE1 3.11Å
643	H	66.9	Low	65.2	Low	145 Å²	145	65.6 Å²	65.6	67%	0.671	37%	0.365	S	S	*	.	S	Bend	trans	58.3	-2.2	-178.6	-65.1	-97.3	0	0	0	117.2	V639 C640	V639-H643 HydrophobicContact CG1-CB 4.39Å; C640-H643 PolarHBondContact O-N 3.14Å
644	Q	66.3	Low	68.1	Low	147 Å²	147	60.5 Å²	60.5	69%	0.687	33%	0.333	S	S	*	.	S	Bend	trans	-93.8	-10.8	-176.4	-69.2	169.6	30.6	0	0	113.2	G642 S811 K812	G642-Q644 WeakPolarHBondContact O-CG 2.98Å; G642-Q644 PolarHBondContact O-N 2.89Å; Q644-S811 WeakPolarHBondContact O-CA 3.32Å; Q644-K812 PolarHBondContact O-N 2.88Å; Q644-K812 VanDerWaalsContact O-N 3.15Å
645	S	67.2	Low	70.7	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.028	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	148.5	-164.1	40.5	0	0	0	0	112.4	C640 W661 S809	C640-S645 WeakPolarHBondContact CB-OG 3.25Å; C640-S645 PolarHBondContact N-O 3.4Å; S645-W661 WeakPolarHBondContact OG-CB 3.44Å; S645-S809 VanDerWaalsContact CB-CB 3.47Å; S645-S809 WeakPolarHBondContact CB-OG 3.42Å
646	T	76.1	Confident	73	Confident	18 Å²	18	60.6 Å²	60.6	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.8	-178.2	52.7	0	0	0	0	110.4	D637 V639 C663	D637-T646 HydrophobicContact CB-CG2 4.23Å; V639-T646 HydrophobicContact CG2-CG2 4.28Å; T646-C663 PolarHBondContact O-SG 3.23Å
647	C	79.4	Confident	74.9	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.014	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.7	173.7	-62.7	0	0	0	0	108.8	D637 H638 Q651 C653 C663	D637-C647 CarbonylContact C-O 3.29Å; D637-C647 VanDerWaalsContact C-O 3.27Å; D637-C647 WeakPolarHBondContact CA-O 3.48Å; D637-C647 WeakPolarHBondContact CB-O 3.25Å; H638-C647 WeakPolarHBondContact CE1-CB 3.48Å; H638-C647 PolarHBondContact CE1-O 3.02Å; H638-C647 PolarHBondContact N-O 2.74Å; H638-C647 PolarHBondContact ND1-O 2.58Å; H638-C647 VanDerWaalsContact ND1-O 3.08Å; H638-C647 PolarHBondContact O-N 2.82Å; C647-Q651 HydrophobicContact CB-CB 4.03Å; C647-C653 VanDerWaalsContact SG-SG 3.62Å; C647-C663 WeakPolarHBondContact CA-SG 2.99Å; C647-C663 HydrophobicContact CB-CB 3.75Å; C647-C663 WeakPolarHBondContact CB-SG 3.46Å; C647-C663 WeakPolarHBondContact SG-CA 3.06Å; C647-C663 WeakPolarHBondContact SG-CB 3.4Å; C647-C663 CovalentContact SG-SG 2.03Å; C647-C663 PolarHBondContact SG-SG 2.86Å
648	S	76.3	Confident	76.3	Confident	31 Å²	31	58 Å²	58	22%	0.217	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	152.2	-179.7	-55.2	0	0	0	0	112.3	D637 H638 D650 Q651	D637-S648 WeakPolarHBondContact OD1-CA 3.4Å; D637-S648 PolarHBondContact OD1-N 3.03Å; D637-S648 PolarHBondContact OD1-OG 3.22Å; H638-S648 PolarHBondContact CE1-O 2.95Å; H638-S648 PolarHBondContact ND1-O 2.98Å; S648-D650 WeakPolarHBondContact CB-OD1 3.24Å; S648-D650 PolarHBondContact O-N 3.37Å; S648-Q651 WeakPolarHBondContact O-CA 3.49Å; S648-Q651 WeakPolarHBondContact O-CB 3.44Å; S648-Q651 PolarHBondContact O-N 3.5Å
649	D	64.8	Low	76.7	Confident	98 Å²	98	62.5 Å²	62.5	52%	0.524	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-26	-178.1	-102.5	1.9	0	0	0	115.9	R636	R636-D649 WeakPolarHBondContact CB-OD1 3.3Å; R636-D649 WeakPolarHBondContact CB-OD2 3.45Å; R636-D649 WeakPolarHBondContact O-CA 3.47Å; R636-D649 WeakPolarHBondContact O-CB 3.44Å; R636-D649 PolarHBondContact O-N 2.83Å
650	D	69.2	Low	77	Confident	77 Å²	77	61.7 Å²	61.7	41%	0.412	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-7.1	179	61.2	-25.8	0	0	0	113.7	S648 K667 N668	S648-D650 WeakPolarHBondContact CB-OD1 3.24Å; S648-D650 PolarHBondContact O-N 3.37Å; D650-K667 HydrophobicContact CB-CG 4.18Å; D650-K667 CarbonylContact O-C 3.52Å; D650-K667 WeakPolarHBondContact O-CA 3.13Å; D650-N668 PolarHBondContact O-N 2.95Å
651	Q	82.4	Confident	77.2	Confident	47 Å²	47	64 Å²	64	22%	0.22	34%	0.335	C	S	.	.	S	Bend	trans	-91.4	158.3	175.7	-63.5	-177	-22.3	0	0	111.1	H638 C647 S648 C663 C664	H638-Q651 PolarHBondContact CE1-O 2.89Å; H638-Q651 PolarHBondContact NE2-O 3.07Å; C647-Q651 HydrophobicContact CB-CB 4.03Å; S648-Q651 WeakPolarHBondContact O-CA 3.49Å; S648-Q651 WeakPolarHBondContact O-CB 3.44Å; S648-Q651 PolarHBondContact O-N 3.5Å; Q651-C663 HydrophobicContact CB-CB 4.39Å; Q651-C664 WeakPolarHBondContact CB-O 3.06Å; Q651-C664 WeakPolarHBondContact CG-O 3.27Å
652	T	84	Confident	77.4	Confident	40 Å²	40	59.3 Å²	59.3	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.8	174.1	-55.9	0	0	0	0	110.1	C654 C664 G669	T652-C654 PolarHBondContact O-N 2.61Å; T652-C664 PolarHBondContact O-N 2.9Å; T652-G669 WeakPolarHBondContact CB-O 3.22Å; T652-G669 WeakPolarHBondContact CG2-O 3.25Å; T652-G669 PolarHBondContact OG1-N 3.44Å; T652-G669 PolarHBondContact OG1-O 2.95Å
653	C	88.1	Confident	78.5	Confident	19 Å²	19	58.4 Å²	58.4	13%	0.128	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	114	172.1	-76.3	0	0	0	0	109.7	H638 C640 C647 W661	H638-C653 PolarHBondContact CD2-SG 3.18Å; H638-C653 PolarHBondContact NE2-N 2.96Å; H638-C653 PolarHBondContact NE2-SG 3.08Å; C640-C653 WeakPolarHBondContact CA-SG 3.47Å; C640-C653 HydrophobicContact CB-CB 3.73Å; C640-C653 WeakPolarHBondContact CB-SG 3.4Å; C640-C653 WeakPolarHBondContact SG-CB 3.1Å; C640-C653 CovalentContact SG-SG 2.04Å; C640-C653 PolarHBondContact SG-SG 2.9Å; C647-C653 VanDerWaalsContact SG-SG 3.62Å; C653-W661 HydrophobicContact CB-CE3 3.74Å; C653-W661 HydrophobicContact CB-CZ3 4.01Å
654	C	89.3	Confident	79.4	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.8	178	-61.6	0	0	0	0	110.7	T652 W661 G662 C671 L806	T652-C654 PolarHBondContact O-N 2.61Å; C654-W661 WeakPolarHBondContact O-CA 3.49Å; C654-G662 PolarHBondContact N-O 2.8Å; C654-G662 PolarHBondContact O-N 2.75Å; C654-C671 WeakPolarHBondContact CA-SG 3.37Å; C654-C671 HydrophobicContact CB-CB 3.77Å; C654-C671 WeakPolarHBondContact CB-SG 3.37Å; C654-C671 VanDerWaalsContact SG-CA 3.52Å; C654-C671 WeakPolarHBondContact SG-CB 3.5Å; C654-C671 CovalentContact SG-SG 2.03Å; C654-C671 PolarHBondContact SG-SG 2.92Å; C654-L806 HydrophobicContact CB-CD1 3.5Å; C654-L806 HydrophobicContact CB-CD2 3.45Å; C654-L806 VanDerWaalsContact CB-CD2 3.45Å; C654-L806 HydrophobicContact CB-CG 4.12Å; C654-L806 VanDerWaalsContact SG-CD2 3.6Å
655	R	86.4	Confident	80.1	Confident	127 Å²	127	45.4 Å²	45.4	48%	0.479	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	125.9	179.2	-168.8	-179.8	-173.5	-177.5	3.4	109.7	W661 H675	R655-W661 HydrophobicContact CB-CZ3 4.5Å; R655-H675 VanDerWaalsContact O-CB 3.27Å; R655-H675 WeakPolarHBondContact O-CB 3.48Å; R655-H675 PolarHBondContact O-ND1 2.7Å
656	L	81.3	Confident	80.7	Confident	29 Å²	29	45.5 Å²	45.5	15%	0.152	24%	0.236	C	C	.	.			trans	-81	164.3	173.4	-76	159.6	0	0	0	111	D658 K659 S660 L806	L656-D658 VanDerWaalsContact CB-OD1 3.25Å; L656-D658 WeakPolarHBondContact CB-OD1 3.34Å; L656-D658 PolarHBondContact O-N 3.29Å; L656-K659 PolarHBondContact O-N 3.24Å; L656-K659 VanDerWaalsContact O-N 3.1Å; L656-S660 VanDerWaalsContact CD1-OG 3.23Å; L656-S660 WeakPolarHBondContact CD1-OG 3.44Å; L656-S660 PolarHBondContact N-O 3.19Å; L656-L806 HydrophobicContact CD2-CB 4.3Å; L656-L806 HydrophobicContact CD2-CD1 4.23Å
657	P	79.5	Confident	80.7	Confident	72 Å²	72	49.4 Å²	49.4	47%	0.468	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.4	-178.8	-19.9	30.4	0	0	0	114.1	K659 H675 F676	P657-K659 PolarHBondContact O-N 2.67Å; P657-H675 WeakPolarHBondContact CD-O 3.22Å; P657-H675 HydrophobicContact CG-CB 4.06Å; P657-F676 HydrophobicContact CB-CZ 4.3Å; P657-F676 HydrophobicContact CG-CD1 4.21Å; P657-F676 HydrophobicContact CG-CD2 4.19Å; P657-F676 HydrophobicContact CG-CE1 3.64Å; P657-F676 HydrophobicContact CG-CE2 3.59Å; P657-F676 HydrophobicContact CG-CG 4.47Å; P657-F676 HydrophobicContact CG-CZ 3.31Å
658	D	78.6	Confident	80.6	Confident	114 Å²	114	53.9 Å²	53.9	61%	0.61	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	7.2	178.9	67.9	-9.8	0	0	0	113.6	L656 S660	L656-D658 VanDerWaalsContact CB-OD1 3.25Å; L656-D658 WeakPolarHBondContact CB-OD1 3.34Å; L656-D658 PolarHBondContact O-N 3.29Å; D658-S660 PolarHBondContact O-N 2.71Å; D658-S660 VanDerWaalsContact OD1-CB 3.22Å; D658-S660 WeakPolarHBondContact OD1-CB 3.08Å; D658-S660 PolarHBondContact OD1-N 3.45Å; D658-S660 PolarHBondContact OD1-OG 3.25Å; D658-S660 PolarHBondContact OD2-OG 3.03Å; D658-S660 VanDerWaalsContact OD2-OG 3.07Å
659	K	75.1	Confident	80.8	Confident	157 Å²	157	52.6 Å²	52.6	68%	0.683	27%	0.266	S	S	*	.	S	Bend	trans	69.4	3.5	-174.1	-48.2	174.1	-179.2	174.3	0	114.8	L656 P657	L656-K659 PolarHBondContact O-N 3.24Å; L656-K659 VanDerWaalsContact O-N 3.1Å; P657-K659 PolarHBondContact O-N 2.67Å
660	S	80.9	Confident	81.8	Confident	43 Å²	43	51 Å²	51	30%	0.301	26%	0.26	S	S	.	.			trans	-75.2	179.6	166.8	78.5	0	0	0	0	110.5	L656 D658	L656-S660 VanDerWaalsContact CD1-OG 3.23Å; L656-S660 WeakPolarHBondContact CD1-OG 3.44Å; L656-S660 PolarHBondContact N-O 3.19Å; D658-S660 PolarHBondContact O-N 2.71Å; D658-S660 VanDerWaalsContact OD1-CB 3.22Å; D658-S660 WeakPolarHBondContact OD1-CB 3.08Å; D658-S660 PolarHBondContact OD1-N 3.45Å; D658-S660 PolarHBondContact OD1-OG 3.25Å; D658-S660 PolarHBondContact OD2-OG 3.03Å; D658-S660 VanDerWaalsContact OD2-OG 3.07Å
661	W	84.7	Confident	82.7	Confident	49 Å²	49	49.8 Å²	49.8	19%	0.186	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.3	-179.9	-65.6	89.7	0	0	0	110.7	C640 P641 G642 S645 C653 C654 R655 S809	C640-W661 HydrophobicContact CB-CB 3.89Å; C640-W661 HydrophobicContact CB-CD2 3.51Å; C640-W661 HydrophobicContact CB-CE3 3.87Å; C640-W661 HydrophobicContact CB-CG 3.49Å; C640-W661 VanDerWaalsContact CB-CG 3.49Å; P641-W661 HydrophobicContact CB-CH2 3.77Å; P641-W661 HydrophobicContact CB-CZ2 3.53Å; P641-W661 VanDerWaalsContact CD-CH2 3.42Å; P641-W661 HydrophobicContact CG-CH2 3.43Å; P641-W661 VanDerWaalsContact CG-CH2 3.43Å; P641-W661 HydrophobicContact CG-CZ2 3.72Å; P641-W661 HydrophobicContact CG-CZ3 4.1Å; G642-W661 VanDerWaalsContact N-NE1 3.11Å; S645-W661 WeakPolarHBondContact OG-CB 3.44Å; C653-W661 HydrophobicContact CB-CE3 3.74Å; C653-W661 HydrophobicContact CB-CZ3 4.01Å; C654-W661 WeakPolarHBondContact O-CA 3.49Å; R655-W661 HydrophobicContact CB-CZ3 4.5Å; W661-S809 VanDerWaalsContact O-CB 3.22Å; W661-S809 WeakPolarHBondContact O-CB 3.41Å; W661-S809 PolarHBondContact O-N 2.73Å; W661-S809 PolarHBondContact O-OG 2.9Å
662	G	82.9	Confident	83	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	157.6	167.1	0	0	0	0	0	110.5	C654 I807	C654-G662 PolarHBondContact N-O 2.8Å; C654-G662 PolarHBondContact O-N 2.75Å; G662-I807 CarbonylContact C-O 3.49Å; G662-I807 WeakPolarHBondContact CA-O 3.48Å
663	C	88.2	Confident	82.9	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.5	175.6	-53.6	0	0	0	0	109.5	T646 C647 Q651 P665 I807	T646-C663 PolarHBondContact O-SG 3.23Å; C647-C663 WeakPolarHBondContact CA-SG 2.99Å; C647-C663 HydrophobicContact CB-CB 3.75Å; C647-C663 WeakPolarHBondContact CB-SG 3.46Å; C647-C663 WeakPolarHBondContact SG-CA 3.06Å; C647-C663 WeakPolarHBondContact SG-CB 3.4Å; C647-C663 CovalentContact SG-SG 2.03Å; C647-C663 PolarHBondContact SG-SG 2.86Å; Q651-C663 HydrophobicContact CB-CB 4.39Å; C663-P665 WeakPolarHBondContact O-CD 3.23Å; C663-I807 PolarHBondContact N-O 3.49Å; C663-I807 PolarHBondContact O-N 3.3Å
664	C	85.9	Confident	82.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	124.1	170.6	179.6	0	0	0	0	109.8	Q651 T652 L666 C678 L806	Q651-C664 WeakPolarHBondContact CB-O 3.06Å; Q651-C664 WeakPolarHBondContact CG-O 3.27Å; T652-C664 PolarHBondContact O-N 2.9Å; C664-L666 PolarHBondContact O-N 2.8Å; C664-C678 VanDerWaalsContact CA-SG 3.51Å; C664-C678 HydrophobicContact CB-CB 3.63Å; C664-C678 WeakPolarHBondContact CB-SG 3.23Å; C664-C678 WeakPolarHBondContact SG-CB 3.44Å; C664-C678 CovalentContact SG-SG 2.03Å; C664-C678 PolarHBondContact SG-SG 2.79Å; C664-L806 HydrophobicContact CB-CD2 4.24Å
665	P	81.7	Confident	82.4	Confident	19 Å²	19	53.4 Å²	53.4	12%	0.123	29%	0.287	C	S	.	.	S	Bend	trans	-71.6	-8.6	-179.9	28.1	-35.8	0	0	0	114.1	C663 M712 P804 I807	C663-P665 WeakPolarHBondContact O-CD 3.23Å; P665-M712 HydrophobicContact CB-SD 4.13Å; P665-M712 HydrophobicContact CG-SD 3.74Å; P665-P804 HydrophobicContact CG-CB 4.16Å; P665-P804 HydrophobicContact CG-CG 4.39Å; P665-I807 HydrophobicContact CB-CD1 3.85Å; P665-I807 HydrophobicContact CB-CG1 4.49Å; P665-I807 HydrophobicContact CG-CD1 4.4Å
666	L	79.1	Confident	82.1	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.031	29%	0.286	C	S	.	.	S	Bend	trans	-89.8	134.3	178.6	-57.6	175.9	0	0	0	110.2	C664 N668 G669 C679 P680 M712 P804	C664-L666 PolarHBondContact O-N 2.8Å; L666-N668 PolarHBondContact O-N 2.86Å; L666-G669 PolarHBondContact O-N 3.01Å; L666-C679 VanDerWaalsContact CD1-C 3.47Å; L666-P680 HydrophobicContact CD1-CB 4.19Å; L666-P680 HydrophobicContact CD1-CG 4.46Å; L666-P680 VanDerWaalsContact CD1-N 3.33Å; L666-M712 HydrophobicContact CD2-CG 4.04Å; L666-P804 HydrophobicContact CD1-CG 3.52Å; L666-P804 HydrophobicContact CD2-CG 4.11Å; L666-P804 HydrophobicContact CG-CG 3.71Å
667	K	76.5	Confident	82.3	Confident	100 Å²	100	52.4 Å²	52.4	44%	0.435	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	119.5	173.6	-178	171.4	-178.5	-169.6	0	110.4	D650 G669	D650-K667 HydrophobicContact CB-CG 4.18Å; D650-K667 CarbonylContact O-C 3.52Å; D650-K667 WeakPolarHBondContact O-CA 3.13Å; K667-G669 PolarHBondContact O-N 3.45Å
668	N	76.5	Confident	82.6	Confident	97 Å²	97	49 Å²	49	52%	0.519	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	34	-176.2	-58.9	-27.5	0	0	0	113.9	D650 L666 A681	D650-N668 PolarHBondContact O-N 2.95Å; L666-N668 PolarHBondContact O-N 2.86Å; N668-A681 HydrophobicContact CB-CB 4.09Å; N668-A681 WeakPolarHBondContact O-CB 3.27Å
669	G	81.4	Confident	83	Confident	3 Å²	3	43.6 Å²	43.6	3%	0.031	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-65.1	150.3	-175.7	0	0	0	0	0	114.3	T652 L666 K667 C679	T652-G669 WeakPolarHBondContact CB-O 3.22Å; T652-G669 WeakPolarHBondContact CG2-O 3.25Å; T652-G669 PolarHBondContact OG1-N 3.44Å; T652-G669 PolarHBondContact OG1-O 2.95Å; L666-G669 PolarHBondContact O-N 3.01Å; K667-G669 PolarHBondContact O-N 3.45Å; G669-C679 CarbonylContact C-O 3.45Å; G669-C679 WeakPolarHBondContact CA-O 3.49Å
670	V	85.5	Confident	83.3	Confident	66 Å²	66	36.4 Å²	36.4	40%	0.4	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.6	178	-177.2	0	0	0	0	109.2	C672 C678 C679	V670-C672 PolarHBondContact O-N 2.81Å; V670-C678 CarbonylContact O-C 3.45Å; V670-C678 VanDerWaalsContact O-CA 3.23Å; V670-C678 WeakPolarHBondContact O-CA 3.32Å; V670-C678 WeakPolarHBondContact O-CB 3.19Å; V670-C679 PolarHBondContact N-O 3.04Å; V670-C679 PolarHBondContact O-N 2.7Å
671	C	89.1	Confident	82.9	Confident	51 Å²	51	36.9 Å²	36.9	35%	0.345	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	129	177.4	-53.8	0	0	0	0	111.1	C654	C654-C671 WeakPolarHBondContact CA-SG 3.37Å; C654-C671 HydrophobicContact CB-CB 3.77Å; C654-C671 WeakPolarHBondContact CB-SG 3.37Å; C654-C671 VanDerWaalsContact SG-CA 3.52Å; C654-C671 WeakPolarHBondContact SG-CB 3.5Å; C654-C671 CovalentContact SG-SG 2.03Å; C654-C671 PolarHBondContact SG-SG 2.92Å
672	C	88.1	Confident	82.1	Confident	8 Å²	8	37.8 Å²	37.8	5%	0.054	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-78	150.1	175.2	-61.9	0	0	0	0	111.2	V670 D674 H675 H677 C679 C685 L687	V670-C672 PolarHBondContact O-N 2.81Å; C672-D674 WeakPolarHBondContact CB-OD1 3.13Å; C672-D674 PolarHBondContact O-N 2.04Å; C672-D674 VanDerWaalsContact O-N 3.16Å; C672-H675 PolarHBondContact O-N 2.84Å; C672-H677 HydrophobicContact CB-CB 4.23Å; C672-H677 VanDerWaalsContact CB-O 3.28Å; C672-H677 WeakPolarHBondContact CB-O 3.15Å; C672-H677 PolarHBondContact N-O 3.11Å; C672-C679 VanDerWaalsContact SG-SG 3.62Å; C672-C685 WeakPolarHBondContact CA-SG 3.31Å; C672-C685 HydrophobicContact CB-CB 3.72Å; C672-C685 WeakPolarHBondContact CB-SG 3.04Å; C672-C685 WeakPolarHBondContact SG-CB 3.24Å; C672-C685 CovalentContact SG-SG 2.05Å; C672-C685 PolarHBondContact SG-SG 2.72Å; C672-L687 HydrophobicContact CB-CD2 3.79Å
673	G	82.4	Confident	81.7	Confident	58 Å²	58	38.1 Å²	38.1	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.3	-179.2	0	0	0	0	0	115	H675	G673-H675 VanDerWaalsContact C-N 3.31Å
674	D	82.1	Confident	81.2	Confident	40 Å²	40	42.5 Å²	42.5	21%	0.214	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.2	174.3	62.9	10.1	0	0	0	113.8	C672 F676 H677 L687	C672-D674 WeakPolarHBondContact CB-OD1 3.13Å; C672-D674 PolarHBondContact O-N 2.04Å; C672-D674 VanDerWaalsContact O-N 3.16Å; D674-F676 WeakPolarHBondContact O-CD2 3.37Å; D674-F676 PolarHBondContact O-N 3.34Å; D674-F676 VanDerWaalsContact O-N 3.14Å; D674-F676 PolarHBondContact OD1-N 3.14Å; D674-H677 PolarHBondContact OD1-N 3.18Å; D674-H677 VanDerWaalsContact OD1-N 3.08Å; D674-H677 IonicContact OD1-ND1 2.67Å; D674-H677 IonicContact OD2-CE1 2.71Å; D674-H677 IonicContact OD2-CG 3.62Å; D674-H677 IonicContact OD2-ND1 3.45Å; D674-H677 PolarHBondContact OD2-ND1 3.31Å; D674-L687 HydrophobicContact CB-CD2 3.94Å
675	H	83.6	Confident	81	Confident	77 Å²	77	44 Å²	44	36%	0.356	27%	0.273	S	S	.	.	S	Bend	trans	63.2	10	-178.5	-59.3	-67.7	0	0	0	115.3	R655 P657 C672 G673 L806	R655-H675 VanDerWaalsContact O-CB 3.27Å; R655-H675 WeakPolarHBondContact O-CB 3.48Å; R655-H675 PolarHBondContact O-ND1 2.7Å; P657-H675 WeakPolarHBondContact CD-O 3.22Å; P657-H675 HydrophobicContact CG-CB 4.06Å; C672-H675 PolarHBondContact O-N 2.84Å; G673-H675 VanDerWaalsContact C-N 3.31Å; H675-L806 WeakPolarHBondContact O-CD1 3.14Å
676	F	80.8	Confident	80.8	Confident	107 Å²	107	44.8 Å²	44.8	47%	0.469	28%	0.277	S	S	.	.	S	Bend	trans	-116	-29.8	-179.4	-74.3	-76.2	0	0	0	112.9	P657 D674 T805 L806	P657-F676 HydrophobicContact CB-CZ 4.3Å; P657-F676 HydrophobicContact CG-CD1 4.21Å; P657-F676 HydrophobicContact CG-CD2 4.19Å; P657-F676 HydrophobicContact CG-CE1 3.64Å; P657-F676 HydrophobicContact CG-CE2 3.59Å; P657-F676 HydrophobicContact CG-CG 4.47Å; P657-F676 HydrophobicContact CG-CZ 3.31Å; D674-F676 WeakPolarHBondContact O-CD2 3.37Å; D674-F676 PolarHBondContact O-N 3.34Å; D674-F676 VanDerWaalsContact O-N 3.14Å; D674-F676 PolarHBondContact OD1-N 3.14Å; F676-T805 CarbonylContact O-C 3.59Å; F676-T805 WeakPolarHBondContact O-CA 3.49Å; F676-T805 WeakPolarHBondContact O-CG2 3.13Å; F676-L806 WeakPolarHBondContact O-CG 2.96Å; F676-L806 PolarHBondContact O-N 3.4Å
677	H	84.4	Confident	80.6	Confident	28 Å²	28	48.2 Å²	48.2	13%	0.13	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-119.1	164.7	-174.7	-51.6	95.1	0	0	0	112.6	C672 D674 A803 P804	C672-H677 HydrophobicContact CB-CB 4.23Å; C672-H677 VanDerWaalsContact CB-O 3.28Å; C672-H677 WeakPolarHBondContact CB-O 3.15Å; C672-H677 PolarHBondContact N-O 3.11Å; D674-H677 PolarHBondContact OD1-N 3.18Å; D674-H677 VanDerWaalsContact OD1-N 3.08Å; D674-H677 IonicContact OD1-ND1 2.67Å; D674-H677 IonicContact OD2-CE1 2.71Å; D674-H677 IonicContact OD2-CG 3.62Å; D674-H677 IonicContact OD2-ND1 3.45Å; D674-H677 PolarHBondContact OD2-ND1 3.31Å; H677-A803 HydrophobicContact CB-CB 3.65Å; H677-A803 PolarHBondContact CD2-O 2.81Å; H677-P804 CarbonylContact C-O 3.43Å; H677-P804 VanDerWaalsContact CA-O 3.24Å; H677-P804 WeakPolarHBondContact CA-O 2.95Å
678	C	87.8	Confident	80.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	161.6	164.2	67.8	0	0	0	0	110.9	C664 V670 P804 L806	C664-C678 VanDerWaalsContact CA-SG 3.51Å; C664-C678 HydrophobicContact CB-CB 3.63Å; C664-C678 WeakPolarHBondContact CB-SG 3.23Å; C664-C678 WeakPolarHBondContact SG-CB 3.44Å; C664-C678 CovalentContact SG-SG 2.03Å; C664-C678 PolarHBondContact SG-SG 2.79Å; V670-C678 CarbonylContact O-C 3.45Å; V670-C678 VanDerWaalsContact O-CA 3.23Å; V670-C678 WeakPolarHBondContact O-CA 3.32Å; V670-C678 WeakPolarHBondContact O-CB 3.19Å; C678-P804 PolarHBondContact N-O 3.12Å; C678-P804 WeakPolarHBondContact O-CD 2.96Å; C678-L806 HydrophobicContact CB-CD2 3.86Å
679	C	85.8	Confident	79.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	155.9	-175.9	-82.1	0	0	0	0	111.6	L666 G669 V670 C672 S683 C685 C692	L666-C679 VanDerWaalsContact CD1-C 3.47Å; G669-C679 CarbonylContact C-O 3.45Å; G669-C679 WeakPolarHBondContact CA-O 3.49Å; V670-C679 PolarHBondContact N-O 3.04Å; V670-C679 PolarHBondContact O-N 2.7Å; C672-C679 VanDerWaalsContact SG-SG 3.62Å; C679-S683 WeakPolarHBondContact CB-OG 3.12Å; C679-C685 PolarHBondContact SG-SG 2.87Å; C679-C692 WeakPolarHBondContact CA-SG 3.46Å; C679-C692 HydrophobicContact CB-CB 3.65Å; C679-C692 WeakPolarHBondContact CB-SG 3.45Å; C679-C692 WeakPolarHBondContact SG-CA 3.09Å; C679-C692 WeakPolarHBondContact SG-CB 3.24Å; C679-C692 CovalentContact SG-SG 2.02Å; C679-C692 PolarHBondContact SG-SG 2.81Å
680	P	81.2	Confident	79.1	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.039	33%	0.329	C	S	.	.			trans	-63.7	154.4	179.8	22.8	-30.4	0	0	0	111.8	L666 G682 S683 C692 F710	L666-P680 HydrophobicContact CD1-CB 4.19Å; L666-P680 HydrophobicContact CD1-CG 4.46Å; L666-P680 VanDerWaalsContact CD1-N 3.33Å; P680-G682 PolarHBondContact O-N 3.28Å; P680-S683 WeakPolarHBondContact CD-OG 3.48Å; P680-S683 WeakPolarHBondContact CG-OG 3.33Å; P680-S683 WeakPolarHBondContact O-CB 3.26Å; P680-S683 PolarHBondContact O-N 2.95Å; P680-S683 VanDerWaalsContact O-N 3.08Å; P680-S683 PolarHBondContact O-OG 2.04Å; P680-C692 HydrophobicContact CG-CB 4.47Å; P680-F710 HydrophobicContact CG-CZ 4.4Å
681	A	73.1	Confident	78.7	Confident	54 Å²	54	53.7 Å²	53.7	45%	0.446	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	133.3	175.2	0	0	0	0	0	111.1	N668 S683	N668-A681 HydrophobicContact CB-CB 4.09Å; N668-A681 WeakPolarHBondContact O-CB 3.27Å; A681-S683 VanDerWaalsContact C-N 3.34Å
682	G	68.7	Low	78.1	Confident	67 Å²	67	51.3 Å²	51.3	69%	0.691	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	3.3	-178.4	0	0	0	0	0	115.4	P680	P680-G682 PolarHBondContact O-N 3.28Å
683	S	74.4	Confident	77.3	Confident	8 Å²	8	53.2 Å²	53.2	6%	0.056	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	155.6	173.3	69.4	0	0	0	0	112.7	C679 P680 A681 I693	C679-S683 WeakPolarHBondContact CB-OG 3.12Å; P680-S683 WeakPolarHBondContact CD-OG 3.48Å; P680-S683 WeakPolarHBondContact CG-OG 3.33Å; P680-S683 WeakPolarHBondContact O-CB 3.26Å; P680-S683 PolarHBondContact O-N 2.95Å; P680-S683 VanDerWaalsContact O-N 3.08Å; P680-S683 PolarHBondContact O-OG 2.04Å; A681-S683 VanDerWaalsContact C-N 3.34Å; S683-I693 CarbonylContact C-O 3.58Å; S683-I693 VanDerWaalsContact CA-O 3.23Å; S683-I693 WeakPolarHBondContact CA-O 3.47Å; S683-I693 WeakPolarHBondContact CB-O 3.11Å
684	V	77.9	Confident	76.3	Confident	98 Å²	98	52.7 Å²	52.7	59%	0.594	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.2	179	-179.7	0	0	0	0	109.4	D686 I693	V684-D686 PolarHBondContact O-N 2.93Å; V684-I693 PolarHBondContact N-O 3.33Å; V684-I693 PolarHBondContact O-N 3.15Å
685	C	79.9	Confident	74.9	Confident	31 Å²	31	57.9 Å²	57.9	21%	0.209	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	116.9	174.1	-60.7	0	0	0	0	110.8	C672 C679 L687	C672-C685 WeakPolarHBondContact CA-SG 3.31Å; C672-C685 HydrophobicContact CB-CB 3.72Å; C672-C685 WeakPolarHBondContact CB-SG 3.04Å; C672-C685 WeakPolarHBondContact SG-CB 3.24Å; C672-C685 CovalentContact SG-SG 2.05Å; C672-C685 PolarHBondContact SG-SG 2.72Å; C679-C685 PolarHBondContact SG-SG 2.87Å; C685-L687 HydrophobicContact CB-CD2 4.12Å
686	D	79.5	Confident	73.2	Confident	36 Å²	36	56.8 Å²	56.8	19%	0.193	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	98	162.8	-177.8	-9.4	0	0	0	108.6	V684 D688 T689 K690 Q691 I693	V684-D686 PolarHBondContact O-N 2.93Å; D686-D688 PolarHBondContact O-N 3.15Å; D686-D688 WeakPolarHBondContact OD1-CB 3.32Å; D686-D688 PolarHBondContact OD1-N 2.87Å; D686-T689 WeakPolarHBondContact CB-OG1 3.05Å; D686-T689 PolarHBondContact O-N 2.95Å; D686-T689 PolarHBondContact OD1-N 2.75Å; D686-T689 VanDerWaalsContact OD1-N 3.15Å; D686-T689 PolarHBondContact OD1-OG1 3.17Å; D686-T689 VanDerWaalsContact OD2-CG2 3.3Å; D686-T689 WeakPolarHBondContact OD2-CG2 3.39Å; D686-T689 PolarHBondContact OD2-OG1 2.97Å; D686-K690 VanDerWaalsContact O-CA 3.27Å; D686-K690 WeakPolarHBondContact O-CA 2.99Å; D686-K690 PolarHBondContact O-N 2.71Å; D686-Q691 WeakPolarHBondContact CA-O 3.05Å; D686-Q691 WeakPolarHBondContact CB-O 3.39Å; D686-Q691 PolarHBondContact N-O 3.14Å; D686-Q691 PolarHBondContact O-N 2.9Å; D686-Q691 VanDerWaalsContact O-N 3.12Å; D686-I693 HydrophobicContact CB-CD1 3.78Å; D686-I693 HydrophobicContact CB-CG1 4.18Å
687	L	74.9	Confident	71.1	Confident	77 Å²	77	59.5 Å²	59.5	40%	0.403	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-24	-178.8	-57	-178.2	0	0	0	112.6	C672 D674 C685	C672-L687 HydrophobicContact CB-CD2 3.79Å; D674-L687 HydrophobicContact CB-CD2 3.94Å; C685-L687 HydrophobicContact CB-CD2 4.12Å
688	D	66.7	Low	68.7	Low	147 Å²	147	64.6 Å²	64.6	79%	0.786	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-38	-179.5	-66.2	-30.8	0	0	0	110.1	D686	D686-D688 PolarHBondContact O-N 3.15Å; D686-D688 WeakPolarHBondContact OD1-CB 3.32Å; D686-D688 PolarHBondContact OD1-N 2.87Å
689	T	65.5	Low	66	Low	62 Å²	62	72.1 Å²	72.1	38%	0.38	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-6.5	179.6	66.9	0	0	0	0	114.1	D686 Q691	D686-T689 WeakPolarHBondContact CB-OG1 3.05Å; D686-T689 PolarHBondContact O-N 2.95Å; D686-T689 PolarHBondContact OD1-N 2.75Å; D686-T689 VanDerWaalsContact OD1-N 3.15Å; D686-T689 PolarHBondContact OD1-OG1 3.17Å; D686-T689 VanDerWaalsContact OD2-CG2 3.3Å; D686-T689 WeakPolarHBondContact OD2-CG2 3.39Å; D686-T689 PolarHBondContact OD2-OG1 2.97Å; T689-Q691 PolarHBondContact O-N 3.44Å; T689-Q691 WeakPolarHBondContact OG1-CB 3.25Å
690	K	70.4	Confident	63.5	Low	127 Å²	127	78.6 Å²	78.6	55%	0.552	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	37.9	-172.2	-55	-179.5	-179.4	-178.4	0	112.5	D686 A803	D686-K690 VanDerWaalsContact O-CA 3.27Å; D686-K690 WeakPolarHBondContact O-CA 2.99Å; D686-K690 PolarHBondContact O-N 2.71Å; K690-A803 PolarHBondContact O-N 2.85Å
691	Q	75.6	Confident	61	Low	46 Å²	46	82.8 Å²	82.8	22%	0.215	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.3	-177.3	-66.6	176.2	-12.7	0	0	111.5	D686 T689 S801	D686-Q691 WeakPolarHBondContact CA-O 3.05Å; D686-Q691 WeakPolarHBondContact CB-O 3.39Å; D686-Q691 PolarHBondContact N-O 3.14Å; D686-Q691 PolarHBondContact O-N 2.9Å; D686-Q691 VanDerWaalsContact O-N 3.12Å; T689-Q691 PolarHBondContact O-N 3.44Å; T689-Q691 WeakPolarHBondContact OG1-CB 3.25Å; Q691-S801 CarbonylContact C-O 3.3Å; Q691-S801 VanDerWaalsContact CA-O 3.25Å; Q691-S801 WeakPolarHBondContact CA-O 3.13Å
692	C	76.5	Confident	59	Low	0 Å²	0	84.2 Å²	84.2	0%	0	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125	169.4	-49.8	0	0	0	0	108.6	C679 P680 K800 S801 A803	C679-C692 WeakPolarHBondContact CA-SG 3.46Å; C679-C692 HydrophobicContact CB-CB 3.65Å; C679-C692 WeakPolarHBondContact CB-SG 3.45Å; C679-C692 WeakPolarHBondContact SG-CA 3.09Å; C679-C692 WeakPolarHBondContact SG-CB 3.24Å; C679-C692 CovalentContact SG-SG 2.02Å; C679-C692 PolarHBondContact SG-SG 2.81Å; P680-C692 HydrophobicContact CG-CB 4.47Å; C692-K800 WeakPolarHBondContact O-CA 2.99Å; C692-S801 WeakPolarHBondContact CB-OG 3.19Å; C692-S801 PolarHBondContact N-O 2.91Å; C692-S801 PolarHBondContact O-N 2.78Å; C692-A803 VanDerWaalsContact SG-CA 3.5Å; C692-A803 VanDerWaalsContact SG-CB 3.55Å
693	I	73	Confident	57.2	Low	48 Å²	48	86.8 Å²	86.8	25%	0.246	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.5	-179.3	-55.9	176.1	0	0	0	108.1	S683 V684 D686 I798	S683-I693 CarbonylContact C-O 3.58Å; S683-I693 VanDerWaalsContact CA-O 3.23Å; S683-I693 WeakPolarHBondContact CA-O 3.47Å; S683-I693 WeakPolarHBondContact CB-O 3.11Å; V684-I693 PolarHBondContact N-O 3.33Å; V684-I693 PolarHBondContact O-N 3.15Å; D686-I693 HydrophobicContact CB-CD1 3.78Å; D686-I693 HydrophobicContact CB-CG1 4.18Å; I693-I798 HydrophobicContact CG2-CG2 3.92Å
694	L	60.6	Low	55.4	Low	47 Å²	47	95.2 Å²	95.2	25%	0.246	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.7	174.2	-164	79.9	0	0	0	109.2	L696 M799	L694-L696 HydrophobicContact CD2-CD2 4.37Å; L694-L696 HydrophobicContact CD2-CG 4.48Å; L694-M799 HydrophobicContact CB-CB 4.29Å; L694-M799 PolarHBondContact N-O 3.05Å
695	Q	52.5	Low	53.2	Low	149 Å²	149	96 Å²	96	70%	0.696	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	105.8	176.4	-167.7	170	-23.2	0	0	108.7	E697	Q695-E697 PolarHBondContact O-N 3.24Å
696	L	47.6	Very low	51.1	Low	54 Å²	54	99.1 Å²	99.1	28%	0.283	52%	0.516	S	S	.	.			trans	-82.3	102.4	176.6	-72.2	159.2	0	0	0	109.1	L694 L698 T702 N797	L694-L696 HydrophobicContact CD2-CD2 4.37Å; L694-L696 HydrophobicContact CD2-CG 4.48Å; L696-L698 PolarHBondContact O-N 3.47Å; L696-T702 HydrophobicContact CD2-CG2 4.41Å; L696-N797 HydrophobicContact CB-CB 4.12Å; L696-N797 HydrophobicContact CD1-CB 4.07Å
697	E	36.4	Very low	48.9	Very low	164 Å²	164	107.1 Å²	107.1	77%	0.766	55%	0.545	S	S	*	.			trans	-73.7	113.2	167.8	-69.3	-175.6	166.5	0	0	109.3	Q695 N699	Q695-E697 PolarHBondContact O-N 3.24Å; E697-N699 PolarHBondContact O-N 3.08Å
698	L	35.7	Very low	46.8	Very low	135 Å²	135	108.7 Å²	108.7	71%	0.707	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	98	168.1	-93.5	91	0	0	0	108	L696 N797	L696-L698 PolarHBondContact O-N 3.47Å; L698-N797 VanDerWaalsContact CD1-ND2 3.26Å; L698-N797 WeakPolarHBondContact CD1-ND2 3.43Å
699	N	29.4	Very low	45.2	Very low	158 Å²	158	102.8 Å²	102.8	85%	0.845	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.2	28.7	147.2	-89.6	-10.5	0	0	0	114.3	E697	E697-N699 PolarHBondContact O-N 3.08Å
700	Q	33.8	Very low	43.5	Very low	137 Å²	137	106 Å²	106	64%	0.64	54%	0.537	S	S	*	.	S	Bend	trans	-138.6	140.2	164.9	-70.5	-176.8	-5.1	0	0	109.7	T702	Q700-T702 WeakPolarHBondContact O-CG2 3.15Å; Q700-T702 PolarHBondContact O-N 3.19Å
701	S	29.1	Very low	41.6	Very low	94 Å²	94	105.6 Å²	105.6	66%	0.657	55%	0.545	S	S	*	.			trans	-42.1	89.4	178	157.7	0	0	0	0	113.9	T703	S701-T703 VanDerWaalsContact C-N 3.29Å; S701-T703 PolarHBondContact O-N 3.19Å
702	T	30.3	Very low	39.4	Very low	83 Å²	83	107.9 Å²	107.9	51%	0.509	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.7	60.9	-178.6	35.7	0	0	0	0	112.2	L696 Q700	L696-T702 HydrophobicContact CD2-CG2 4.41Å; Q700-T702 WeakPolarHBondContact O-CG2 3.15Å; Q700-T702 PolarHBondContact O-N 3.19Å
703	T	32.3	Very low	37.1	Very low	121 Å²	121	116.5 Å²	116.5	74%	0.742	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-6.5	158.4	46.2	0	0	0	0	112.3	S701	S701-T703 VanDerWaalsContact C-N 3.29Å; S701-T703 PolarHBondContact O-N 3.19Å
704	K	34.7	Very low	35.1	Very low	185 Å²	185	121 Å²	121	80%	0.804	62%	0.62	S	S	*	*	S	Bend	trans	-111.6	-5.2	-174	-145.1	175.4	-178	-177.2	0	115.7
705	I	33.6	Very low	33.5	Very low	116 Å²	116	122.6 Å²	122.6	60%	0.595	64%	0.64	S	S	*	*	S	Bend	trans	-107.7	-9	-175.9	-59.4	173.5	0	0	0	112.7
706	V	34.9	Very low	32.3	Very low	95 Å²	95	122.7 Å²	122.7	58%	0.576	65%	0.645	S	S	*	*	S	Bend	trans	-87.5	-3.1	-173	-177.4	0	0	0	0	114
707	Y	34.1	Very low	31.6	Very low	204 Å²	204	131.8 Å²	131.8	80%	0.8	68%	0.676	S	S	*	*	S	Bend	trans	-107.8	-9.8	-177.2	-84.3	-80.9	0	0	0	116.2
708	D	29.7	Very low	31.2	Very low	111 Å²	111	133.6 Å²	133.6	59%	0.594	68%	0.681	S	S	*	*	S	Bend	trans	-108.6	7.1	-171.4	-83	-10.4	0	0	0	115.2
709	G	32.9	Very low	30.9	Very low	22 Å²	22	132.5 Å²	132.5	23%	0.227	69%	0.685	C	S	.	*	S	Bend	trans	-112.7	-1.8	-174.9	0	0	0	0	0	117.4
710	F	31.3	Very low	31.1	Very low	130 Å²	130	128.7 Å²	128.7	57%	0.57	67%	0.671	S	S	*	*			trans	-139.2	80.3	-175.6	-73	-83.7	0	0	0	112	P680	P680-F710 HydrophobicContact CG-CZ 4.4Å
711	T	30.3	Very low	30.9	Very low	118 Å²	118	126.6 Å²	126.6	72%	0.724	66%	0.664	S	S	*	*			trans	-131.9	86.2	162.4	-25.9	0	0	0	0	108.6
712	M	29.1	Very low	30.8	Very low	95 Å²	95	132.6 Å²	132.6	47%	0.468	67%	0.672	S	S	.	*			trans	-84.5	125.2	167.1	-94	-105.5	-66.7	0	0	109.1	P665 L666 I714 P804	P665-M712 HydrophobicContact CB-SD 4.13Å; P665-M712 HydrophobicContact CG-SD 3.74Å; L666-M712 HydrophobicContact CD2-CG 4.04Å; M712-I714 PolarHBondContact O-N 3.32Å; M712-P804 HydrophobicContact CE-CB 3.97Å; M712-P804 HydrophobicContact CG-CB 4.46Å; M712-P804 HydrophobicContact SD-CB 3.54Å; M712-P804 VanDerWaalsContact SD-CB 3.54Å; M712-P804 HydrophobicContact SD-CG 4.27Å
713	H	27.3	Very low	30.7	Very low	181 Å²	181	133.7 Å²	133.7	84%	0.838	67%	0.674	S	S	*	*			trans	-56	102.6	162.1	-96.2	-82.6	0	0	0	109.8
714	I	31.7	Very low	30.4	Very low	141 Å²	141	136.9 Å²	136.9	72%	0.723	67%	0.674	S	S	*	*			trans	-100.6	87.9	162.4	-59	178.4	0	0	0	107	M712	M712-I714 PolarHBondContact O-N 3.32Å
715	A	26.9	Very low	30.2	Very low	81 Å²	81	131.9 Å²	131.9	67%	0.669	66%	0.662	S	S	*	*			trans	-71.2	126.7	159.6	0	0	0	0	0	108.3
716	N	27.5	Very low	29.9	Very low	152 Å²	152	134.4 Å²	134.4	81%	0.813	67%	0.672	S	S	*	*	S	Bend	trans	62.1	84.8	167.2	-65.5	-31.5	0	0	0	117.4
717	R	31.9	Very low	29.5	Very low	244 Å²	244	135.8 Å²	135.8	92%	0.921	68%	0.682	S	S	*	*				-167.1	140.5	118.2	-104.2	170.2	-170.8	-156.2	3.8	112.4
718	K	28	Very low	29.3	Very low	202 Å²	202	132.6 Å²	132.6	88%	0.878	68%	0.684	S	S	*	*			trans	-54.4	161.5	-173.3	-64.8	168.4	173.6	-178	0	115.3
719	S	30.3	Very low	29.2	Very low	112 Å²	112	136.5 Å²	136.5	78%	0.783	70%	0.695	S	S	*	*			trans	86.6	106.4	155.8	79.1	0	0	0	0	119.4
720	S	32.9	Very low	29	Very low	79 Å²	79	140.3 Å²	140.3	55%	0.552	72%	0.719	S	S	*	*				67.6	138.3	123.9	-138.4	0	0	0	0	117.1	D748	S720-D748 VanDerWaalsContact C-OD2 3.24Å; S720-D748 VanDerWaalsContact CB-CG 3.47Å; S720-D748 WeakPolarHBondContact CB-OD2 3.12Å; S720-D748 WeakPolarHBondContact O-CB 3.09Å; S720-D748 PolarHBondContact OG-OD2 3.33Å
721	D	29.3	Very low	28.8	Very low	93 Å²	93	141.6 Å²	141.6	50%	0.497	73%	0.73	S	S	.	*			cis	-172.1	125.9	-27.5	-128.7	-22.3	0	0	0	104.5	D748	D721-D748 VanDerWaalsContact CB-OD2 3.31Å; D721-D748 WeakPolarHBondContact CB-OD2 3.28Å; D721-D748 VanDerWaalsContact N-CG 3.31Å; D721-D748 PolarHBondContact N-OD2 3.43Å; D721-D748 WeakPolarHBondContact O-CB 3.46Å
722	R	28	Very low	28.6	Very low	220 Å²	220	140.6 Å²	140.6	83%	0.83	73%	0.728	S	S	*	*			trans	-30.6	135.6	165.3	-63.8	164.2	178.2	-161.7	-0.6	115.8
723	L	27.8	Very low	28.5	Very low	105 Å²	105	142.7 Å²	142.7	55%	0.55	75%	0.746	S	S	.	*			trans	-165.7	107.9	147.1	-108.5	128.1	0	0	0	113	T749 V767	L723-T749 WeakPolarHBondContact CA-OG1 3.28Å; L723-T749 VanDerWaalsContact CB-OG1 3.31Å; L723-T749 WeakPolarHBondContact CB-OG1 3.02Å; L723-T749 PolarHBondContact N-OG1 2.89Å; L723-T749 WeakPolarHBondContact O-CB 3.17Å; L723-T749 PolarHBondContact O-OG1 2.9Å; L723-V767 WeakPolarHBondContact O-CG2 3.41Å
724	Y	27.2	Very low	28.6	Very low	188 Å²	188	142.4 Å²	142.4	74%	0.737	75%	0.749	S	S	*	*				38.1	142.3	127.7	-76.6	-91	0	0	0	120.9	V767	Y724-V767 VanDerWaalsContact C-CG2 3.44Å; Y724-V767 WeakPolarHBondContact O-CG2 3.24Å
725	S	29.2	Very low	28.4	Very low	80 Å²	80	143.1 Å²	143.1	56%	0.559	75%	0.754	S	S	*	*				-172.1	147.3	81.9	36.1	0	0	0	0	116.4	P765	S725-P765 PolarHBondContact OG-O 2.04Å
726	Q	28.7	Very low	28.9	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-64.9	160.2	159.5	-75.9	177.7	-22.3	0	0	111.7
727	P	25.4	Very low	29.9	Very low	123 Å²	123	138 Å²	138	80%	0.799	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-82.4	138.4	-168.2	32.1	-32	0	0	0	113.5
728	V	30.3	Very low	30.6	Very low	138 Å²	138	131 Å²	131	84%	0.836	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-75.7	118.9	169.1	178.3	0	0	0	0	109.4
729	K	28.1	Very low	31.8	Very low	192 Å²	192	128.8 Å²	128.8	84%	0.835	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-95.4	136.4	158	-86.7	-175	178	179.3	0	108.8
730	S	27	Very low	32.8	Very low	102 Å²	102	123.7 Å²	123.7	71%	0.713	67%	0.672	S	S	*	*			trans	60.6	103.7	170.1	63.5	0	0	0	0	117
731	I	27.5	Very low	33.8	Very low	157 Å²	157	129.6 Å²	129.6	81%	0.805	69%	0.688	S	S	*	*				-163.8	129	108	-93.3	150.8	0	0	0	108.3
732	S	25.7	Very low	35.4	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	70%	0.696	S	S	*	*			trans	-48.4	155.5	168.7	44.9	0	0	0	0	113
733	T	28.5	Very low	37	Very low	139 Å²	139	125.4 Å²	125.4	85%	0.853	67%	0.672	S	S	*	*			trans	89.7	104.5	178.4	70.2	0	0	0	0	115.8	D735	T733-D735 PolarHBondContact O-N 2.82Å
734	I	28.3	Very low	38.6	Very low	175 Å²	175	122.7 Å²	122.7	90%	0.897	67%	0.669	S	S	*	*			trans	-57.6	110.1	166.3	-62.9	151.3	0	0	0	108.7
735	D	28.7	Very low	40.5	Very low	157 Å²	157	116.7 Å²	116.7	84%	0.84	66%	0.658	S	S	*	*			trans	-167.2	154.5	141.7	-139.1	-19.2	0	0	0	112.1	T733	T733-D735 PolarHBondContact O-N 2.82Å
736	A	37	Very low	42.5	Very low	80 Å²	80	113.7 Å²	113.7	66%	0.661	64%	0.637	S	S	*	*			trans	75.2	83.3	165.9	0	0	0	0	0	119.5	V738	A736-V738 PolarHBondContact O-N 2.81Å
737	S	47.8	Very low	44.1	Very low	46 Å²	46	107.3 Å²	107.3	32%	0.322	62%	0.617	S	S	.	*			trans	-49.1	126	134.6	2.4	0	0	0	0	108.5	Q739 N776	S737-Q739 PolarHBondContact O-N 3.09Å; S737-N776 PolarHBondContact OG-O 2.83Å; S737-N776 VanDerWaalsContact OG-O 3.07Å
738	V	47.7	Very low	45.8	Very low	95 Å²	95	106 Å²	106	58%	0.576	60%	0.603	S	S	*	*			trans	-57.8	107.1	175	178.9	0	0	0	0	107.8	A736 A740 S762 C763	A736-V738 PolarHBondContact O-N 2.81Å; V738-A740 PolarHBondContact O-N 3.15Å; V738-S762 WeakPolarHBondContact O-CA 3.04Å; V738-C763 PolarHBondContact O-N 2.83Å
739	Q	52.5	Low	47.1	Very low	156 Å²	156	100.8 Å²	100.8	73%	0.729	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.5	113.3	178	-77.5	179.3	-13.2	0	0	108.8	S737 W761	S737-Q739 PolarHBondContact O-N 3.09Å; Q739-W761 CarbonylContact C-O 3.27Å; Q739-W761 WeakPolarHBondContact CA-O 3.4Å
740	A	51.5	Low	49.2	Very low	6 Å²	6	96.5 Å²	96.5	5%	0.05	55%	0.55	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.1	136.4	171.6	0	0	0	0	0	109.4	V738 W742 A745 W761	V738-A740 PolarHBondContact O-N 3.15Å; A740-W742 PolarHBondContact O-N 3.22Å; A740-A745 HydrophobicContact CB-CB 3.87Å; A740-W761 HydrophobicContact CB-CB 4.32Å; A740-W761 PolarHBondContact N-O 2.89Å; A740-W761 WeakPolarHBondContact O-CB 3.28Å; A740-W761 PolarHBondContact O-N 2.6Å; A740-W761 VanDerWaalsContact O-N 3.1Å; A740-W761 VanDerWaalsContact O-O 3.12Å
741	K	54.1	Low	51.1	Low	202 Å²	202	93 Å²	93	88%	0.878	53%	0.528	S	S	*	.	S	Bend	trans	-67.1	-21.6	172	-85.1	-177.3	175	178.2	0	113
742	W	62.3	Low	53.4	Low	177 Å²	177	87.1 Å²	87.1	67%	0.67	50%	0.5	S	S	*	.	S	Bend	trans	-164.8	157.7	-179.1	64.1	-63.8	0	0	0	109.5	A740 G744 A745	A740-W742 PolarHBondContact O-N 3.22Å; W742-G744 PolarHBondContact O-N 3.11Å; W742-A745 PolarHBondContact O-N 3.48Å
743	C	62.2	Low	55.9	Low	49 Å²	49	82.6 Å²	82.6	33%	0.331	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-60	-19.6	-173.9	-70.8	0	0	0	0	116.5	A745 C746 C752 W761	C743-A745 PolarHBondContact O-N 2.73Å; C743-C746 PolarHBondContact O-N 2.8Å; C743-C752 WeakPolarHBondContact CA-SG 3.35Å; C743-C752 HydrophobicContact CB-CB 3.7Å; C743-C752 WeakPolarHBondContact CB-SG 3.06Å; C743-C752 WeakPolarHBondContact SG-CB 3.37Å; C743-C752 CovalentContact SG-SG 2.04Å; C743-C752 PolarHBondContact SG-SG 2.91Å; C743-W761 VanDerWaalsContact SG-CD2 3.58Å; C743-W761 WeakPolarHBondContact SG-CZ3 3.05Å
744	G	61.5	Low	58	Low	47 Å²	47	77.1 Å²	77.1	49%	0.485	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-71.9	-2.1	179.8	0	0	0	0	0	115	W742	W742-G744 PolarHBondContact O-N 3.11Å
745	A	67.1	Low	59.9	Low	62 Å²	62	69.8 Å²	69.8	51%	0.512	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-87.8	-6.6	172.2	0	0	0	0	0	113.6	A740 W742 C743	A740-A745 HydrophobicContact CB-CB 3.87Å; W742-A745 PolarHBondContact O-N 3.48Å; C743-A745 PolarHBondContact O-N 2.73Å
746	C	70	Confident	61.6	Low	18 Å²	18	65.5 Å²	65.5	12%	0.122	38%	0.384	C	S	.	.	S	Bend	trans	-87.3	141.9	177	-56.9	0	0	0	0	110.9	C743 W750 C763	C743-C746 PolarHBondContact O-N 2.8Å; C746-W750 HydrophobicContact CB-CB 4.09Å; C746-C763 WeakPolarHBondContact CA-SG 3.44Å; C746-C763 HydrophobicContact CB-CB 3.85Å; C746-C763 WeakPolarHBondContact CB-SG 3.28Å; C746-C763 WeakPolarHBondContact SG-CA 3.37Å; C746-C763 WeakPolarHBondContact SG-CB 3.15Å; C746-C763 CovalentContact SG-SG 2.05Å; C746-C763 PolarHBondContact SG-SG 3.13Å
747	G	63.5	Low	63	Low	35 Å²	35	65.6 Å²	65.6	36%	0.361	38%	0.377	S	S	.	.			trans	-63.4	157.7	173.8	0	0	0	0	0	112	T749 W750	G747-T749 PolarHBondContact O-N 3.41Å; G747-W750 WeakPolarHBondContact O-CB 3.36Å; G747-W750 PolarHBondContact O-N 3.34Å
748	D	60.6	Low	63.6	Low	96 Å²	96	70 Å²	70	51%	0.513	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.4	-170.2	-45.9	-67.5	0	0	0	114.7	S720 D721	S720-D748 VanDerWaalsContact C-OD2 3.24Å; S720-D748 VanDerWaalsContact CB-CG 3.47Å; S720-D748 WeakPolarHBondContact CB-OD2 3.12Å; S720-D748 WeakPolarHBondContact O-CB 3.09Å; S720-D748 PolarHBondContact OG-OD2 3.33Å; D721-D748 VanDerWaalsContact CB-OD2 3.31Å; D721-D748 WeakPolarHBondContact CB-OD2 3.28Å; D721-D748 VanDerWaalsContact N-CG 3.31Å; D721-D748 PolarHBondContact N-OD2 3.43Å; D721-D748 WeakPolarHBondContact O-CB 3.46Å
749	T	58	Low	64.5	Low	28 Å²	28	72 Å²	72	17%	0.172	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	4.2	173.3	51.6	0	0	0	0	114.6	L723 G747	L723-T749 WeakPolarHBondContact CA-OG1 3.28Å; L723-T749 VanDerWaalsContact CB-OG1 3.31Å; L723-T749 WeakPolarHBondContact CB-OG1 3.02Å; L723-T749 PolarHBondContact N-OG1 2.89Å; L723-T749 WeakPolarHBondContact O-CB 3.17Å; L723-T749 PolarHBondContact O-OG1 2.9Å; G747-T749 PolarHBondContact O-N 3.41Å
750	W	70.8	Confident	65.2	Low	102 Å²	102	65.8 Å²	65.8	39%	0.386	37%	0.372	S	S	.	.	S	Bend	trans	-101.9	137	-178.7	-68.3	2.6	0	0	0	110.4	C746 G747 C763 C764	C746-W750 HydrophobicContact CB-CB 4.09Å; G747-W750 WeakPolarHBondContact O-CB 3.36Å; G747-W750 PolarHBondContact O-N 3.34Å; W750-C763 HydrophobicContact CD2-CB 4.36Å; W750-C763 HydrophobicContact CE3-CB 3.44Å; W750-C763 VanDerWaalsContact CE3-CB 3.44Å; W750-C763 HydrophobicContact CZ3-CB 3.98Å; W750-C764 WeakPolarHBondContact CA-O 3.27Å; W750-C764 WeakPolarHBondContact CB-O 2.99Å; W750-C764 VanDerWaalsContact CG-O 3.31Å
751	A	68.6	Low	66.3	Low	29 Å²	29	69.2 Å²	69.2	24%	0.24	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135.6	174.1	0	0	0	0	0	110.4	C764	A751-C764 HydrophobicContact CB-CB 3.78Å; A751-C764 PolarHBondContact N-O 2.74Å; A751-C764 WeakPolarHBondContact O-CB 3.4Å; A751-C764 PolarHBondContact O-N 3.5Å
752	C	76	Confident	67.4	Low	34 Å²	34	59.8 Å²	59.8	23%	0.23	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	114.5	176.4	-171.5	0	0	0	0	110.2	C743 W761	C743-C752 WeakPolarHBondContact CA-SG 3.35Å; C743-C752 HydrophobicContact CB-CB 3.7Å; C743-C752 WeakPolarHBondContact CB-SG 3.06Å; C743-C752 WeakPolarHBondContact SG-CB 3.37Å; C743-C752 CovalentContact SG-SG 2.04Å; C743-C752 PolarHBondContact SG-SG 2.91Å; C752-W761 HydrophobicContact CB-CE3 4.45Å
753	C	77.3	Confident	68.2	Low	2 Å²	2	52 Å²	52	1%	0.014	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116	-177	-58.3	0	0	0	0	110.9	W761 S762 C771	C753-W761 CarbonylContact O-C 3.52Å; C753-W761 WeakPolarHBondContact O-CA 3.3Å; C753-S762 WeakPolarHBondContact CB-OG 3.22Å; C753-S762 PolarHBondContact N-O 2.87Å; C753-S762 PolarHBondContact O-N 2.94Å; C753-S762 PolarHBondContact O-OG 3.09Å; C753-C771 WeakPolarHBondContact CA-SG 3.13Å; C753-C771 HydrophobicContact CB-CB 3.73Å; C753-C771 WeakPolarHBondContact CB-SG 3.26Å; C753-C771 WeakPolarHBondContact SG-CB 3.35Å; C753-C771 CovalentContact SG-SG 2.04Å; C753-C771 PolarHBondContact SG-SG 3.5Å
754	P	72	Confident	69	Low	24 Å²	24	49.7 Å²	49.7	16%	0.156	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	149.4	175.3	29.5	-33	0	0	0	111.3	F758 W761	P754-F758 HydrophobicContact CB-CD1 4.1Å; P754-F758 HydrophobicContact CB-CE1 4.42Å; P754-F758 HydrophobicContact CG-CD1 4.48Å; P754-F758 HydrophobicContact CG-CE1 4.33Å; P754-W761 HydrophobicContact CB-CD2 4.42Å; P754-W761 HydrophobicContact CB-CE3 3.8Å; P754-W761 HydrophobicContact CB-CH2 4.39Å; P754-W761 HydrophobicContact CB-CZ3 3.83Å; P754-W761 HydrophobicContact CG-CE3 4.45Å; P754-W761 HydrophobicContact CG-CZ3 4.17Å
755	D	68.4	Low	69.3	Low	21 Å²	21	50.4 Å²	50.4	11%	0.112	30%	0.296	C	S	.	.			trans	-72.5	174	169.7	81.3	-26.6	0	0	0	112.2	T757 F758 N759 S760 N776	D755-T757 VanDerWaalsContact CG-OG1 3.32Å; D755-T757 PolarHBondContact O-N 2.01Å; D755-T757 VanDerWaalsContact O-N 3.14Å; D755-T757 PolarHBondContact OD1-N 2.89Å; D755-T757 PolarHBondContact OD1-OG1 3.05Å; D755-T757 PolarHBondContact OD2-OG1 3.08Å; D755-F758 PolarHBondContact O-N 3.47Å; D755-F758 WeakPolarHBondContact OD1-CA 3.03Å; D755-F758 PolarHBondContact OD1-N 2.04Å; D755-N759 PolarHBondContact OD1-N 2.82Å; D755-S760 WeakPolarHBondContact CB-O 3.35Å; D755-S760 PolarHBondContact N-O 3.41Å; D755-S760 PolarHBondContact OD1-N 2.73Å; D755-N776 WeakPolarHBondContact CA-OD1 3.33Å; D755-N776 WeakPolarHBondContact CB-OD1 3.28Å; D755-N776 PolarHBondContact N-OD1 3.27Å
756	A	64.2	Low	69.6	Low	67 Å²	67	51.9 Å²	51.9	55%	0.554	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.5	178.7	0	0	0	0	0	113.8
757	T	66.4	Low	69.1	Low	81 Å²	81	54.3 Å²	54.3	50%	0.497	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-3.2	-177.1	73.1	0	0	0	0	113.6	D755 N759	D755-T757 VanDerWaalsContact CG-OG1 3.32Å; D755-T757 PolarHBondContact O-N 2.01Å; D755-T757 VanDerWaalsContact O-N 3.14Å; D755-T757 PolarHBondContact OD1-N 2.89Å; D755-T757 PolarHBondContact OD1-OG1 3.05Å; D755-T757 PolarHBondContact OD2-OG1 3.08Å; T757-N759 PolarHBondContact O-N 2.79Å; T757-N759 VanDerWaalsContact O-N 3.09Å; T757-N759 WeakPolarHBondContact OG1-CB 3.45Å; T757-N759 PolarHBondContact OG1-N 2.05Å; T757-N759 PolarHBondContact OG1-ND2 3.41Å
758	F	61.4	Low	69	Low	138 Å²	138	55.7 Å²	55.7	61%	0.605	32%	0.317	S	S	*	.	S	Bend	trans	54.8	14.1	-169.8	-64.6	-92	0	0	0	114.5	P754 D755	P754-F758 HydrophobicContact CB-CD1 4.1Å; P754-F758 HydrophobicContact CB-CE1 4.42Å; P754-F758 HydrophobicContact CG-CD1 4.48Å; P754-F758 HydrophobicContact CG-CE1 4.33Å; D755-F758 PolarHBondContact O-N 3.47Å; D755-F758 WeakPolarHBondContact OD1-CA 3.03Å; D755-F758 PolarHBondContact OD1-N 2.04Å
759	N	66.8	Low	69.2	Low	137 Å²	137	51.8 Å²	51.8	73%	0.733	30%	0.299	S	S	*	.	S	Bend	trans	-100.3	-12.7	-178.5	-65	-37.4	0	0	0	112.5	D755 T757	D755-N759 PolarHBondContact OD1-N 2.82Å; T757-N759 PolarHBondContact O-N 2.79Å; T757-N759 VanDerWaalsContact O-N 3.09Å; T757-N759 WeakPolarHBondContact OG1-CB 3.45Å; T757-N759 PolarHBondContact OG1-N 2.05Å; T757-N759 PolarHBondContact OG1-ND2 3.41Å
760	S	66.9	Low	69.8	Low	26 Å²	26	56.1 Å²	56.1	18%	0.182	32%	0.317	C	S	.	.			trans	-135.3	148.6	179.6	-168.5	0	0	0	0	110.3	D755	D755-S760 WeakPolarHBondContact CB-O 3.35Å; D755-S760 PolarHBondContact N-O 3.41Å; D755-S760 PolarHBondContact OD1-N 2.73Å
761	W	74.5	Confident	70.1	Confident	79 Å²	79	52.9 Å²	52.9	30%	0.299	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	155.9	-179.7	-58.9	82.3	0	0	0	109.8	Q739 A740 C743 C752 C753 P754	Q739-W761 CarbonylContact C-O 3.27Å; Q739-W761 WeakPolarHBondContact CA-O 3.4Å; A740-W761 HydrophobicContact CB-CB 4.32Å; A740-W761 PolarHBondContact N-O 2.89Å; A740-W761 WeakPolarHBondContact O-CB 3.28Å; A740-W761 PolarHBondContact O-N 2.6Å; A740-W761 VanDerWaalsContact O-N 3.1Å; A740-W761 VanDerWaalsContact O-O 3.12Å; C743-W761 VanDerWaalsContact SG-CD2 3.58Å; C743-W761 WeakPolarHBondContact SG-CZ3 3.05Å; C752-W761 HydrophobicContact CB-CE3 4.45Å; C753-W761 CarbonylContact O-C 3.52Å; C753-W761 WeakPolarHBondContact O-CA 3.3Å; P754-W761 HydrophobicContact CB-CD2 4.42Å; P754-W761 HydrophobicContact CB-CE3 3.8Å; P754-W761 HydrophobicContact CB-CH2 4.39Å; P754-W761 HydrophobicContact CB-CZ3 3.83Å; P754-W761 HydrophobicContact CG-CE3 4.45Å; P754-W761 HydrophobicContact CG-CZ3 4.17Å
762	S	76.4	Confident	70.4	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.028	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.6	176.9	52.6	0	0	0	0	110.9	V738 C753	V738-S762 WeakPolarHBondContact O-CA 3.04Å; C753-S762 WeakPolarHBondContact CB-OG 3.22Å; C753-S762 PolarHBondContact N-O 2.87Å; C753-S762 PolarHBondContact O-N 2.94Å; C753-S762 PolarHBondContact O-OG 3.09Å
763	C	79.9	Confident	69.8	Low	13 Å²	13	57.2 Å²	57.2	9%	0.088	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127	178.8	-56.7	0	0	0	0	112	V738 C746 W750	V738-C763 PolarHBondContact O-N 2.83Å; C746-C763 WeakPolarHBondContact CA-SG 3.44Å; C746-C763 HydrophobicContact CB-CB 3.85Å; C746-C763 WeakPolarHBondContact CB-SG 3.28Å; C746-C763 WeakPolarHBondContact SG-CA 3.37Å; C746-C763 WeakPolarHBondContact SG-CB 3.15Å; C746-C763 CovalentContact SG-SG 2.05Å; C746-C763 PolarHBondContact SG-SG 3.13Å; W750-C763 HydrophobicContact CD2-CB 4.36Å; W750-C763 HydrophobicContact CE3-CB 3.44Å; W750-C763 VanDerWaalsContact CE3-CB 3.44Å; W750-C763 HydrophobicContact CZ3-CB 3.98Å
764	C	78.5	Confident	69	Low	1 Å²	1	58.8 Å²	58.8	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	122.3	174.4	175.8	0	0	0	0	111.5	W750 A751 Y766 C778	W750-C764 WeakPolarHBondContact CA-O 3.27Å; W750-C764 WeakPolarHBondContact CB-O 2.99Å; W750-C764 VanDerWaalsContact CG-O 3.31Å; A751-C764 HydrophobicContact CB-CB 3.78Å; A751-C764 PolarHBondContact N-O 2.74Å; A751-C764 WeakPolarHBondContact O-CB 3.4Å; A751-C764 PolarHBondContact O-N 3.5Å; C764-Y766 VanDerWaalsContact C-N 3.27Å; C764-Y766 PolarHBondContact O-N 2.98Å; C764-Y766 PolarHBondContact SG-N 2.9Å; C764-C778 HydrophobicContact CB-CB 3.45Å; C764-C778 VanDerWaalsContact CB-CB 3.45Å; C764-C778 WeakPolarHBondContact CB-SG 2.97Å; C764-C778 WeakPolarHBondContact SG-CB 3.04Å; C764-C778 CovalentContact SG-SG 1.99Å; C764-C778 PolarHBondContact SG-SG 2.76Å
765	P	68.9	Low	68.6	Low	61 Å²	61	61.1 Å²	61.1	40%	0.396	35%	0.351	S	S	.	.			trans	-77.3	-6.6	-176.1	31.3	-36.1	0	0	0	114.5	S725	S725-P765 PolarHBondContact OG-O 2.04Å
766	Y	71.4	Confident	68.3	Low	94 Å²	94	62.6 Å²	62.6	37%	0.369	36%	0.359	S	S	.	.	S	Bend	trans	-90.5	122.2	-178.1	-54.8	-66.7	0	0	0	111.5	C764 G768 G769 C778 P780	C764-Y766 VanDerWaalsContact C-N 3.27Å; C764-Y766 PolarHBondContact O-N 2.98Å; C764-Y766 PolarHBondContact SG-N 2.9Å; Y766-G768 PolarHBondContact O-N 3.29Å; Y766-G769 PolarHBondContact O-N 3.19Å; Y766-C778 HydrophobicContact CD2-CB 4.4Å; Y766-C778 WeakPolarHBondContact CE2-O 3.05Å; Y766-P780 HydrophobicContact CD1-CB 3.77Å; Y766-P780 HydrophobicContact CD2-CB 4.22Å; Y766-P780 HydrophobicContact CE1-CB 3.85Å; Y766-P780 HydrophobicContact CE1-CG 4.39Å; Y766-P780 HydrophobicContact CE2-CB 4.32Å; Y766-P780 HydrophobicContact CE2-CG 4.49Å; Y766-P780 HydrophobicContact CG-CB 3.96Å
767	V	59.8	Low	68.7	Low	69 Å²	69	62.2 Å²	62.2	42%	0.418	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	108	172.2	-172.4	0	0	0	0	109.4	L723 Y724 P781	L723-V767 WeakPolarHBondContact O-CG2 3.41Å; Y724-V767 VanDerWaalsContact C-CG2 3.44Å; Y724-V767 WeakPolarHBondContact O-CG2 3.24Å; V767-P781 WeakPolarHBondContact O-CG 3.18Å
768	G	61.2	Low	69.3	Low	64 Å²	64	59.4 Å²	59.4	66%	0.66	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	22.8	-172.5	0	0	0	0	0	114.4	Y766	Y766-G768 PolarHBondContact O-N 3.29Å
769	G	66.1	Low	70.3	Confident	13 Å²	13	52.9 Å²	52.9	13%	0.134	30%	0.302	C	S	.	.			trans	-69.6	156.8	173.1	0	0	0	0	0	113.6	Y766 C779	Y766-G769 PolarHBondContact O-N 3.19Å; G769-C779 CarbonylContact C-O 3.54Å; G769-C779 WeakPolarHBondContact CA-O 3.31Å
770	E	71	Confident	70.5	Confident	120 Å²	120	48.1 Å²	48.1	56%	0.561	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.6	-177.7	-161.2	172.3	-169.7	0	0	110	C779	E770-C779 PolarHBondContact N-O 3.09Å; E770-C779 PolarHBondContact O-N 3.03Å
771	C	75.4	Confident	70.3	Confident	34 Å²	34	50.5 Å²	50.5	23%	0.23	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	129.2	-179.7	-67.3	0	0	0	0	111.6	C753 I773	C753-C771 WeakPolarHBondContact CA-SG 3.13Å; C753-C771 HydrophobicContact CB-CB 3.73Å; C753-C771 WeakPolarHBondContact CB-SG 3.26Å; C753-C771 WeakPolarHBondContact SG-CB 3.35Å; C753-C771 CovalentContact SG-SG 2.04Å; C753-C771 PolarHBondContact SG-SG 3.5Å; C771-I773 PolarHBondContact O-N 2.62Å; C771-I773 VanDerWaalsContact O-N 3.15Å
772	C	75.2	Confident	69.8	Low	5 Å²	5	49 Å²	49	3%	0.034	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	103.1	169.5	-61.4	0	0	0	0	109.8	G774 Q775 I777 C785	C772-G774 PolarHBondContact O-N 3.33Å; C772-G774 VanDerWaalsContact O-N 3.11Å; C772-Q775 HydrophobicContact CB-CB 4.09Å; C772-Q775 PolarHBondContact O-N 2.9Å; C772-Q775 VanDerWaalsContact O-N 3.17Å; C772-I777 HydrophobicContact CB-CB 4.08Å; C772-I777 HydrophobicContact CB-CG2 4.48Å; C772-I777 WeakPolarHBondContact CB-O 3.3Å; C772-I777 PolarHBondContact N-O 3.33Å; C772-I777 PolarHBondContact SG-O 3.33Å; C772-I777 VanDerWaalsContact SG-O 3.36Å; C772-C785 HydrophobicContact CB-CB 3.96Å; C772-C785 WeakPolarHBondContact CB-SG 3.45Å; C772-C785 WeakPolarHBondContact SG-CB 3.37Å; C772-C785 CovalentContact SG-SG 2.01Å; C772-C785 PolarHBondContact SG-SG 2.82Å
773	I	63.4	Low	69.5	Low	148 Å²	148	49.2 Å²	49.2	76%	0.759	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	119.2	177.9	-56.8	175.2	0	0	0	109.2	C771	C771-I773 PolarHBondContact O-N 2.62Å; C771-I773 VanDerWaalsContact O-N 3.15Å
774	G	62	Low	69.1	Low	35 Å²	35	55 Å²	55	36%	0.361	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	8.2	176.5	0	0	0	0	0	116.3	C772	C772-G774 PolarHBondContact O-N 3.33Å; C772-G774 VanDerWaalsContact O-N 3.11Å
775	Q	61.9	Low	68.7	Low	73 Å²	73	57.1 Å²	57.1	34%	0.341	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	8	-175.6	-62	-167.9	-21.9	0	0	115.9	C772 I777 N787	C772-Q775 HydrophobicContact CB-CB 4.09Å; C772-Q775 PolarHBondContact O-N 2.9Å; C772-Q775 VanDerWaalsContact O-N 3.17Å; Q775-I777 HydrophobicContact CB-CD1 4.19Å; Q775-I777 WeakPolarHBondContact O-CD1 3.26Å; Q775-I777 WeakPolarHBondContact O-CG1 3.31Å; Q775-I777 PolarHBondContact O-N 2.84Å; Q775-N787 PolarHBondContact NE2-O 2.03Å
776	N	63.2	Low	68.9	Low	52 Å²	52	57 Å²	57	28%	0.278	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	21.2	-179.7	-87.7	-13.5	0	0	0	114.8	S737 D755	S737-N776 PolarHBondContact OG-O 2.83Å; S737-N776 VanDerWaalsContact OG-O 3.07Å; D755-N776 WeakPolarHBondContact CA-OD1 3.33Å; D755-N776 WeakPolarHBondContact CB-OD1 3.28Å; D755-N776 PolarHBondContact N-OD1 3.27Å
777	I	71.8	Confident	68.5	Low	60 Å²	60	58.9 Å²	58.9	31%	0.308	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.2	-173.1	-72	161.3	0	0	0	108.5	C772 Q775 G789	C772-I777 HydrophobicContact CB-CB 4.08Å; C772-I777 HydrophobicContact CB-CG2 4.48Å; C772-I777 WeakPolarHBondContact CB-O 3.3Å; C772-I777 PolarHBondContact N-O 3.33Å; C772-I777 PolarHBondContact SG-O 3.33Å; C772-I777 VanDerWaalsContact SG-O 3.36Å; Q775-I777 HydrophobicContact CB-CD1 4.19Å; Q775-I777 WeakPolarHBondContact O-CD1 3.26Å; Q775-I777 WeakPolarHBondContact O-CG1 3.31Å; Q775-I777 PolarHBondContact O-N 2.84Å; I777-G789 WeakPolarHBondContact CG2-O 3.41Å
778	C	79.4	Confident	68.9	Low	22 Å²	22	60.4 Å²	60.4	15%	0.149	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.4	174.4	-168.1	0	0	0	0	111.7	C764 Y766	C764-C778 HydrophobicContact CB-CB 3.45Å; C764-C778 VanDerWaalsContact CB-CB 3.45Å; C764-C778 WeakPolarHBondContact CB-SG 2.97Å; C764-C778 WeakPolarHBondContact SG-CB 3.04Å; C764-C778 CovalentContact SG-SG 1.99Å; C764-C778 PolarHBondContact SG-SG 2.76Å; Y766-C778 HydrophobicContact CD2-CB 4.4Å; Y766-C778 WeakPolarHBondContact CE2-O 3.05Å
779	C	82.5	Confident	68.9	Low	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.9	177.7	-70	0	0	0	0	113.3	G769 E770 C791	G769-C779 CarbonylContact C-O 3.54Å; G769-C779 WeakPolarHBondContact CA-O 3.31Å; E770-C779 PolarHBondContact N-O 3.09Å; E770-C779 PolarHBondContact O-N 3.03Å; C779-C791 WeakPolarHBondContact CA-SG 3.08Å; C779-C791 HydrophobicContact CB-CB 3.74Å; C779-C791 WeakPolarHBondContact CB-SG 3.15Å; C779-C791 VanDerWaalsContact SG-CA 3.53Å; C779-C791 WeakPolarHBondContact SG-CB 3.47Å; C779-C791 CovalentContact SG-SG 2.04Å; C779-C791 PolarHBondContact SG-SG 2.86Å
780	P	72.1	Confident	69.3	Low	37 Å²	37	64.1 Å²	64.1	24%	0.24	36%	0.355	C	S	.	.			trans	-68.5	155.2	178	24.3	-29.4	0	0	0	112.2	Y766 G782 S783	Y766-P780 HydrophobicContact CD1-CB 3.77Å; Y766-P780 HydrophobicContact CD2-CB 4.22Å; Y766-P780 HydrophobicContact CE1-CB 3.85Å; Y766-P780 HydrophobicContact CE1-CG 4.39Å; Y766-P780 HydrophobicContact CE2-CB 4.32Å; Y766-P780 HydrophobicContact CE2-CG 4.49Å; Y766-P780 HydrophobicContact CG-CB 3.96Å; P780-G782 PolarHBondContact O-N 3Å; P780-S783 VanDerWaalsContact O-CB 3.22Å; P780-S783 WeakPolarHBondContact O-CB 3.41Å; P780-S783 PolarHBondContact O-N 2.84Å; P780-S783 PolarHBondContact O-OG 2.95Å
781	P	62.5	Low	69.5	Low	77 Å²	77	60.9 Å²	60.9	50%	0.5	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	134.9	177.4	-25.4	27.6	0	0	0	112.4	V767 S783	V767-P781 WeakPolarHBondContact O-CG 3.18Å; P781-S783 VanDerWaalsContact C-N 3.32Å
782	G	62.3	Low	69.5	Low	46 Å²	46	63 Å²	63	47%	0.474	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	23.7	-176.9	0	0	0	0	0	113.7	P780 K793 I794	P780-G782 PolarHBondContact O-N 3Å; G782-K793 CarbonylContact O-C 3.51Å; G782-I794 PolarHBondContact O-N 2.85Å
783	S	70.3	Confident	69	Low	10 Å²	10	71.1 Å²	71.1	7%	0.07	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.6	171.4	-50.1	0	0	0	0	110.9	P780 P781 E792	P780-S783 VanDerWaalsContact O-CB 3.22Å; P780-S783 WeakPolarHBondContact O-CB 3.41Å; P780-S783 PolarHBondContact O-N 2.84Å; P780-S783 PolarHBondContact O-OG 2.95Å; P781-S783 VanDerWaalsContact C-N 3.32Å; S783-E792 CarbonylContact C-O 3.55Å; S783-E792 WeakPolarHBondContact CA-O 3.12Å; S783-E792 WeakPolarHBondContact CB-O 3.49Å
784	R	71.3	Confident	68.8	Low	134 Å²	134	68.4 Å²	68.4	51%	0.506	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	149.3	173.7	66.5	176.6	-178.5	-172.7	-2	111.6	C791 E792 I794	R784-C791 WeakPolarHBondContact O-CA 3.37Å; R784-E792 HydrophobicContact CG-CB 4.07Å; R784-E792 IonicContact CZ-OE2 3.31Å; R784-E792 PolarHBondContact N-O 3.36Å; R784-E792 IonicContact NE-OE2 3.62Å; R784-E792 PolarHBondContact NE-OE2 2.91Å; R784-E792 IonicContact NH2-OE1 2.62Å; R784-E792 PolarHBondContact NH2-OE1 2.82Å; R784-E792 IonicContact NH2-OE2 2.7Å; R784-E792 PolarHBondContact NH2-OE2 2.66Å; R784-E792 PolarHBondContact O-N 2.01Å; R784-I794 HydrophobicContact CB-CD1 4.19Å; R784-I794 HydrophobicContact CB-CG1 4.38Å
785	C	70.6	Confident	67.9	Low	45 Å²	45	72.1 Å²	72.1	30%	0.304	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.6	173.7	-167.6	0	0	0	0	112.2	C772	C772-C785 HydrophobicContact CB-CB 3.96Å; C772-C785 WeakPolarHBondContact CB-SG 3.45Å; C772-C785 WeakPolarHBondContact SG-CB 3.37Å; C772-C785 CovalentContact SG-SG 2.01Å; C772-C785 PolarHBondContact SG-SG 2.82Å
786	L	73.5	Confident	67.2	Low	58 Å²	58	76.9 Å²	76.9	30%	0.304	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-90.1	153.2	171.9	-64.9	172.7	0	0	0	110.1	N788 G789 K790 E792	L786-N788 WeakPolarHBondContact CB-OD1 3.25Å; L786-N788 PolarHBondContact O-N 3.09Å; L786-G789 PolarHBondContact O-N 3.29Å; L786-K790 HydrophobicContact CB-CB 4.43Å; L786-K790 VanDerWaalsContact CB-O 3.28Å; L786-K790 WeakPolarHBondContact CB-O 3.36Å; L786-K790 HydrophobicContact CD1-CB 4.02Å; L786-K790 PolarHBondContact N-O 3.38Å; L786-E792 HydrophobicContact CD1-CB 4.15Å; L786-E792 HydrophobicContact CG-CB 4.27Å
787	N	63.7	Low	66.1	Low	134 Å²	134	79 Å²	79	72%	0.717	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-8	-179.4	-60.5	-34	0	0	0	114.4	Q775	Q775-N787 PolarHBondContact NE2-O 2.03Å
788	N	66.9	Low	64.8	Low	102 Å²	102	81.4 Å²	81.4	55%	0.545	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	15.5	179.1	63.7	-2.5	0	0	0	113.1	L786 K790	L786-N788 WeakPolarHBondContact CB-OD1 3.25Å; L786-N788 PolarHBondContact O-N 3.09Å; N788-K790 VanDerWaalsContact C-N 3.25Å; N788-K790 PolarHBondContact O-N 3.5Å; N788-K790 VanDerWaalsContact OD1-CB 3.28Å; N788-K790 WeakPolarHBondContact OD1-CB 3.48Å; N788-K790 PolarHBondContact OD1-N 1.99Å; N788-K790 VanDerWaalsContact OD1-N 3.09Å
789	G	62.8	Low	63.2	Low	17 Å²	17	85.4 Å²	85.4	18%	0.175	45%	0.453	C	S	.	.	S	Bend	trans	72.4	12.2	-177.6	0	0	0	0	0	115	I777 L786	I777-G789 WeakPolarHBondContact CG2-O 3.41Å; L786-G789 PolarHBondContact O-N 3.29Å
790	K	73.6	Confident	61.8	Low	138 Å²	138	91.4 Å²	91.4	60%	0.6	48%	0.48	S	S	*	.			trans	-94.7	146.3	174.9	-67.8	-174.4	179.3	179.4	0	111.6	L786 N788	L786-K790 HydrophobicContact CB-CB 4.43Å; L786-K790 VanDerWaalsContact CB-O 3.28Å; L786-K790 WeakPolarHBondContact CB-O 3.36Å; L786-K790 HydrophobicContact CD1-CB 4.02Å; L786-K790 PolarHBondContact N-O 3.38Å; N788-K790 VanDerWaalsContact C-N 3.25Å; N788-K790 PolarHBondContact O-N 3.5Å; N788-K790 VanDerWaalsContact OD1-CB 3.28Å; N788-K790 WeakPolarHBondContact OD1-CB 3.48Å; N788-K790 PolarHBondContact OD1-N 1.99Å; N788-K790 VanDerWaalsContact OD1-N 3.09Å
791	C	76.1	Confident	60.8	Low	51 Å²	51	90.9 Å²	90.9	35%	0.345	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.2	174.8	-56.9	0	0	0	0	111	C779 R784	C779-C791 WeakPolarHBondContact CA-SG 3.08Å; C779-C791 HydrophobicContact CB-CB 3.74Å; C779-C791 WeakPolarHBondContact CB-SG 3.15Å; C779-C791 VanDerWaalsContact SG-CA 3.53Å; C779-C791 WeakPolarHBondContact SG-CB 3.47Å; C779-C791 CovalentContact SG-SG 2.04Å; C779-C791 PolarHBondContact SG-SG 2.86Å; R784-C791 WeakPolarHBondContact O-CA 3.37Å
792	E	75.4	Confident	60.6	Low	80 Å²	80	95.2 Å²	95.2	37%	0.374	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.4	179.9	-174.2	-174	-169.2	0	0	110.9	S783 R784 L786	S783-E792 CarbonylContact C-O 3.55Å; S783-E792 WeakPolarHBondContact CA-O 3.12Å; S783-E792 WeakPolarHBondContact CB-O 3.49Å; R784-E792 HydrophobicContact CG-CB 4.07Å; R784-E792 IonicContact CZ-OE2 3.31Å; R784-E792 PolarHBondContact N-O 3.36Å; R784-E792 IonicContact NE-OE2 3.62Å; R784-E792 PolarHBondContact NE-OE2 2.91Å; R784-E792 IonicContact NH2-OE1 2.62Å; R784-E792 PolarHBondContact NH2-OE1 2.82Å; R784-E792 IonicContact NH2-OE2 2.7Å; R784-E792 PolarHBondContact NH2-OE2 2.66Å; R784-E792 PolarHBondContact O-N 2.01Å; L786-E792 HydrophobicContact CD1-CB 4.15Å; L786-E792 HydrophobicContact CG-CB 4.27Å
793	K	63.7	Low	60.3	Low	174 Å²	174	93.6 Å²	93.6	76%	0.757	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.9	-177	-158.5	177.9	-175.3	-179	0	111.9	G782	G782-K793 CarbonylContact O-C 3.51Å
794	I	59.5	Low	60	Low	92 Å²	92	94 Å²	94	47%	0.472	47%	0.472	S	S	.	.			trans	-88.9	115	178	-52.3	173.2	0	0	0	109.1	G782 R784	G782-I794 PolarHBondContact O-N 2.85Å; R784-I794 HydrophobicContact CB-CD1 4.19Å; R784-I794 HydrophobicContact CB-CG1 4.38Å
795	S	42.3	Very low	60.1	Low	112 Å²	112	91.9 Å²	91.9	78%	0.783	48%	0.475	S	S	*	.			trans	-94.9	78.7	172.7	-72.9	0	0	0	0	111.8
796	K	46.8	Very low	60	Low	173 Å²	173	90.2 Å²	90.2	75%	0.752	46%	0.463	S	S	*	.			trans	-154.5	125	163.7	-69	-163.6	178.5	178.4	0	112.7	I798	K796-I798 PolarHBondContact O-N 2.84Å
797	N	41.5	Very low	59.9	Low	96 Å²	96	91.4 Å²	91.4	51%	0.513	47%	0.468	S	S	.	.			trans	-84.5	85.4	-176.7	-78.8	-17.2	0	0	0	113.7	L696 L698	L696-N797 HydrophobicContact CB-CB 4.12Å; L696-N797 HydrophobicContact CD1-CB 4.07Å; L698-N797 VanDerWaalsContact CD1-ND2 3.26Å; L698-N797 WeakPolarHBondContact CD1-ND2 3.43Å
798	I	44.2	Very low	60	Low	111 Å²	111	89.8 Å²	89.8	57%	0.569	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	114.8	164.8	-58.3	175.9	0	0	0	107.7	I693 K796 K800	I693-I798 HydrophobicContact CG2-CG2 3.92Å; K796-I798 PolarHBondContact O-N 2.84Å; I798-K800 HydrophobicContact CG2-CG 4.35Å
799	M	46.1	Very low	59.4	Low	106 Å²	106	86.2 Å²	86.2	52%	0.522	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.9	172.3	-71.5	-177.7	80.6	0	0	109.4	L694	L694-M799 HydrophobicContact CB-CB 4.29Å; L694-M799 PolarHBondContact N-O 3.05Å
800	K	51.7	Low	59	Low	126 Å²	126	91.2 Å²	91.2	55%	0.548	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.2	173.7	-61.8	-176.4	171.8	-162.5	0	108.6	C692 I798	C692-K800 WeakPolarHBondContact O-CA 2.99Å; I798-K800 HydrophobicContact CG2-CG 4.35Å
801	S	51.2	Low	57.7	Low	26 Å²	26	88.2 Å²	88.2	18%	0.182	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	155	173	61.9	0	0	0	0	110.5	Q691 C692	Q691-S801 CarbonylContact C-O 3.3Å; Q691-S801 VanDerWaalsContact CA-O 3.25Å; Q691-S801 WeakPolarHBondContact CA-O 3.13Å; C692-S801 WeakPolarHBondContact CB-OG 3.19Å; C692-S801 PolarHBondContact N-O 2.91Å; C692-S801 PolarHBondContact O-N 2.78Å
802	F	58.9	Low	56.3	Low	169 Å²	169	91.4 Å²	91.4	74%	0.741	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	141.2	170	-76.2	-82.7	0	0	0	110.3	P804	F802-P804 VanDerWaalsContact O-CD 3.28Å; F802-P804 WeakPolarHBondContact O-CD 3.18Å
803	A	55.5	Low	54.4	Low	12 Å²	12	94.4 Å²	94.4	10%	0.099	49%	0.493	C	S	.	.			trans	-80.9	115	174.1	0	0	0	0	0	109.5	H677 K690 C692	H677-A803 HydrophobicContact CB-CB 3.65Å; H677-A803 PolarHBondContact CD2-O 2.81Å; K690-A803 PolarHBondContact O-N 2.85Å; C692-A803 VanDerWaalsContact SG-CA 3.5Å; C692-A803 VanDerWaalsContact SG-CB 3.55Å
804	P	65.2	Low	52.8	Low	17 Å²	17	92.9 Å²	92.9	11%	0.11	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-64.3	149.6	175.8	24	-35.2	0	0	0	112.6	P665 L666 H677 C678 M712 F802	P665-P804 HydrophobicContact CG-CB 4.16Å; P665-P804 HydrophobicContact CG-CG 4.39Å; L666-P804 HydrophobicContact CD1-CG 3.52Å; L666-P804 HydrophobicContact CD2-CG 4.11Å; L666-P804 HydrophobicContact CG-CG 3.71Å; H677-P804 CarbonylContact C-O 3.43Å; H677-P804 VanDerWaalsContact CA-O 3.24Å; H677-P804 WeakPolarHBondContact CA-O 2.95Å; C678-P804 PolarHBondContact N-O 3.12Å; C678-P804 WeakPolarHBondContact O-CD 2.96Å; M712-P804 HydrophobicContact CE-CB 3.97Å; M712-P804 HydrophobicContact CG-CB 4.46Å; M712-P804 HydrophobicContact SD-CB 3.54Å; M712-P804 VanDerWaalsContact SD-CB 3.54Å; M712-P804 HydrophobicContact SD-CG 4.27Å; F802-P804 VanDerWaalsContact O-CD 3.28Å; F802-P804 WeakPolarHBondContact O-CD 3.18Å
805	T	72.5	Confident	51.3	Low	90 Å²	90	96.2 Å²	96.2	55%	0.552	51%	0.512	S	S	*	.	B	Isolated β-bridge	trans	-71.2	143.9	174.7	-43.2	0	0	0	0	111	F676	F676-T805 CarbonylContact O-C 3.59Å; F676-T805 WeakPolarHBondContact O-CA 3.49Å; F676-T805 WeakPolarHBondContact O-CG2 3.13Å
806	L	69.7	Low	50.6	Low	11 Å²	11	99.1 Å²	99.1	6%	0.058	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-62.7	141.6	172.6	-63.6	174.9	0	0	0	111.7	C654 L656 C664 H675 F676 C678	C654-L806 HydrophobicContact CB-CD1 3.5Å; C654-L806 HydrophobicContact CB-CD2 3.45Å; C654-L806 VanDerWaalsContact CB-CD2 3.45Å; C654-L806 HydrophobicContact CB-CG 4.12Å; C654-L806 VanDerWaalsContact SG-CD2 3.6Å; L656-L806 HydrophobicContact CD2-CB 4.3Å; L656-L806 HydrophobicContact CD2-CD1 4.23Å; C664-L806 HydrophobicContact CB-CD2 4.24Å; H675-L806 WeakPolarHBondContact O-CD1 3.14Å; F676-L806 WeakPolarHBondContact O-CG 2.96Å; F676-L806 PolarHBondContact O-N 3.4Å; C678-L806 HydrophobicContact CB-CD2 3.86Å
807	I	71.2	Confident	49.8	Very low	82 Å²	82	100.2 Å²	100.2	42%	0.421	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.5	172.7	-57.3	177	0	0	0	108.2	G662 C663 P665 S809	G662-I807 CarbonylContact C-O 3.49Å; G662-I807 WeakPolarHBondContact CA-O 3.48Å; C663-I807 PolarHBondContact N-O 3.49Å; C663-I807 PolarHBondContact O-N 3.3Å; P665-I807 HydrophobicContact CB-CD1 3.85Å; P665-I807 HydrophobicContact CB-CG1 4.49Å; P665-I807 HydrophobicContact CG-CD1 4.4Å; I807-S809 PolarHBondContact O-N 3.33Å
808	P	64.9	Low	48.9	Very low	101 Å²	101	104.9 Å²	104.9	66%	0.656	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.6	134.6	172.3	-23.6	33.4	0	0	0	111.5
809	S	55.1	Low	48	Very low	27 Å²	27	104.1 Å²	104.1	19%	0.189	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-73	158.8	179.9	59.4	0	0	0	0	112.9	S645 W661 I807 S811	S645-S809 VanDerWaalsContact CB-CB 3.47Å; S645-S809 WeakPolarHBondContact CB-OG 3.42Å; W661-S809 VanDerWaalsContact O-CB 3.22Å; W661-S809 WeakPolarHBondContact O-CB 3.41Å; W661-S809 PolarHBondContact O-N 2.73Å; W661-S809 PolarHBondContact O-OG 2.9Å; I807-S809 PolarHBondContact O-N 3.33Å; S809-S811 PolarHBondContact O-N 2.58Å
810	I	54.4	Low	47.1	Very low	122 Å²	122	109.7 Å²	109.7	63%	0.626	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.9	117.4	177.8	-57.1	172.2	0	0	0	108.8
811	S	46.2	Very low	45.7	Very low	74 Å²	74	111.9 Å²	111.9	52%	0.517	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.3	133.8	175.8	176.9	0	0	0	0	111.4	Q644 S809 N813	Q644-S811 WeakPolarHBondContact O-CA 3.32Å; S809-S811 PolarHBondContact O-N 2.58Å; S811-N813 PolarHBondContact O-N 3.15Å; S811-N813 PolarHBondContact OG-N 2.91Å
812	K	45.6	Very low	44.5	Very low	119 Å²	119	117.4 Å²	117.4	52%	0.517	60%	0.598	S	S	.	*	S	Bend	trans	-69.4	-7.7	174.2	-77.5	-174.5	176.4	177.4	0	114.4	Q644	Q644-K812 PolarHBondContact O-N 2.88Å; Q644-K812 VanDerWaalsContact O-N 3.15Å
813	N	36.8	Very low	42.9	Very low	142 Å²	142	116.1 Å²	116.1	76%	0.759	60%	0.595	S	S	*	*			trans	-102.8	102	178.4	-81	-13.5	0	0	0	111.7	S811 N815	S811-N813 PolarHBondContact O-N 3.15Å; S811-N813 PolarHBondContact OG-N 2.91Å; N813-N815 PolarHBondContact O-N 2.6Å
814	N	29	Very low	41.7	Very low	142 Å²	142	124.2 Å²	124.2	76%	0.759	63%	0.63	S	S	*	*			trans	-70.1	104.9	163.4	-86.5	-45.3	0	0	0	109.7
815	N	28.5	Very low	39.8	Very low	163 Å²	163	129.5 Å²	129.5	87%	0.872	66%	0.657	S	S	*	*			trans	-153.4	136.1	142.7	-97.1	-31.4	0	0	0	109.5	N813 Q817	N813-N815 PolarHBondContact O-N 2.6Å; N815-Q817 PolarHBondContact O-N 3.46Å
816	L	28.7	Very low	37.5	Very low	172 Å²	172	132.9 Å²	132.9	90%	0.901	67%	0.672	S	S	*	*			trans	-25.5	121.7	172.3	-110.9	69.9	0	0	0	114.7
817	Q	29.2	Very low	35.5	Very low	196 Å²	196	138 Å²	138	92%	0.916	70%	0.704	S	S	*	*			trans	-149.5	111.3	138	-119.4	176.8	-10	0	0	111.2	N815	N815-Q817 PolarHBondContact O-N 3.46Å
818	K	23.4	Very low	33.3	Very low	194 Å²	194	143.8 Å²	143.8	84%	0.843	73%	0.726	S	S	*	*			trans	-56.9	150.2	164.9	-93.9	171.5	168.9	174.5	0	110.6
819	S	24.4	Very low	31.5	Very low	95 Å²	95	147.4 Å²	147.4	66%	0.664	73%	0.734	S	S	*	*			trans	62.5	123	149.2	66.3	0	0	0	0	119
820	Y	27	Very low	30	Very low	223 Å²	223	153.3 Å²	153.3	88%	0.875	76%	0.764	S	S	*	*				-149	111.3	107.1	-114.3	-87	0	0	0	109.7
821	F	23	Very low	28.7	Very low	172 Å²	172	156.8 Å²	156.8	75%	0.754	77%	0.774	S	S	*	*			trans	-59.4	133.7	159.3	-95.5	-102.5	0	0	0	108.3	Q823	F821-Q823 HydrophobicContact CD1-CG 4.15Å
822	I	26.4	Very low	27.6	Very low	143 Å²	143	161 Å²	161	73%	0.733	79%	0.786	S	S	*	*			trans	-110.6	89.6	149.7	-60.1	-176.3	0	0	0	106.3	Q824	I822-Q824 HydrophobicContact CG2-CG 3.84Å; I822-Q824 PolarHBondContact O-N 2.81Å
823	Q	25.1	Very low	26.7	Very low	142 Å²	142	163 Å²	163	66%	0.664	80%	0.8	S	S	*	*			trans	-66.1	116.2	148.4	-76.5	177.2	-20.3	0	0	106	F821	F821-Q823 HydrophobicContact CD1-CG 4.15Å
824	Q	29.6	Very low	26	Very low	181 Å²	181	163.1 Å²	163.1	85%	0.846	80%	0.796	S	S	*	*			trans	-107.7	112.2	153.7	-86.4	-172.4	2.8	0	0	108.4	I822	I822-Q824 HydrophobicContact CG2-CG 3.84Å; I822-Q824 PolarHBondContact O-N 2.81Å
825	N	25.8	Very low	25.8	Very low	128 Å²	128	164.2 Å²	164.2	68%	0.684	80%	0.799	S	S	*	*			trans	-66.3	149.6	-175.1	-76.4	-43.6	0	0	0	112.1	V827	N825-V827 PolarHBondContact O-N 3.01Å
826	N	24.2	Very low	25.5	Very low	162 Å²	162	161 Å²	161	87%	0.866	79%	0.789	S	S	*	*			trans	-34.1	119.8	149	-73.7	-45.5	0	0	0	111.9
827	V	28.1	Very low	25.4	Very low	118 Å²	118	159.6 Å²	159.6	72%	0.715	78%	0.783	S	S	*	*			trans	-132.1	109.2	149	-179.4	0	0	0	0	106.8	N825 E829	N825-V827 PolarHBondContact O-N 3.01Å; V827-E829 PolarHBondContact O-N 2.05Å
828	K	24.6	Very low	25.2	Very low	204 Å²	204	158.2 Å²	158.2	89%	0.887	78%	0.78	S	S	*	*			trans	-59	120.3	159	-83.5	174.4	170.3	177.7	0	106.9
829	E	25.8	Very low	25.2	Very low	176 Å²	176	152.3 Å²	152.3	82%	0.822	77%	0.767	S	S	*	*			trans	-142.5	114.2	152.8	-111.3	170	-159	0	0	109.4	V827	V827-E829 PolarHBondContact O-N 2.05Å
830	N	25.2	Very low	25.3	Very low	152 Å²	152	155.2 Å²	155.2	81%	0.813	77%	0.768	S	S	*	*			trans	-62.5	125.1	171.5	-74.1	-31	0	0	0	109
831	F	25.8	Very low	25.6	Very low	194 Å²	194	149.5 Å²	149.5	85%	0.851	76%	0.757	S	S	*	*			trans	-140.7	100.3	148.3	-106.4	-83.2	0	0	0	109.1	I833	F831-I833 PolarHBondContact O-N 3.48Å
832	H	24.1	Very low	25.5	Very low	164 Å²	164	144 Å²	144	76%	0.759	74%	0.744	S	S	*	*			trans	-59.1	118.6	158.4	-104	-101.1	0	0	0	108.2
833	I	25.9	Very low	25.4	Very low	160 Å²	160	145.9 Å²	145.9	82%	0.821	75%	0.75	S	S	*	*			trans	-134.2	114.2	144.2	-60.5	-175.2	0	0	0	107.7	F831	F831-I833 PolarHBondContact O-N 3.48Å
834	E	22.4	Very low	25.6	Very low	145 Å²	145	143.1 Å²	143.1	68%	0.678	73%	0.733	S	S	*	*			trans	-64.9	163.3	175.9	-106.7	176.1	163	0	0	113.7
835	M	24	Very low	25.9	Very low	165 Å²	165	139.1 Å²	139.1	81%	0.813	72%	0.718	S	S	*	*			trans	72	137	154.4	-68.6	167.2	70.7	0	0	116.4
836	S	24.1	Very low	26.3	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	71%	0.714	S	S	*	*			cis	-167.1	150.8	6.3	36.2	0	0	0	0	108.2
837	N	24.7	Very low	26.9	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	70%	0.702	S	S	*	*			trans	-12.5	163.9	155.4	-61.2	-46.7	0	0	0	119.2
838	I	25.6	Very low	27.5	Very low	167 Å²	167	135.1 Å²	135.1	86%	0.856	69%	0.69	S	S	*	*			trans	101.8	90.6	151.4	-47.9	156.2	0	0	0	113.2
839	A	24.6	Very low	28.2	Very low	69 Å²	69	128.7 Å²	128.7	57%	0.57	67%	0.665	S	S	*	*				168.8	105.6	105.7	0	0	0	0	0	111.7
840	K	26.6	Very low	29.2	Very low	157 Å²	157	123.4 Å²	123.4	68%	0.683	64%	0.644	S	S	*	*			trans	-55.5	-176.6	142.8	-71.5	-179.9	177.2	180	0	109.4
841	P	31.5	Very low	30	Very low	102 Å²	102	123.3 Å²	123.3	66%	0.662	63%	0.633	S	S	*	*			cis	-134.5	-153.9	-37.5	30.7	-7.5	0	0	0	110.1
842	A	22.2	Very low	30.8	Very low	56 Å²	56	115.1 Å²	115.1	46%	0.463	60%	0.597	S	S	.	*			trans	109.5	135.8	152.8	0	0	0	0	0	117.7	L868	A842-L868 HydrophobicContact CB-CD1 3.92Å; A842-L868 HydrophobicContact CB-CG 4.44Å
843	Q	23.6	Very low	31.7	Very low	184 Å²	184	115.6 Å²	115.6	86%	0.86	59%	0.593	S	S	*	*			trans	-43.7	134.5	-169.3	-65	160.2	-36.2	0	0	113.4
844	R	29.8	Very low	32.9	Very low	83 Å²	83	115.5 Å²	115.5	31%	0.313	58%	0.582	S	S	.	*			trans	-126.4	105.5	173.3	-72.8	-174.9	-178.9	169	-6.5	112.4	I846 L849 H852 S867 Y870	R844-I846 PolarHBondContact O-N 3Å; R844-L849 HydrophobicContact CB-CB 4.2Å; R844-L849 HydrophobicContact CB-CD1 3.73Å; R844-L849 HydrophobicContact CG-CD1 4.14Å; R844-H852 PolarHBondContact NH1-CD2 3.49Å; R844-H852 PolarHBondContact NH1-NE2 2.91Å; R844-H852 PolarHBondContact NH2-CE1 2.76Å; R844-H852 PolarHBondContact NH2-NE2 2.86Å; R844-H852 VanDerWaalsContact NH2-NE2 3.14Å; R844-S867 PolarHBondContact NH2-O 2.7Å; R844-Y870 PolarHBondContact NH2-OH 3.47Å
845	N	34.5	Very low	33.9	Very low	98 Å²	98	114.2 Å²	114.2	52%	0.524	57%	0.572	S	S	.	*			trans	-34.4	120.8	150.5	-178.9	-27.5	0	0	0	109	L847 L848 L849	N845-L847 PolarHBondContact O-N 3.15Å; N845-L847 VanDerWaalsContact O-N 3.07Å; N845-L847 WeakPolarHBondContact OD1-CB 3.38Å; N845-L847 PolarHBondContact OD1-N 2.91Å; N845-L848 HydrophobicContact CB-CB 4.05Å; N845-L848 HydrophobicContact CB-CD1 3.88Å; N845-L848 HydrophobicContact CB-CG 3.93Å; N845-L848 CarbonylContact O-C 3.33Å; N845-L848 WeakPolarHBondContact O-CA 3.39Å; N845-L848 WeakPolarHBondContact O-CB 3.31Å; N845-L848 PolarHBondContact O-N 3.07Å; N845-L849 PolarHBondContact O-N 3.03Å
846	I	36	Very low	34.9	Very low	120 Å²	120	111 Å²	111	62%	0.615	56%	0.557	S	S	*	*	H	α-helix	trans	-58.4	-26.7	-174.7	-127.5	156.2	0	0	0	111.2	R844 V850	R844-I846 PolarHBondContact O-N 3Å; I846-V850 WeakPolarHBondContact O-CB 3.39Å; I846-V850 WeakPolarHBondContact O-CG2 3Å; I846-V850 PolarHBondContact O-N 2.73Å
847	L	35.2	Very low	35.9	Very low	118 Å²	118	115.3 Å²	115.3	62%	0.618	56%	0.564	S	S	*	*	H	α-helix	trans	-70.2	-35.8	171.9	-128.7	87.8	0	0	0	112.9	N845 R851	N845-L847 PolarHBondContact O-N 3.15Å; N845-L847 VanDerWaalsContact O-N 3.07Å; N845-L847 WeakPolarHBondContact OD1-CB 3.38Å; N845-L847 PolarHBondContact OD1-N 2.91Å; L847-R851 WeakPolarHBondContact O-CB 3.39Å; L847-R851 PolarHBondContact O-N 3.14Å
848	L	40.5	Very low	36.8	Very low	85 Å²	85	117.1 Å²	117.1	45%	0.445	56%	0.56	S	S	.	*	H	α-helix	trans	-75.9	-35	173.4	-70.1	177	0	0	0	111.9	N845 R851 H852	N845-L848 HydrophobicContact CB-CB 4.05Å; N845-L848 HydrophobicContact CB-CD1 3.88Å; N845-L848 HydrophobicContact CB-CG 3.93Å; N845-L848 CarbonylContact O-C 3.33Å; N845-L848 WeakPolarHBondContact O-CA 3.39Å; N845-L848 WeakPolarHBondContact O-CB 3.31Å; N845-L848 PolarHBondContact O-N 3.07Å; L848-R851 CarbonylContact O-C 3.59Å; L848-R851 PolarHBondContact O-N 2.9Å; L848-H852 WeakPolarHBondContact O-CB 3.46Å; L848-H852 PolarHBondContact O-N 3.48Å
849	L	39.5	Very low	38.1	Very low	69 Å²	69	117.9 Å²	117.9	36%	0.361	56%	0.56	S	S	.	*	H	α-helix	trans	-66.4	-39.6	175.8	-159.7	79.3	0	0	0	111.2	R844 N845 H852 Y853	R844-L849 HydrophobicContact CB-CB 4.2Å; R844-L849 HydrophobicContact CB-CD1 3.73Å; R844-L849 HydrophobicContact CG-CD1 4.14Å; N845-L849 PolarHBondContact O-N 3.03Å; L849-H852 PolarHBondContact O-N 3.03Å; L849-Y853 WeakPolarHBondContact O-CB 3.2Å; L849-Y853 PolarHBondContact O-N 3.4Å
850	V	46.5	Very low	39.6	Very low	65 Å²	65	119.4 Å²	119.4	39%	0.394	56%	0.558	S	S	.	*	H	α-helix	trans	-69	-38.2	172.3	172	0	0	0	0	111.5	I846 R854	I846-V850 WeakPolarHBondContact O-CB 3.39Å; I846-V850 WeakPolarHBondContact O-CG2 3Å; I846-V850 PolarHBondContact O-N 2.73Å; V850-R854 VanDerWaalsContact O-CB 3.26Å; V850-R854 WeakPolarHBondContact O-CB 3.09Å; V850-R854 WeakPolarHBondContact O-CG 3.04Å; V850-R854 PolarHBondContact O-N 3.35Å
851	R	41.9	Very low	41.4	Very low	151 Å²	151	115.6 Å²	115.6	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-64.4	-36.7	169.5	-94	-179.7	175.5	156.7	0.1	112.6	L847 L848 R855	L847-R851 WeakPolarHBondContact O-CB 3.39Å; L847-R851 PolarHBondContact O-N 3.14Å; L848-R851 CarbonylContact O-C 3.59Å; L848-R851 PolarHBondContact O-N 2.9Å; R851-R855 WeakPolarHBondContact O-CB 3.43Å; R851-R855 WeakPolarHBondContact O-CG 3.06Å; R851-R855 PolarHBondContact O-N 2.96Å
852	H	42.5	Very low	43.4	Very low	22 Å²	22	113.1 Å²	113.1	10%	0.102	53%	0.526	C	S	.	.	H	α-helix	trans	-70.3	-46.4	179.4	-179.4	70.2	0	0	0	111.6	R844 L848 L849 R854 R855 L856 Y870	R844-H852 PolarHBondContact NH1-CD2 3.49Å; R844-H852 PolarHBondContact NH1-NE2 2.91Å; R844-H852 PolarHBondContact NH2-CE1 2.76Å; R844-H852 PolarHBondContact NH2-NE2 2.86Å; R844-H852 VanDerWaalsContact NH2-NE2 3.14Å; L848-H852 WeakPolarHBondContact O-CB 3.46Å; L848-H852 PolarHBondContact O-N 3.48Å; L849-H852 PolarHBondContact O-N 3.03Å; H852-R854 PolarHBondContact O-N 3.36Å; H852-R855 PolarHBondContact O-N 3.1Å; H852-R855 VanDerWaalsContact O-N 3.17Å; H852-L856 VanDerWaalsContact CD2-CD1 3.47Å; H852-L856 WeakPolarHBondContact CD2-CD1 3.19Å; H852-L856 WeakPolarHBondContact NE2-CD1 3.36Å; H852-L856 WeakPolarHBondContact O-CB 3.12Å; H852-L856 PolarHBondContact O-N 2.74Å; H852-Y870 AromaticContact CE1-CE1 3.39Å; H852-Y870 WeakPolarHBondContact CE1-CE1 3.42Å; H852-Y870 AromaticContact CE1-CZ 3.52Å; H852-Y870 PolarHBondContact CE1-OH 3.16Å; H852-Y870 AromaticContact ND1-CE1 3.28Å; H852-Y870 VanDerWaalsContact ND1-CE1 3.28Å; H852-Y870 WeakPolarHBondContact ND1-CE1 3.31Å; H852-Y870 AromaticContact ND1-CE2 3.84Å; H852-Y870 AromaticContact ND1-CZ 3Å; H852-Y870 PolarHBondContact ND1-OH 3.04Å
853	Y	44.6	Very low	46	Very low	173 Å²	173	115.4 Å²	115.4	68%	0.678	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-35.9	174.7	-116.4	-94.5	0	0	0	112.5	L849 R855 K857	L849-Y853 WeakPolarHBondContact O-CB 3.2Å; L849-Y853 PolarHBondContact O-N 3.4Å; Y853-R855 VanDerWaalsContact C-N 3.34Å; Y853-K857 PolarHBondContact O-N 3Å
854	R	50.2	Low	48.9	Very low	158 Å²	158	106.8 Å²	106.8	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-68.3	-28.6	172.6	-75.8	175.4	-177.1	169	2.4	113.1	V850 H852	V850-R854 VanDerWaalsContact O-CB 3.26Å; V850-R854 WeakPolarHBondContact O-CB 3.09Å; V850-R854 WeakPolarHBondContact O-CG 3.04Å; V850-R854 PolarHBondContact O-N 3.35Å; H852-R854 PolarHBondContact O-N 3.36Å
855	R	43.3	Very low	51.1	Low	119 Å²	119	107.1 Å²	107.1	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-84.6	-31	176.4	-77.9	-179.6	176.8	176.6	-3.3	113.4	R851 H852 Y853 R858	R851-R855 WeakPolarHBondContact O-CB 3.43Å; R851-R855 WeakPolarHBondContact O-CG 3.06Å; R851-R855 PolarHBondContact O-N 2.96Å; H852-R855 PolarHBondContact O-N 3.1Å; H852-R855 VanDerWaalsContact O-N 3.17Å; Y853-R855 VanDerWaalsContact C-N 3.34Å; R855-R858 PolarHBondContact O-N 2.99Å
856	L	44.9	Very low	53	Low	98 Å²	98	104 Å²	104	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-71.5	-30	175.4	-93.6	154.6	0	0	0	114	H852 R858	H852-L856 VanDerWaalsContact CD2-CD1 3.47Å; H852-L856 WeakPolarHBondContact CD2-CD1 3.19Å; H852-L856 WeakPolarHBondContact NE2-CD1 3.36Å; H852-L856 WeakPolarHBondContact O-CB 3.12Å; H852-L856 PolarHBondContact O-N 2.74Å; L856-R858 PolarHBondContact O-N 3.33Å; L856-R858 VanDerWaalsContact O-N 3.11Å
857	K	46.2	Very low	54.6	Low	184 Å²	184	99.8 Å²	99.8	80%	0.8	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-1	172.4	-105.3	-174.4	177.6	-179.9	0	113.9	Y853	Y853-K857 PolarHBondContact O-N 3Å
858	R	43.1	Very low	56	Low	181 Å²	181	97.3 Å²	97.3	68%	0.683	45%	0.453	S	S	*	.	S	Bend	trans	-124.9	111.7	171.8	-67.8	-177.8	177.7	-178.8	-0.7	108.5	R855 L856 L860	R855-R858 PolarHBondContact O-N 2.99Å; L856-R858 PolarHBondContact O-N 3.33Å; L856-R858 VanDerWaalsContact O-N 3.11Å; R858-L860 HydrophobicContact CB-CD1 4.22Å; R858-L860 PolarHBondContact O-N 3.33Å
859	Q	52.9	Low	57.8	Low	184 Å²	184	96 Å²	96	86%	0.86	45%	0.445	S	S	*	.	S	Bend	trans	-63.5	48.5	-178.3	-66.6	-179.8	-32.4	0	0	115.5
860	L	56.5	Low	59.7	Low	100 Å²	100	94.9 Å²	94.9	52%	0.524	44%	0.436	S	S	.	.			trans	-121.7	10.2	-162	-79	167.9	0	0	0	116	R858 K873	R858-L860 HydrophobicContact CB-CD1 4.22Å; R858-L860 PolarHBondContact O-N 3.33Å; L860-K873 PolarHBondContact O-N 3.24Å
861	H	63.1	Low	61.5	Low	77 Å²	77	91.8 Å²	91.8	36%	0.356	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.7	-171.3	-55.7	89.3	0	0	0	114.3	C871	H861-C871 CarbonylContact C-O 3.39Å; H861-C871 WeakPolarHBondContact CA-O 3.27Å; H861-C871 VanDerWaalsContact CB-O 3.25Å; H861-C871 WeakPolarHBondContact CB-O 3.05Å
862	T	74.7	Confident	63.2	Low	51 Å²	51	85.6 Å²	85.6	31%	0.313	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.6	164.6	-49.8	0	0	0	0	108.8	Y870 C871 G872 E875	T862-Y870 CarbonylContact O-C 3.46Å; T862-Y870 WeakPolarHBondContact O-CA 3.33Å; T862-C871 PolarHBondContact N-O 3.02Å; T862-C871 PolarHBondContact O-N 2.04Å; T862-G872 PolarHBondContact OG1-O 3.26Å; T862-E875 PolarHBondContact OG1-O 3.17Å
863	I	77.5	Confident	64.6	Low	104 Å²	104	91.6 Å²	91.6	53%	0.533	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128	-179.9	-59.8	172.7	0	0	0	109	Y870	I863-Y870 HydrophobicContact CG1-CD1 4.45Å
864	C	82.6	Confident	66.3	Low	2 Å²	2	87.6 Å²	87.6	1%	0.014	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-79.4	157.3	176.2	-57.3	0	0	0	0	112.1	D866 S867 H869 C877 Y885	C864-D866 PolarHBondContact O-N 3.41Å; C864-D866 VanDerWaalsContact O-N 3.08Å; C864-S867 PolarHBondContact O-N 3.49Å; C864-H869 HydrophobicContact CB-CB 3.79Å; C864-H869 PolarHBondContact N-O 2.95Å; C864-C877 WeakPolarHBondContact CA-SG 3.39Å; C864-C877 HydrophobicContact CB-CB 3.73Å; C864-C877 WeakPolarHBondContact CB-SG 3.27Å; C864-C877 WeakPolarHBondContact SG-CB 3.45Å; C864-C877 CovalentContact SG-SG 2.04Å; C864-C877 PolarHBondContact SG-SG 2.85Å; C864-Y885 HydrophobicContact CB-CD1 4.13Å; C864-Y885 HydrophobicContact CB-CD2 4.06Å; C864-Y885 HydrophobicContact CB-CG 3.8Å
865	P	76.8	Confident	68.1	Low	91 Å²	91	83.4 Å²	83.4	59%	0.591	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.3	-173.6	-22.9	29.5	0	0	0	116.3	S867 Y885	P865-S867 VanDerWaalsContact C-N 3.26Å; P865-S867 PolarHBondContact O-N 2.86Å; P865-Y885 HydrophobicContact CB-CE2 4.49Å; P865-Y885 WeakPolarHBondContact CB-OH 3.06Å; P865-Y885 HydrophobicContact CG-CE1 3.86Å; P865-Y885 WeakPolarHBondContact CG-OH 3.29Å
866	D	74.9	Confident	70.3	Confident	33 Å²	33	80 Å²	80	18%	0.176	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4	176.2	65.2	1.6	0	0	0	114.6	C864 L868 H869 Y885	C864-D866 PolarHBondContact O-N 3.41Å; C864-D866 VanDerWaalsContact O-N 3.08Å; D866-L868 HydrophobicContact CB-CB 4.43Å; D866-L868 HydrophobicContact CB-CD1 4.45Å; D866-L868 PolarHBondContact O-N 2.75Å; D866-L868 PolarHBondContact OD1-N 3.07Å; D866-H869 PolarHBondContact OD1-N 2.02Å; D866-H869 IonicContact OD1-ND1 2.77Å; D866-H869 IonicContact OD2-CE1 3.85Å; D866-H869 IonicContact OD2-CG 2.79Å; D866-H869 IonicContact OD2-ND1 3.02Å; D866-H869 PolarHBondContact OD2-ND1 3.26Å; D866-Y885 HydrophobicContact CB-CD2 4.05Å; D866-Y885 HydrophobicContact CB-CE2 3.71Å; D866-Y885 VanDerWaalsContact CG-CD2 3.45Å; D866-Y885 WeakPolarHBondContact OD2-CD2 3.06Å
867	S	69.6	Low	72.3	Confident	31 Å²	31	76.8 Å²	76.8	22%	0.217	39%	0.385	C	S	.	.	S	Bend	trans	57.4	7.6	-172.8	-58.6	0	0	0	0	114.8	R844 C864 P865 Y870	R844-S867 PolarHBondContact NH2-O 2.7Å; C864-S867 PolarHBondContact O-N 3.49Å; P865-S867 VanDerWaalsContact C-N 3.26Å; P865-S867 PolarHBondContact O-N 2.86Å; S867-Y870 PolarHBondContact O-OH 2.78Å
868	L	64.7	Low	74.3	Confident	65 Å²	65	68.2 Å²	68.2	34%	0.34	35%	0.348	S	S	.	.	S	Bend	trans	-105	-27.1	-178.7	-70.2	160.7	0	0	0	111.4	A842 D866 Y870	A842-L868 HydrophobicContact CB-CD1 3.92Å; A842-L868 HydrophobicContact CB-CG 4.44Å; D866-L868 HydrophobicContact CB-CB 4.43Å; D866-L868 HydrophobicContact CB-CD1 4.45Å; D866-L868 PolarHBondContact O-N 2.75Å; D866-L868 PolarHBondContact OD1-N 3.07Å; L868-Y870 VanDerWaalsContact O-CE2 3.29Å; L868-Y870 WeakPolarHBondContact O-CE2 3.41Å
869	H	78.3	Confident	76.1	Confident	58 Å²	58	63.9 Å²	63.9	27%	0.269	34%	0.338	S	S	.	.			trans	-107.1	148.8	179.5	-68.2	82.8	0	0	0	113.7	C864 D866 F883	C864-H869 HydrophobicContact CB-CB 3.79Å; C864-H869 PolarHBondContact N-O 2.95Å; D866-H869 PolarHBondContact OD1-N 2.02Å; D866-H869 IonicContact OD1-ND1 2.77Å; D866-H869 IonicContact OD2-CE1 3.85Å; D866-H869 IonicContact OD2-CG 2.79Å; D866-H869 IonicContact OD2-ND1 3.02Å; D866-H869 PolarHBondContact OD2-ND1 3.26Å; H869-F883 PolarHBondContact CE1-O 2.58Å; H869-F883 PolarHBondContact NE2-O 3.48Å
870	Y	78.9	Confident	77.2	Confident	45 Å²	45	55.5 Å²	55.5	18%	0.176	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.1	-179.9	-38.4	-78.9	0	0	0	109.1	R844 H852 T862 I863 S867 L868	R844-Y870 PolarHBondContact NH2-OH 3.47Å; H852-Y870 AromaticContact CE1-CE1 3.39Å; H852-Y870 WeakPolarHBondContact CE1-CE1 3.42Å; H852-Y870 AromaticContact CE1-CZ 3.52Å; H852-Y870 PolarHBondContact CE1-OH 3.16Å; H852-Y870 AromaticContact ND1-CE1 3.28Å; H852-Y870 VanDerWaalsContact ND1-CE1 3.28Å; H852-Y870 WeakPolarHBondContact ND1-CE1 3.31Å; H852-Y870 AromaticContact ND1-CE2 3.84Å; H852-Y870 AromaticContact ND1-CZ 3Å; H852-Y870 PolarHBondContact ND1-OH 3.04Å; T862-Y870 CarbonylContact O-C 3.46Å; T862-Y870 WeakPolarHBondContact O-CA 3.33Å; I863-Y870 HydrophobicContact CG1-CD1 4.45Å; S867-Y870 PolarHBondContact O-OH 2.78Å; L868-Y870 VanDerWaalsContact O-CE2 3.29Å; L868-Y870 WeakPolarHBondContact O-CE2 3.41Å
871	C	83.5	Confident	77.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	157.2	172.7	-58	0	0	0	0	110	H861 T862 E875 C877 C887	H861-C871 CarbonylContact C-O 3.39Å; H861-C871 WeakPolarHBondContact CA-O 3.27Å; H861-C871 VanDerWaalsContact CB-O 3.25Å; H861-C871 WeakPolarHBondContact CB-O 3.05Å; T862-C871 PolarHBondContact N-O 3.02Å; T862-C871 PolarHBondContact O-N 2.04Å; C871-E875 HydrophobicContact CB-CB 3.61Å; C871-C877 VanDerWaalsContact SG-SG 3.61Å; C871-C887 WeakPolarHBondContact CA-SG 3.34Å; C871-C887 HydrophobicContact CB-CB 3.66Å; C871-C887 WeakPolarHBondContact CB-SG 3.38Å; C871-C887 WeakPolarHBondContact SG-CA 3.26Å; C871-C887 WeakPolarHBondContact SG-CB 3.4Å; C871-C887 CovalentContact SG-SG 2.04Å; C871-C887 PolarHBondContact SG-SG 3.02Å
872	G	78.3	Confident	77.7	Confident	20 Å²	20	60 Å²	60	21%	0.206	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	160	173.5	0	0	0	0	0	111.9	T862 S874 E875	T862-G872 PolarHBondContact OG1-O 3.26Å; G872-S874 PolarHBondContact O-N 3.34Å; G872-E875 PolarHBondContact N-OE2 3.11Å; G872-E875 WeakPolarHBondContact O-CB 3.38Å; G872-E875 PolarHBondContact O-N 2.77Å
873	K	73	Confident	77.4	Confident	149 Å²	149	63.5 Å²	63.5	65%	0.648	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.6	178.3	-152	177.2	-177.7	177.9	0	114.3	L860	L860-K873 PolarHBondContact O-N 3.24Å
874	S	79.5	Confident	77.5	Confident	88 Å²	88	60.2 Å²	60.2	62%	0.615	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	11.6	177	52.1	0	0	0	0	113.9	G872 N890	G872-S874 PolarHBondContact O-N 3.34Å; S874-N890 PolarHBondContact O-N 2.87Å; S874-N890 VanDerWaalsContact O-N 3.14Å
875	E	88.6	Confident	77.5	Confident	71 Å²	71	62.1 Å²	62.1	33%	0.332	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.7	-174.3	-64.3	174.8	163.6	0	0	111.2	T862 C871 G872 C887 T888	T862-E875 PolarHBondContact OG1-O 3.17Å; C871-E875 HydrophobicContact CB-CB 3.61Å; G872-E875 PolarHBondContact N-OE2 3.11Å; G872-E875 WeakPolarHBondContact O-CB 3.38Å; G872-E875 PolarHBondContact O-N 2.77Å; E875-C887 HydrophobicContact CB-CB 4.34Å; E875-C887 WeakPolarHBondContact OE2-CB 2.99Å; E875-T888 CarbonylContact C-O 3.59Å; E875-T888 WeakPolarHBondContact CA-O 3.43Å; E875-T888 WeakPolarHBondContact CB-O 3.16Å
876	Q	88.1	Confident	78	Confident	46 Å²	46	60.1 Å²	60.1	22%	0.215	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	159.9	174.7	69.1	-180	-4.9	0	0	110.8	C887 T888 P889 S892	Q876-C887 WeakPolarHBondContact O-CA 3Å; Q876-T888 WeakPolarHBondContact CG-OG1 3.21Å; Q876-T888 PolarHBondContact N-O 3.28Å; Q876-T888 PolarHBondContact NE2-OG1 2.83Å; Q876-T888 PolarHBondContact O-N 3.31Å; Q876-P889 PolarHBondContact NE2-O 2.98Å; Q876-S892 PolarHBondContact NE2-O 3.08Å; Q876-S892 PolarHBondContact NE2-OG 3.17Å
877	C	88.4	Confident	78.6	Confident	31 Å²	31	60.7 Å²	60.7	21%	0.209	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.6	180	-56.3	0	0	0	0	110.9	C864 C871 Y885	C864-C877 WeakPolarHBondContact CA-SG 3.39Å; C864-C877 HydrophobicContact CB-CB 3.73Å; C864-C877 WeakPolarHBondContact CB-SG 3.27Å; C864-C877 WeakPolarHBondContact SG-CB 3.45Å; C864-C877 CovalentContact SG-SG 2.04Å; C864-C877 PolarHBondContact SG-SG 2.85Å; C871-C877 VanDerWaalsContact SG-SG 3.61Å; C877-Y885 HydrophobicContact CB-CD1 3.8Å; C877-Y885 HydrophobicContact CB-CE1 4.45Å; C877-Y885 HydrophobicContact CB-CG 4.5Å
878	C	88.4	Confident	79.5	Confident	4 Å²	4	59.2 Å²	59.2	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.4	164.7	-67.6	0	0	0	0	109.1	Y885 T886 T888 C894	C878-Y885 CarbonylContact O-C 3.37Å; C878-Y885 VanDerWaalsContact O-CA 3.27Å; C878-Y885 WeakPolarHBondContact O-CA 3.28Å; C878-Y885 WeakPolarHBondContact O-CD1 3.01Å; C878-T886 HydrophobicContact CB-CG2 3.99Å; C878-T886 PolarHBondContact N-O 3.47Å; C878-T886 PolarHBondContact O-N 2.74Å; C878-T888 HydrophobicContact CB-CG2 4.09Å; C878-T888 VanDerWaalsContact SG-CG2 3.56Å; C878-T888 PolarHBondContact SG-OG1 2.84Å; C878-T888 VanDerWaalsContact SG-OG1 3.41Å; C878-C894 VanDerWaalsContact CA-SG 3.57Å; C878-C894 HydrophobicContact CB-CB 3.82Å; C878-C894 WeakPolarHBondContact CB-SG 3.38Å; C878-C894 WeakPolarHBondContact SG-CB 3.3Å; C878-C894 CovalentContact SG-SG 2.05Å; C878-C894 PolarHBondContact SG-SG 2.75Å
879	L	79.6	Confident	80.5	Confident	91 Å²	91	59.7 Å²	59.7	48%	0.476	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	146.8	172.2	-95.3	93	0	0	0	109.9	G884 Y885 M899	L879-G884 CarbonylContact C-O 3.59Å; L879-G884 WeakPolarHBondContact CA-O 3.32Å; L879-Y885 HydrophobicContact CD1-CE1 4.07Å; L879-Y885 HydrophobicContact CG-CE1 4.18Å; L879-M899 CarbonylContact C-O 3.48Å; L879-M899 HydrophobicContact CB-CB 4.46Å; L879-M899 HydrophobicContact CB-CE 4.38Å; L879-M899 HydrophobicContact CB-CG 4.33Å; L879-M899 HydrophobicContact CB-SD 3.35Å; L879-M899 WeakPolarHBondContact CB-SD 3.5Å; L879-M899 HydrophobicContact CD2-CE 3.74Å; L879-M899 HydrophobicContact CD2-SD 3.85Å; L879-M899 HydrophobicContact CG-SD 4.19Å; L879-M899 CarbonylContact O-C 3.46Å; L879-M899 WeakPolarHBondContact O-CB 3.31Å
880	S	75.3	Confident	80.6	Confident	7 Å²	7	61.6 Å²	61.6	5%	0.049	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.3	171.8	170.7	0	0	0	0	111.6	K882 F883 G884 M899 D900	S880-K882 VanDerWaalsContact C-N 3.29Å; S880-K882 PolarHBondContact OG-N 2.04Å; S880-F883 PolarHBondContact OG-N 3.05Å; S880-G884 PolarHBondContact N-O 3.02Å; S880-G884 CarbonylContact O-C 3.5Å; S880-G884 WeakPolarHBondContact O-CA 3.41Å; S880-G884 PolarHBondContact O-N 3.35Å; S880-M899 VanDerWaalsContact CA-O 3.23Å; S880-M899 WeakPolarHBondContact CA-O 3.44Å; S880-D900 WeakPolarHBondContact CB-OD1 3.46Å; S880-D900 PolarHBondContact OG-OD1 2.77Å
881	N	66.7	Low	80.8	Confident	117 Å²	117	66.8 Å²	66.8	63%	0.626	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-22.6	176.8	-86.4	-12.7	0	0	0	112.1	M899 D900	N881-M899 HydrophobicContact CB-CB 4.25Å; N881-M899 WeakPolarHBondContact OD1-CG 3.35Å; N881-D900 PolarHBondContact N-OD1 2.05Å
882	K	65.3	Low	80.9	Confident	156 Å²	156	67.5 Å²	67.5	68%	0.678	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-30.7	-177.1	-164.5	170.6	-177.7	177.2	0	112.7	S880	S880-K882 VanDerWaalsContact C-N 3.29Å; S880-K882 PolarHBondContact OG-N 2.04Å
883	F	67.8	Low	81.3	Confident	124 Å²	124	69 Å²	69	54%	0.544	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-0.9	-172	-53.3	-70.2	0	0	0	114	H869 S880 Y885	H869-F883 PolarHBondContact CE1-O 2.58Å; H869-F883 PolarHBondContact NE2-O 3.48Å; S880-F883 PolarHBondContact OG-N 3.05Å; F883-Y885 PolarHBondContact O-N 2.97Å; F883-Y885 VanDerWaalsContact O-N 3.09Å
884	G	78.9	Confident	82	Confident	35 Å²	35	64.6 Å²	64.6	36%	0.361	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.5	-57	-174.1	0	0	0	0	0	112.1	L879 S880	L879-G884 CarbonylContact C-O 3.59Å; L879-G884 WeakPolarHBondContact CA-O 3.32Å; S880-G884 PolarHBondContact N-O 3.02Å; S880-G884 CarbonylContact O-C 3.5Å; S880-G884 WeakPolarHBondContact O-CA 3.41Å; S880-G884 PolarHBondContact O-N 3.35Å
885	Y	83.2	Confident	82.2	Confident	42 Å²	42	60.6 Å²	60.6	17%	0.165	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.5	172.1	-72.4	-86.4	0	0	0	112.1	C864 P865 D866 C877 C878 L879 F883	C864-Y885 HydrophobicContact CB-CD1 4.13Å; C864-Y885 HydrophobicContact CB-CD2 4.06Å; C864-Y885 HydrophobicContact CB-CG 3.8Å; P865-Y885 HydrophobicContact CB-CE2 4.49Å; P865-Y885 WeakPolarHBondContact CB-OH 3.06Å; P865-Y885 HydrophobicContact CG-CE1 3.86Å; P865-Y885 WeakPolarHBondContact CG-OH 3.29Å; D866-Y885 HydrophobicContact CB-CD2 4.05Å; D866-Y885 HydrophobicContact CB-CE2 3.71Å; D866-Y885 VanDerWaalsContact CG-CD2 3.45Å; D866-Y885 WeakPolarHBondContact OD2-CD2 3.06Å; C877-Y885 HydrophobicContact CB-CD1 3.8Å; C877-Y885 HydrophobicContact CB-CE1 4.45Å; C877-Y885 HydrophobicContact CB-CG 4.5Å; C878-Y885 CarbonylContact O-C 3.37Å; C878-Y885 VanDerWaalsContact O-CA 3.27Å; C878-Y885 WeakPolarHBondContact O-CA 3.28Å; C878-Y885 WeakPolarHBondContact O-CD1 3.01Å; L879-Y885 HydrophobicContact CD1-CE1 4.07Å; L879-Y885 HydrophobicContact CG-CE1 4.18Å; F883-Y885 PolarHBondContact O-N 2.97Å; F883-Y885 VanDerWaalsContact O-N 3.09Å
886	T	86.5	Confident	81.1	Confident	48 Å²	48	60.4 Å²	60.4	29%	0.294	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	152.7	170.4	-167.4	0	0	0	0	110.4	C878 T888	C878-T886 HydrophobicContact CB-CG2 3.99Å; C878-T886 PolarHBondContact N-O 3.47Å; C878-T886 PolarHBondContact O-N 2.74Å; T886-T888 HydrophobicContact CG2-CG2 4.24Å
887	C	88	Confident	79.6	Confident	45 Å²	45	61.3 Å²	61.3	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.1	-177.9	-61.8	0	0	0	0	110.5	C871 E875 Q876	C871-C887 WeakPolarHBondContact CA-SG 3.34Å; C871-C887 HydrophobicContact CB-CB 3.66Å; C871-C887 WeakPolarHBondContact CB-SG 3.38Å; C871-C887 WeakPolarHBondContact SG-CA 3.26Å; C871-C887 WeakPolarHBondContact SG-CB 3.4Å; C871-C887 CovalentContact SG-SG 2.04Å; C871-C887 PolarHBondContact SG-SG 3.02Å; E875-C887 HydrophobicContact CB-CB 4.34Å; E875-C887 WeakPolarHBondContact OE2-CB 2.99Å; Q876-C887 WeakPolarHBondContact O-CA 3Å
888	T	87.8	Confident	77.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	154.5	-178.9	66.5	0	0	0	0	110.1	E875 Q876 C878 T886 N890 S892 Y902	E875-T888 CarbonylContact C-O 3.59Å; E875-T888 WeakPolarHBondContact CA-O 3.43Å; E875-T888 WeakPolarHBondContact CB-O 3.16Å; Q876-T888 WeakPolarHBondContact CG-OG1 3.21Å; Q876-T888 PolarHBondContact N-O 3.28Å; Q876-T888 PolarHBondContact NE2-OG1 2.83Å; Q876-T888 PolarHBondContact O-N 3.31Å; C878-T888 HydrophobicContact CB-CG2 4.09Å; C878-T888 VanDerWaalsContact SG-CG2 3.56Å; C878-T888 PolarHBondContact SG-OG1 2.84Å; C878-T888 VanDerWaalsContact SG-OG1 3.41Å; T886-T888 HydrophobicContact CG2-CG2 4.24Å; T888-N890 PolarHBondContact O-N 3.47Å; T888-S892 VanDerWaalsContact CB-OG 3.24Å; T888-S892 WeakPolarHBondContact CB-OG 3.47Å; T888-S892 PolarHBondContact OG1-OG 2.95Å; T888-Y902 HydrophobicContact CG2-CD1 3.56Å; T888-Y902 HydrophobicContact CG2-CD2 4.17Å; T888-Y902 HydrophobicContact CG2-CE1 4.22Å; T888-Y902 HydrophobicContact CG2-CG 3.54Å
889	P	86.9	Confident	76.4	Confident	75 Å²	75	65.5 Å²	65.5	49%	0.487	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	139.7	175.6	-24.2	33.8	0	0	0	111.1	Q876 K891 S892	Q876-P889 PolarHBondContact NE2-O 2.98Å; P889-K891 PolarHBondContact O-N 2.74Å; P889-S892 PolarHBondContact O-N 3.39Å; P889-S892 VanDerWaalsContact O-N 3.15Å; P889-S892 PolarHBondContact O-OG 2.94Å
890	N	80.4	Confident	75.8	Confident	98 Å²	98	65.4 Å²	65.4	52%	0.524	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	132.6	177.1	-134.9	-7.8	0	0	0	110.3	S874 T888	S874-N890 PolarHBondContact O-N 2.87Å; S874-N890 VanDerWaalsContact O-N 3.14Å; T888-N890 PolarHBondContact O-N 3.47Å
891	K	82.3	Confident	75.7	Confident	155 Å²	155	66.9 Å²	66.9	67%	0.674	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	13.7	-175.7	-43.6	175.2	178.3	-179.3	0	117.7	P889 I905	P889-K891 PolarHBondContact O-N 2.74Å; K891-I905 HydrophobicContact CB-CD1 3.82Å; K891-I905 HydrophobicContact CD-CD1 4.24Å; K891-I905 WeakPolarHBondContact O-CB 3.12Å; K891-I905 WeakPolarHBondContact O-CG1 3.38Å
892	S	86.2	Confident	76.7	Confident	16 Å²	16	66.6 Å²	66.6	11%	0.112	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-78	159.5	166.7	49.1	0	0	0	0	111.7	Q876 T888 P889 C903	Q876-S892 PolarHBondContact NE2-O 3.08Å; Q876-S892 PolarHBondContact NE2-OG 3.17Å; T888-S892 VanDerWaalsContact CB-OG 3.24Å; T888-S892 WeakPolarHBondContact CB-OG 3.47Å; T888-S892 PolarHBondContact OG1-OG 2.95Å; P889-S892 PolarHBondContact O-N 3.39Å; P889-S892 VanDerWaalsContact O-N 3.15Å; P889-S892 PolarHBondContact O-OG 2.94Å; S892-C903 CarbonylContact C-O 3.57Å; S892-C903 VanDerWaalsContact CA-O 3.31Å; S892-C903 WeakPolarHBondContact CA-O 3.5Å; S892-C903 VanDerWaalsContact CB-O 3.26Å; S892-C903 WeakPolarHBondContact CB-O 3.44Å
893	I	87.2	Confident	77.8	Confident	50 Å²	50	59.2 Å²	59.2	26%	0.256	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.6	176.7	-53.9	-175	0	0	0	108.7	Y902 C903 K907	I893-Y902 CarbonylContact O-C 3.57Å; I893-Y902 VanDerWaalsContact O-CA 3.24Å; I893-Y902 WeakPolarHBondContact O-CA 3.06Å; I893-C903 HydrophobicContact CB-CB 4.34Å; I893-C903 PolarHBondContact N-O 2.77Å; I893-C903 PolarHBondContact O-N 2.84Å; I893-K907 WeakPolarHBondContact CD1-O 3.04Å
894	C	87.7	Confident	78.6	Confident	57 Å²	57	55.3 Å²	55.3	39%	0.385	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	123.8	173.4	-54	0	0	0	0	110	C878	C878-C894 VanDerWaalsContact CA-SG 3.57Å; C878-C894 HydrophobicContact CB-CB 3.82Å; C878-C894 WeakPolarHBondContact CB-SG 3.38Å; C878-C894 WeakPolarHBondContact SG-CB 3.3Å; C878-C894 CovalentContact SG-SG 2.05Å; C878-C894 PolarHBondContact SG-SG 2.75Å
895	C	82.7	Confident	78.9	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.034	33%	0.331	C	S	.	.			trans	-86.9	114	-178.3	-60.2	0	0	0	0	111.9	S897 T901 C909	C895-S897 PolarHBondContact O-N 3.24Å; C895-T901 PolarHBondContact N-O 3.26Å; C895-T901 WeakPolarHBondContact CB-O 3.44Å; C895-T901 VanDerWaalsContact N-O 3.11Å; C895-C909 WeakPolarHBondContact CA-SG 3.07Å; C895-C909 HydrophobicContact CB-CB 3.75Å; C895-C909 WeakPolarHBondContact CB-SG 3.43Å; C895-C909 WeakPolarHBondContact SG-CB 3.09Å; C895-C909 CovalentContact SG-SG 2.04Å; C895-C909 PolarHBondContact SG-SG 3.47Å
896	G	65.2	Low	79.1	Confident	66 Å²	66	63.8 Å²	63.8	68%	0.68	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.7	-165.9	0	0	0	0	0	117.7
897	S	57.1	Low	79.2	Confident	66 Å²	66	63.9 Å²	63.9	46%	0.462	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-16.4	-175.3	30.3	0	0	0	0	114.6	C895 G913	C895-S897 PolarHBondContact O-N 3.24Å; S897-G913 WeakPolarHBondContact OG-CA 3.38Å; S897-G913 PolarHBondContact OG-N 3.29Å; S897-G913 VanDerWaalsContact OG-N 3.09Å
898	N	50.6	Low	79.2	Confident	68 Å²	68	65.2 Å²	65.2	36%	0.364	35%	0.352	S	S	.	.	S	Bend	trans	-150.6	108	165.2	-99.3	-44.6	0	0	0	107.6	D900 T901	N898-D900 PolarHBondContact O-N 3.17Å; N898-T901 PolarHBondContact O-N 2.04Å
899	M	59.5	Low	79.1	Confident	54 Å²	54	66.9 Å²	66.9	27%	0.266	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	12.3	-160.9	-59.1	-78	-171.5	0	0	115.2	L879 S880 N881	L879-M899 CarbonylContact C-O 3.48Å; L879-M899 HydrophobicContact CB-CB 4.46Å; L879-M899 HydrophobicContact CB-CE 4.38Å; L879-M899 HydrophobicContact CB-CG 4.33Å; L879-M899 HydrophobicContact CB-SD 3.35Å; L879-M899 WeakPolarHBondContact CB-SD 3.5Å; L879-M899 HydrophobicContact CD2-CE 3.74Å; L879-M899 HydrophobicContact CD2-SD 3.85Å; L879-M899 HydrophobicContact CG-SD 4.19Å; L879-M899 CarbonylContact O-C 3.46Å; L879-M899 WeakPolarHBondContact O-CB 3.31Å; S880-M899 VanDerWaalsContact CA-O 3.23Å; S880-M899 WeakPolarHBondContact CA-O 3.44Å; N881-M899 HydrophobicContact CB-CB 4.25Å; N881-M899 WeakPolarHBondContact OD1-CG 3.35Å
900	D	65.8	Low	79	Confident	90 Å²	90	64 Å²	64	48%	0.481	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	2.5	-179	-62.9	-31.6	0	0	0	113.2	S880 N881 N898	S880-D900 WeakPolarHBondContact CB-OD1 3.46Å; S880-D900 PolarHBondContact OG-OD1 2.77Å; N881-D900 PolarHBondContact N-OD1 2.05Å; N898-D900 PolarHBondContact O-N 3.17Å
901	T	74.4	Confident	78.9	Confident	37 Å²	37	67.9 Å²	67.9	23%	0.227	37%	0.365	C	S	.	.			trans	-109.7	135.3	-177.6	-28.6	0	0	0	0	112.3	C895 N898 G913	C895-T901 PolarHBondContact N-O 3.26Å; C895-T901 WeakPolarHBondContact CB-O 3.44Å; C895-T901 VanDerWaalsContact N-O 3.11Å; N898-T901 PolarHBondContact O-N 2.04Å; T901-G913 VanDerWaalsContact CB-O 3.26Å; T901-G913 WeakPolarHBondContact CB-O 3.37Å; T901-G913 PolarHBondContact OG1-O 3.36Å
902	Y	86.7	Confident	78.4	Confident	112 Å²	112	63.2 Å²	63.2	44%	0.439	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.9	170.8	65.6	-86.2	0	0	0	110.6	T888 I893	T888-Y902 HydrophobicContact CG2-CD1 3.56Å; T888-Y902 HydrophobicContact CG2-CD2 4.17Å; T888-Y902 HydrophobicContact CG2-CE1 4.22Å; T888-Y902 HydrophobicContact CG2-CG 3.54Å; I893-Y902 CarbonylContact O-C 3.57Å; I893-Y902 VanDerWaalsContact O-CA 3.24Å; I893-Y902 WeakPolarHBondContact O-CA 3.06Å
903	C	88.3	Confident	77.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.3	-179.7	-63.2	0	0	0	0	111.7	S892 I893 K907 C916	S892-C903 CarbonylContact C-O 3.57Å; S892-C903 VanDerWaalsContact CA-O 3.31Å; S892-C903 WeakPolarHBondContact CA-O 3.5Å; S892-C903 VanDerWaalsContact CB-O 3.26Å; S892-C903 WeakPolarHBondContact CB-O 3.44Å; I893-C903 HydrophobicContact CB-CB 4.34Å; I893-C903 PolarHBondContact N-O 2.77Å; I893-C903 PolarHBondContact O-N 2.84Å; C903-K907 HydrophobicContact CB-CB 4.19Å; C903-C916 PolarHBondContact SG-SG 3.07Å; C903-C916 CovalentContact SG-SG 2.04Å; C903-C916 WeakPolarHBondContact SG-CB 3.28Å; C903-C916 WeakPolarHBondContact SG-CA 3.27Å; C903-C916 HydrophobicContact CB-CB 3.88Å; C903-C916 WeakPolarHBondContact CA-SG 3.49Å; C903-C916 WeakPolarHBondContact CB-SG 3.48Å
904	P	85.3	Confident	77.2	Confident	42 Å²	42	66.2 Å²	66.2	27%	0.273	36%	0.357	S	S	.	.			trans	-56.6	157.4	168	-18.3	29.2	0	0	0	110.9	Y906 K907	P904-Y906 PolarHBondContact O-N 3.44Å; P904-Y906 HydrophobicContact CG-CE2 4.01Å; P904-Y906 HydrophobicContact CG-CE1 4.11Å; P904-Y906 HydrophobicContact CB-CG 4.2Å; P904-Y906 HydrophobicContact CB-CE2 3.83Å; P904-Y906 HydrophobicContact CB-CE1 3.27Å; P904-Y906 HydrophobicContact CB-CD2 4.25Å; P904-Y906 HydrophobicContact CB-CD1 3.74Å; P904-K907 PolarHBondContact O-N 3.41Å
905	I	84.6	Confident	77	Confident	103 Å²	103	68.7 Å²	68.7	53%	0.528	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.5	-176.2	-148	174	0	0	0	114.5	K891 K919	K891-I905 HydrophobicContact CB-CD1 3.82Å; K891-I905 HydrophobicContact CD-CD1 4.24Å; K891-I905 WeakPolarHBondContact O-CB 3.12Å; K891-I905 WeakPolarHBondContact O-CG1 3.38Å; I905-K919 PolarHBondContact O-NZ 3.09Å; I905-K919 VanDerWaalsContact O-NZ 3.14Å
906	Y	86.8	Confident	77.3	Confident	152 Å²	152	70.3 Å²	70.3	60%	0.596	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.8	-177.7	55.3	-98.8	0	0	0	114.9	P904	P904-Y906 PolarHBondContact O-N 3.44Å; P904-Y906 HydrophobicContact CG-CE2 4.01Å; P904-Y906 HydrophobicContact CG-CE1 4.11Å; P904-Y906 HydrophobicContact CB-CG 4.2Å; P904-Y906 HydrophobicContact CB-CE2 3.83Å; P904-Y906 HydrophobicContact CB-CE1 3.27Å; P904-Y906 HydrophobicContact CB-CD2 4.25Å; P904-Y906 HydrophobicContact CB-CD1 3.74Å
907	K	89.7	Confident	78.4	Confident	51 Å²	51	70.8 Å²	70.8	22%	0.222	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	158.3	174.1	-69.1	-169.9	-179.5	-90.5	0	110.4	I893 C903 P904 C916 I917 D918	I893-K907 WeakPolarHBondContact CD1-O 3.04Å; C903-K907 HydrophobicContact CB-CB 4.19Å; P904-K907 PolarHBondContact O-N 3.41Å; K907-C916 HydrophobicContact CB-CB 3.88Å; K907-C916 HydrophobicContact CD-CB 3.47Å; K907-C916 VanDerWaalsContact CD-CB 3.47Å; K907-C916 HydrophobicContact CG-CB 4.31Å; K907-I917 WeakPolarHBondContact CB-O 3.36Å; K907-I917 VanDerWaalsContact CB-O 3.26Å; K907-I917 VanDerWaalsContact CA-O 3.3Å; K907-I917 WeakPolarHBondContact CA-O 3.36Å; K907-I917 CarbonylContact C-O 3.48Å; K907-D918 WeakPolarHBondContact CE-OD1 3.1Å; K907-D918 VanDerWaalsContact NZ-CG 3.32Å; K907-D918 IonicContact NZ-OD1 3.59Å; K907-D918 PolarHBondContact NZ-OD1 3.3Å; K907-D918 IonicContact NZ-OD2 2.65Å; K907-D918 PolarHBondContact NZ-OD2 3.12Å
908	D	87	Confident	79.7	Confident	72 Å²	72	72.3 Å²	72.3	39%	0.385	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	163.6	170.3	-86.5	-26.7	0	0	0	111.6	C916 I917 K919	D908-C916 CarbonylContact O-C 3.33Å; D908-C916 VanDerWaalsContact O-CA 3.32Å; D908-C916 WeakPolarHBondContact O-CA 2.99Å; D908-I917 HydrophobicContact CB-CG1 4.15Å; D908-I917 PolarHBondContact O-N 2.68Å; D908-I917 WeakPolarHBondContact O-CG1 3.33Å; D908-I917 VanDerWaalsContact O-CG1 3.22Å; D908-I917 PolarHBondContact N-O 2.96Å; D908-I917 HydrophobicContact CB-CD1 4.48Å; D908-K919 HydrophobicContact CB-CG 4.33Å; D908-K919 VanDerWaalsContact CG-CE 3.44Å; D908-K919 WeakPolarHBondContact OD1-CE 3.33Å; D908-K919 IonicContact OD1-NZ 3.89Å; D908-K919 WeakPolarHBondContact OD2-CG 3.05Å
909	C	85.9	Confident	80.8	Confident	35 Å²	35	73.5 Å²	73.5	24%	0.236	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.7	174.7	-61.6	0	0	0	0	110.2	C895 I917	C895-C909 WeakPolarHBondContact CA-SG 3.07Å; C895-C909 HydrophobicContact CB-CB 3.75Å; C895-C909 WeakPolarHBondContact CB-SG 3.43Å; C895-C909 WeakPolarHBondContact SG-CB 3.09Å; C895-C909 CovalentContact SG-SG 2.04Å; C895-C909 PolarHBondContact SG-SG 3.47Å; C909-I917 WeakPolarHBondContact O-CD1 3.41Å
910	S	85	Confident	81	Confident	15 Å²	15	84.8 Å²	84.8	11%	0.105	41%	0.405	C	S	.	.			trans	-52.9	153.8	165.7	172.5	0	0	0	0	110.9	D912 G913 F915	S910-D912 PolarHBondContact O-N 3.39Å; S910-D912 VanDerWaalsContact O-N 3.11Å; S910-D912 PolarHBondContact OG-N 3.44Å; S910-D912 PolarHBondContact OG-OD1 3.23Å; S910-D912 WeakPolarHBondContact CB-OD1 3.36Å; S910-G913 WeakPolarHBondContact O-CA 3.24Å; S910-G913 PolarHBondContact O-N 3.05Å; S910-F915 WeakPolarHBondContact OG-CE2 3.08Å; S910-F915 WeakPolarHBondContact OG-CZ 3.47Å; S910-F915 PolarHBondContact N-O 3.1Å; S910-F915 WeakPolarHBondContact CB-O 3.49Å; S910-F915 VanDerWaalsContact CB-O 3.28Å; S910-F915 VanDerWaalsContact CB-CD2 3.48Å
911	L	78.2	Confident	81.8	Confident	180 Å²	180	84.6 Å²	84.6	94%	0.942	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-35	175	-77.8	161.9	0	0	0	112.4
912	D	72.5	Confident	82.2	Confident	56 Å²	56	87.1 Å²	87.1	30%	0.299	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.5	177.9	72.3	-11	0	0	0	114.3	S910 K914 F915	S910-D912 PolarHBondContact O-N 3.39Å; S910-D912 VanDerWaalsContact O-N 3.11Å; S910-D912 PolarHBondContact OG-N 3.44Å; S910-D912 PolarHBondContact OG-OD1 3.23Å; S910-D912 WeakPolarHBondContact CB-OD1 3.36Å; D912-K914 HydrophobicContact CB-CG 4.45Å; D912-K914 PolarHBondContact O-N 3.22Å; D912-K914 PolarHBondContact OD1-N 3.14Å; D912-K914 VanDerWaalsContact OD1-N 3.15Å; D912-K914 WeakPolarHBondContact OD2-CD 3.47Å; D912-F915 WeakPolarHBondContact OD1-CE1 3.18Å; D912-F915 WeakPolarHBondContact OD2-CE1 3.27Å
913	G	72.2	Confident	81.9	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	41%	0.409	C	S	.	.	S	Bend	trans	67.7	10.5	178.3	0	0	0	0	0	115.1	S897 T901 S910	S897-G913 WeakPolarHBondContact OG-CA 3.38Å; S897-G913 PolarHBondContact OG-N 3.29Å; S897-G913 VanDerWaalsContact OG-N 3.09Å; T901-G913 VanDerWaalsContact CB-O 3.26Å; T901-G913 WeakPolarHBondContact CB-O 3.37Å; T901-G913 PolarHBondContact OG1-O 3.36Å; S910-G913 WeakPolarHBondContact O-CA 3.24Å; S910-G913 PolarHBondContact O-N 3.05Å
914	K	76.3	Confident	81.6	Confident	130 Å²	130	90.7 Å²	90.7	57%	0.565	43%	0.433	S	S	*	.	S	Bend	trans	-90.1	-22.8	-173.2	-68.4	-173.4	-171.9	167	0	114.6	D912	D912-K914 HydrophobicContact CB-CG 4.45Å; D912-K914 PolarHBondContact O-N 3.22Å; D912-K914 PolarHBondContact OD1-N 3.14Å; D912-K914 VanDerWaalsContact OD1-N 3.15Å; D912-K914 WeakPolarHBondContact OD2-CD 3.47Å
915	F	83.8	Confident	81.3	Confident	109 Å²	109	93.8 Å²	93.8	48%	0.478	44%	0.443	S	S	.	.	S	Bend	trans	-147.1	160.7	-176.2	42.8	-88.9	0	0	0	111.2	S910 D912 I917	S910-F915 WeakPolarHBondContact OG-CE2 3.08Å; S910-F915 WeakPolarHBondContact OG-CZ 3.47Å; S910-F915 PolarHBondContact N-O 3.1Å; S910-F915 WeakPolarHBondContact CB-O 3.49Å; S910-F915 VanDerWaalsContact CB-O 3.28Å; S910-F915 VanDerWaalsContact CB-CD2 3.48Å; D912-F915 WeakPolarHBondContact OD1-CE1 3.18Å; D912-F915 WeakPolarHBondContact OD2-CE1 3.27Å; F915-I917 HydrophobicContact CD2-CG2 4.39Å; F915-I917 HydrophobicContact CE2-CG2 4.43Å
916	C	87.6	Confident	81.1	Confident	39 Å²	39	93.1 Å²	93.1	26%	0.264	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.2	179.7	-58.7	0	0	0	0	110.5	C903 K907 D908	C903-C916 PolarHBondContact SG-SG 3.07Å; C903-C916 CovalentContact SG-SG 2.04Å; C903-C916 WeakPolarHBondContact SG-CB 3.28Å; C903-C916 WeakPolarHBondContact SG-CA 3.27Å; C903-C916 HydrophobicContact CB-CB 3.88Å; C903-C916 WeakPolarHBondContact CA-SG 3.49Å; C903-C916 WeakPolarHBondContact CB-SG 3.48Å; K907-C916 HydrophobicContact CB-CB 3.88Å; K907-C916 HydrophobicContact CD-CB 3.47Å; K907-C916 VanDerWaalsContact CD-CB 3.47Å; K907-C916 HydrophobicContact CG-CB 4.31Å; D908-C916 CarbonylContact O-C 3.33Å; D908-C916 VanDerWaalsContact O-CA 3.32Å; D908-C916 WeakPolarHBondContact O-CA 2.99Å
917	I	88.7	Confident	80.7	Confident	76 Å²	76	88.9 Å²	88.9	39%	0.39	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	145.1	174.9	36.7	174.3	0	0	0	109.8	K907 D908 C909 F915	K907-I917 WeakPolarHBondContact CB-O 3.36Å; K907-I917 VanDerWaalsContact CB-O 3.26Å; K907-I917 VanDerWaalsContact CA-O 3.3Å; K907-I917 WeakPolarHBondContact CA-O 3.36Å; K907-I917 CarbonylContact C-O 3.48Å; D908-I917 HydrophobicContact CB-CG1 4.15Å; D908-I917 PolarHBondContact O-N 2.68Å; D908-I917 WeakPolarHBondContact O-CG1 3.33Å; D908-I917 VanDerWaalsContact O-CG1 3.22Å; D908-I917 PolarHBondContact N-O 2.96Å; D908-I917 HydrophobicContact CB-CD1 4.48Å; C909-I917 WeakPolarHBondContact O-CD1 3.41Å; F915-I917 HydrophobicContact CD2-CG2 4.39Å; F915-I917 HydrophobicContact CE2-CG2 4.43Å
918	D	85.6	Confident	80	Confident	98 Å²	98	91.8 Å²	91.8	52%	0.524	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	144.8	174.6	-73.9	-45.2	0	0	0	110.5	K907 Y920	K907-D918 WeakPolarHBondContact CE-OD1 3.1Å; K907-D918 VanDerWaalsContact NZ-CG 3.32Å; K907-D918 IonicContact NZ-OD1 3.59Å; K907-D918 PolarHBondContact NZ-OD1 3.3Å; K907-D918 IonicContact NZ-OD2 2.65Å; K907-D918 PolarHBondContact NZ-OD2 3.12Å; D918-Y920 PolarHBondContact O-N 2.8Å
919	K	73.8	Confident	79.4	Confident	93 Å²	93	93.5 Å²	93.5	40%	0.404	45%	0.446	S	S	.	.			trans	-75.7	60.3	176	-80.6	-178.3	172.9	170.8	0	110.8	I905 D908	I905-K919 PolarHBondContact O-NZ 3.09Å; I905-K919 VanDerWaalsContact O-NZ 3.14Å; D908-K919 HydrophobicContact CB-CG 4.33Å; D908-K919 VanDerWaalsContact CG-CE 3.44Å; D908-K919 WeakPolarHBondContact OD1-CE 3.33Å; D908-K919 IonicContact OD1-NZ 3.89Å; D908-K919 WeakPolarHBondContact OD2-CG 3.05Å
920	Y	63.7	Low	78.8	Confident	291 Å²	291	98.8 Å²	98.8	100%	1.141	47%	0.465	S	S	*	.			trans	-149.8	0	179.9	-76.6	-73.5	0	0	0	112.5	D918	D918-Y920 PolarHBondContact O-N 2.8Å

Retrieved 920 of 920 residues in 490.7 ms (Link to these results)

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