A0A3Q0KSR6_SCHMA Loading...

Putative granulin

AlphaFold DB , UniProt , Accession A0A3Q0KSR6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 844 aa.

						>A0A3Q0KSR6_SCHMA|A0A3Q0KSR6
MLFVIYVLFLCRTGIVYSNLCPRQCLPGSCCEVEENDFRCCPYANGVCCSDGKNCCPQGTKCDMELGQCRSSNGAVLLSKHMSEKVIGDLKTSALDVVLRRLSANYIMCPDRLSVCQDNTTCCPMSGEIWGCCQHANAICCPDGEHCCPHGSVCDMVNHSCKPAKSNEIPEMKESFPTLHLVSASAPARLNPNVKPSKASRRKNIHQPSAKYLLAYSGVVCPDPLYECPDNTTCCSSSDEKWACCPIPQAVCCSDGEHCCPNGYTCDLSVGECIKNSHSSNESKKFSSNTILSSLPIKIGSNALCPDSDVYCSDNSTCCEHDKKWGCCLFPNAVCCSDGIHCCPQNTICDVQEEMCISKSGDMITKLQLKSTPKLHSFKSNSRINICSDMKSVCINGTCCSNVNDPLSTLCCPYENAVCCSDGKHCCPKGTTCDMINGGCIISQEGLSKSNSIPLLTKIRALHVTSKNNTQSIVFTQICPGGKAKCPDSSTCCKLSSGKYACCPIPNAICCADDIHCCPPGTSCDYKTLSCVKANNDHSIGSPSANELLRNPKLLFTGVRDHVCPGHQSTCSDDQTCCRLPDKSWGCCPLKNGVCCGDHFHCCPAGSVCDLDTKQCILQLELNQSTTKIVYDGFTMHIANRKSSDRLYSQPVKSISTIDASVQAKWCGACGDTWACCPDATFNSWSCCPYVGGECCIGQNICCPPGSRCLNNGKCEKISKNIMKSFAPTLIPSISKNNNLQKSYFIQQNNVKENFHIEMSNIAKPAQRNILLLVRHYRRLKRQLHTICPDSLHYCGKSEQCCLSNKFGYTCTPNKSICCGSNMDTYCPIYKDCSLDGKFCIDKY
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.7	Very low	47.9	Very low	193 Å²	193	129 Å²	129	95%	0.951	65%	0.651	S	S	*	*				0	-83.1	0	-61.8	-41.6	-169.3	0	0	112.6	F3 V4 I5	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.01Å; M1-V4 WeakPolarHBondContact O-CB 3.41Å; M1-V4 PolarHBondContact O-N 3.43Å; M1-I5 PolarHBondContact O-N 3.18Å
2	L	48.6	Very low	47.3	Very low	147 Å²	147	137.6 Å²	137.6	77%	0.77	67%	0.67	S	S	*	*	H	α-helix	trans	-48.3	-41.4	-173.4	-77.4	162	0	0	0	115.2	V4 I5 Y6	L2-V4 VanDerWaalsContact C-N 3.29Å; L2-V4 PolarHBondContact O-N 3.47Å; L2-I5 PolarHBondContact O-N 3.28Å; L2-Y6 PolarHBondContact O-N 3.15Å
3	F	48.4	Very low	46.8	Very low	174 Å²	174	133.5 Å²	133.5	76%	0.763	66%	0.659	S	S	*	*	H	α-helix	trans	-61.2	-32.8	177.8	-137.6	-93.1	0	0	0	113.9	M1 Y6 V7	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.01Å; F3-Y6 PolarHBondContact O-N 2.76Å; F3-V7 WeakPolarHBondContact O-CG2 3.31Å; F3-V7 PolarHBondContact O-N 3.15Å
4	V	53.5	Low	46	Very low	88 Å²	88	130 Å²	130	53%	0.533	67%	0.674	S	S	.	*	H	α-helix	trans	-73.3	-37.6	177.1	-175.5	0	0	0	0	110.6	M1 L2 Y6 V7 L8	M1-V4 WeakPolarHBondContact O-CB 3.41Å; M1-V4 PolarHBondContact O-N 3.43Å; L2-V4 VanDerWaalsContact C-N 3.29Å; L2-V4 PolarHBondContact O-N 3.47Å; V4-Y6 VanDerWaalsContact C-N 3.31Å; V4-Y6 PolarHBondContact O-N 3.22Å; V4-V7 PolarHBondContact O-N 2.74Å; V4-L8 HydrophobicContact CG1-CD1 4.18Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 2.74Å
5	I	55.8	Low	45.5	Very low	93 Å²	93	131 Å²	131	48%	0.477	68%	0.678	S	S	.	*	H	α-helix	trans	-64.7	-39	175.2	-58	173.8	0	0	0	110.2	M1 L2 L8 F9	M1-I5 PolarHBondContact O-N 3.18Å; L2-I5 PolarHBondContact O-N 3.28Å; I5-L8 PolarHBondContact O-N 2.77Å; I5-F9 HydrophobicContact CG2-CD2 4.11Å; I5-F9 HydrophobicContact CG2-CE2 4.4Å; I5-F9 PolarHBondContact O-N 3.43Å
6	Y	50.3	Low	44.7	Very low	165 Å²	165	128.4 Å²	128.4	65%	0.647	67%	0.67	S	S	*	*	H	α-helix	trans	-64.6	-43.3	176.9	-161.2	-96.1	0	0	0	112.5	L2 F3 V4 F9 L10	L2-Y6 PolarHBondContact O-N 3.15Å; F3-Y6 PolarHBondContact O-N 2.76Å; V4-Y6 VanDerWaalsContact C-N 3.31Å; V4-Y6 PolarHBondContact O-N 3.22Å; Y6-F9 PolarHBondContact O-N 2.84Å; Y6-L10 HydrophobicContact CD1-CD1 4.12Å; Y6-L10 HydrophobicContact CE1-CD1 3.98Å; Y6-L10 PolarHBondContact O-N 2.8Å
7	V	51.2	Low	44.2	Very low	83 Å²	83	131.9 Å²	131.9	50%	0.503	67%	0.674	S	S	.	*	H	α-helix	trans	-62.6	-43.5	174.6	172.5	0	0	0	0	111.3	F3 V4 F9 L10	F3-V7 WeakPolarHBondContact O-CG2 3.31Å; F3-V7 PolarHBondContact O-N 3.15Å; V4-V7 PolarHBondContact O-N 2.74Å; V7-F9 VanDerWaalsContact C-N 3.31Å; V7-F9 PolarHBondContact O-N 3.3Å; V7-L10 PolarHBondContact O-N 3.5Å
8	L	46.8	Very low	44.2	Very low	116 Å²	116	131.1 Å²	131.1	61%	0.607	68%	0.682	S	S	*	*	H	α-helix	trans	-67.2	-26.8	178.2	-71.6	170.8	0	0	0	113.8	V4 I5	V4-L8 HydrophobicContact CG1-CD1 4.18Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 2.74Å; I5-L8 PolarHBondContact O-N 2.77Å
9	F	44.8	Very low	44.6	Very low	156 Å²	156	131.9 Å²	131.9	68%	0.684	69%	0.687	S	S	*	*	H	α-helix	trans	-73.6	-31.7	176.1	-108.8	-91.5	0	0	0	113.3	I5 Y6 V7 C11 R12	I5-F9 HydrophobicContact CG2-CD2 4.11Å; I5-F9 HydrophobicContact CG2-CE2 4.4Å; I5-F9 PolarHBondContact O-N 3.43Å; Y6-F9 PolarHBondContact O-N 2.84Å; V7-F9 VanDerWaalsContact C-N 3.31Å; V7-F9 PolarHBondContact O-N 3.3Å; F9-C11 VanDerWaalsContact C-N 3.25Å; F9-C11 PolarHBondContact O-N 3.29Å; F9-R12 PolarHBondContact O-N 2.66Å
10	L	40.8	Very low	45.2	Very low	97 Å²	97	130.1 Å²	130.1	51%	0.508	68%	0.678	S	S	.	*	H	α-helix	trans	-69.9	-21.7	-180	-68.5	170.6	0	0	0	112.9	Y6 V7 R12 T13	Y6-L10 HydrophobicContact CD1-CD1 4.12Å; Y6-L10 HydrophobicContact CE1-CD1 3.98Å; Y6-L10 PolarHBondContact O-N 2.8Å; V7-L10 PolarHBondContact O-N 3.5Å; L10-R12 PolarHBondContact O-N 2.92Å; L10-T13 PolarHBondContact O-N 2.89Å; L10-T13 PolarHBondContact O-OG1 3.35Å
11	C	38.4	Very low	46	Very low	107 Å²	107	126.3 Å²	126.3	72%	0.723	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	4.7	174.4	-62	0	0	0	0	114.8	F9	F9-C11 VanDerWaalsContact C-N 3.25Å; F9-C11 PolarHBondContact O-N 3.29Å
12	R	40.2	Very low	46.6	Very low	232 Å²	232	118.2 Å²	118.2	88%	0.875	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	7.4	176.4	-75.6	-170.3	169	-164.2	-3.7	115.1	F9 L10	F9-R12 PolarHBondContact O-N 2.66Å; L10-R12 PolarHBondContact O-N 2.92Å
13	T	41.7	Very low	47.4	Very low	85 Å²	85	123.4 Å²	123.4	52%	0.521	63%	0.633	S	S	.	*	S	Bend	trans	-123	103.2	174.9	50.2	0	0	0	0	110.3	L10 I15	L10-T13 PolarHBondContact O-N 2.89Å; L10-T13 PolarHBondContact O-OG1 3.35Å; T13-I15 PolarHBondContact O-N 2.04Å
14	G	35.3	Very low	48.4	Very low	84 Å²	84	122 Å²	122	87%	0.866	63%	0.629	S	S	*	*			trans	-69	85	-174.4	0	0	0	0	0	113.9
15	I	38.6	Very low	49.4	Very low	145 Å²	145	118.8 Å²	118.8	74%	0.744	61%	0.61	S	S	*	*			trans	-104.2	85.9	171.7	-56.4	178	0	0	0	107.6	T13	T13-I15 PolarHBondContact O-N 2.04Å
16	V	32.2	Very low	50.1	Low	89 Å²	89	119.6 Å²	119.6	54%	0.539	61%	0.614	S	S	.	*			trans	-70.7	135.4	-176	177.1	0	0	0	0	111.1	S18 E32	V16-S18 PolarHBondContact O-N 3.02Å; V16-E32 VanDerWaalsContact CG1-OE2 3.26Å; V16-E32 WeakPolarHBondContact CG1-OE2 3.12Å; V16-E32 WeakPolarHBondContact CG2-OE2 3.04Å
17	Y	36.9	Very low	50.9	Low	189 Å²	189	117.2 Å²	117.2	74%	0.741	62%	0.619	S	S	*	*			trans	-69.2	118.1	174.7	-82	-106.8	0	0	0	110.5	N19	Y17-N19 PolarHBondContact O-N 3.18Å
18	S	43.4	Very low	52	Low	117 Å²	117	115.6 Å²	115.6	82%	0.818	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	15.9	-171.6	52	0	0	0	0	116.6	V16	V16-S18 PolarHBondContact O-N 3.02Å
19	N	51.4	Low	53.7	Low	146 Å²	146	110.2 Å²	110.2	78%	0.781	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	-7.8	-173.8	-71.1	-25.5	0	0	0	115.1	Y17	Y17-N19 PolarHBondContact O-N 3.18Å
20	L	57.2	Low	55.6	Low	96 Å²	96	104.7 Å²	104.7	50%	0.503	57%	0.572	S	S	.	*			trans	-91.5	-13.9	-177.8	-82.4	78.5	0	0	0	114.7	P22 F38	L20-P22 WeakPolarHBondContact O-CD 3.48Å; L20-F38 HydrophobicContact CB-CE1 4.47Å; L20-F38 HydrophobicContact CB-CE2 4.18Å; L20-F38 HydrophobicContact CB-CZ 3.72Å; L20-F38 HydrophobicContact CD2-CZ 4.36Å
21	C	62.5	Low	57.7	Low	51 Å²	51	100.2 Å²	100.2	35%	0.345	55%	0.549	S	S	.	.	S	Bend	trans	-67.3	127.2	-176.9	-177.6	0	0	0	0	112.4	C30	C21-C30 HydrophobicContact CB-CB 3.83Å; C21-C30 WeakPolarHBondContact CB-SG 3.41Å; C21-C30 WeakPolarHBondContact SG-CB 3.49Å; C21-C30 CovalentContact SG-SG 2.03Å; C21-C30 PolarHBondContact SG-SG 3.18Å
22	P	61.6	Low	59.8	Low	23 Å²	23	98.8 Å²	98.8	15%	0.149	53%	0.531	C	S	.	.			trans	-64.5	148.5	175.7	-20.9	33	0	0	0	112.7	L20 Q24 C25 F38 V86	L20-P22 WeakPolarHBondContact O-CD 3.48Å; P22-Q24 PolarHBondContact O-N 2.83Å; P22-C25 PolarHBondContact O-N 2.74Å; P22-F38 HydrophobicContact CG-CD2 4.48Å; P22-V86 HydrophobicContact CB-CG1 3.61Å; P22-V86 HydrophobicContact CG-CB 4.35Å; P22-V86 HydrophobicContact CG-CG1 3.75Å
23	R	63.9	Low	61.7	Low	255 Å²	255	89.9 Å²	89.9	96%	0.962	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	10	-176.6	-76	-169.3	169.2	-164.8	-0.7	116.2
24	Q	69.7	Low	63.4	Low	146 Å²	146	92.3 Å²	92.3	68%	0.682	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-23.6	179.6	-52.4	-173.6	18.1	0	0	112.2	P22 V86	P22-Q24 PolarHBondContact O-N 2.83Å; Q24-V86 HydrophobicContact CB-CG1 3.82Å; Q24-V86 HydrophobicContact CG-CG1 3.96Å
25	C	75.3	Confident	65.2	Low	19 Å²	19	96.4 Å²	96.4	13%	0.128	51%	0.505	C	S	.	.	S	Bend	trans	-83.9	156.2	175.1	-56.8	0	0	0	0	112.7	P22 C30 C40	P22-C25 PolarHBondContact O-N 2.74Å; C25-C30 HydrophobicContact CB-CB 4.41Å; C25-C40 WeakPolarHBondContact CA-SG 3.36Å; C25-C40 HydrophobicContact CB-CB 3.88Å; C25-C40 WeakPolarHBondContact CB-SG 3.38Å; C25-C40 WeakPolarHBondContact SG-CA 3.41Å; C25-C40 WeakPolarHBondContact SG-CB 3.09Å; C25-C40 CovalentContact SG-SG 2.05Å; C25-C40 PolarHBondContact SG-SG 2.82Å
26	L	71	Confident	66.6	Low	110 Å²	110	94 Å²	94	58%	0.576	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-67.1	152.1	169.2	-73.6	162.6	0	0	0	110.1	G28 S29	L26-G28 PolarHBondContact O-N 2.81Å; L26-S29 WeakPolarHBondContact CB-OG 3.32Å; L26-S29 PolarHBondContact N-OG 2.82Å; L26-S29 PolarHBondContact O-N 3.42Å; L26-S29 PolarHBondContact O-OG 3.05Å
27	P	66.7	Low	69	Low	115 Å²	115	90.1 Å²	90.1	75%	0.747	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	125.1	173.8	-25.6	35.1	0	0	0	111.2	S29	P27-S29 VanDerWaalsContact C-N 3.31Å; P27-S29 PolarHBondContact O-N 3.06Å
28	G	72.9	Confident	71.2	Confident	49 Å²	49	81.7 Å²	81.7	51%	0.505	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	10.9	-177.1	0	0	0	0	0	115.4	L26 N45	L26-G28 PolarHBondContact O-N 2.81Å; G28-N45 WeakPolarHBondContact O-CA 3.27Å; G28-N45 PolarHBondContact O-N 2.78Å
29	S	83.2	Confident	73.2	Confident	3 Å²	3	78.7 Å²	78.7	2%	0.021	41%	0.407	C	S	.	.			trans	-109.7	21.4	178.5	92.5	0	0	0	0	113.8	L26 P27 C40 C41	L26-S29 WeakPolarHBondContact CB-OG 3.32Å; L26-S29 PolarHBondContact N-OG 2.82Å; L26-S29 PolarHBondContact O-N 3.42Å; L26-S29 PolarHBondContact O-OG 3.05Å; P27-S29 VanDerWaalsContact C-N 3.31Å; P27-S29 PolarHBondContact O-N 3.06Å; S29-C40 CarbonylContact O-C 3.56Å; S29-C40 WeakPolarHBondContact O-CA 3.33Å; S29-C41 VanDerWaalsContact CB-O 3.32Å; S29-C41 WeakPolarHBondContact CB-O 3.49Å; S29-C41 WeakPolarHBondContact O-CB 3.39Å; S29-C41 PolarHBondContact O-N 2.8Å; S29-C41 PolarHBondContact OG-O 2.03Å
30	C	84.4	Confident	74.9	Confident	41 Å²	41	72.7 Å²	72.7	28%	0.277	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.7	-175	-154.1	0	0	0	0	111.3	C21 C25	C21-C30 HydrophobicContact CB-CB 3.83Å; C21-C30 WeakPolarHBondContact CB-SG 3.41Å; C21-C30 WeakPolarHBondContact SG-CB 3.49Å; C21-C30 CovalentContact SG-SG 2.03Å; C21-C30 PolarHBondContact SG-SG 3.18Å; C25-C30 HydrophobicContact CB-CB 4.41Å
31	C	84.7	Confident	76.3	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.02	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.9	177.1	-63	0	0	0	0	109.3	F38 R39 C48 M82	C31-F38 CarbonylContact O-C 3.41Å; C31-F38 WeakPolarHBondContact O-CA 3.03Å; C31-R39 PolarHBondContact N-O 3.22Å; C31-R39 PolarHBondContact O-N 3.35Å; C31-C48 WeakPolarHBondContact CA-SG 2.99Å; C31-C48 HydrophobicContact CB-CB 3.7Å; C31-C48 WeakPolarHBondContact CB-SG 3.47Å; C31-C48 WeakPolarHBondContact SG-CB 3.38Å; C31-C48 CovalentContact SG-SG 2.03Å; C31-C48 PolarHBondContact SG-SG 2.87Å; C31-M82 HydrophobicContact CB-CE 3.46Å; C31-M82 VanDerWaalsContact CB-CE 3.46Å; C31-M82 HydrophobicContact CB-SD 4.38Å
32	E	82.7	Confident	77.4	Confident	76 Å²	76	68.7 Å²	68.7	36%	0.355	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.8	164.8	-170.2	166.8	-161.3	0	0	108.1	V16 E34 D37 F38	V16-E32 VanDerWaalsContact CG1-OE2 3.26Å; V16-E32 WeakPolarHBondContact CG1-OE2 3.12Å; V16-E32 WeakPolarHBondContact CG2-OE2 3.04Å; E32-E34 WeakPolarHBondContact CG-O 3.3Å; E32-D37 WeakPolarHBondContact CA-O 3.39Å; E32-F38 HydrophobicContact CB-CD1 3.97Å; E32-F38 HydrophobicContact CB-CE1 3.84Å; E32-F38 HydrophobicContact CG-CD1 4.14Å; E32-F38 HydrophobicContact CG-CE1 3.72Å; E32-F38 HydrophobicContact CG-CZ 4.45Å
33	V	81	Confident	78.5	Confident	46 Å²	46	70.1 Å²	70.1	28%	0.279	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-44.9	-176.1	174.4	0	0	0	0	110.9	D37 R39 G52 M82	V33-D37 HydrophobicContact CB-CB 4.26Å; V33-D37 PolarHBondContact N-O 3.38Å; V33-R39 HydrophobicContact CG2-CB 4.44Å; V33-R39 HydrophobicContact CG2-CG 4.17Å; V33-G52 VanDerWaalsContact CG1-CA 3.49Å; V33-M82 HydrophobicContact CG2-CE 3.65Å
34	E	75.9	Confident	79	Confident	135 Å²	135	60.9 Å²	60.9	63%	0.631	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	169.9	172.2	-69.5	178.3	172.5	0	0	107.1	E32 N36 D37	E32-E34 WeakPolarHBondContact CG-O 3.3Å; E34-N36 PolarHBondContact O-N 3.33Å; E34-D37 HydrophobicContact CB-CB 4.02Å; E34-D37 PolarHBondContact O-N 2.88Å
35	E	74.9	Confident	79.3	Confident	171 Å²	171	57.1 Å²	57.1	80%	0.799	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	113.6	177.6	-173.6	172.5	-166.9	0	0	110.6
36	N	68.1	Low	79.7	Confident	93 Å²	93	57 Å²	57	50%	0.497	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	30.2	-170.1	-52	-76.4	0	0	0	115.5	E34 K85	E34-N36 PolarHBondContact O-N 3.33Å; N36-K85 WeakPolarHBondContact O-CE 3.11Å; N36-K85 PolarHBondContact O-NZ 2.79Å
37	D	81.3	Confident	80.5	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.043	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	89.3	159.5	-162.7	-31.9	0	0	0	110.5	E32 V33 E34 R39 K85	E32-D37 WeakPolarHBondContact CA-O 3.39Å; V33-D37 HydrophobicContact CB-CB 4.26Å; V33-D37 PolarHBondContact N-O 3.38Å; E34-D37 HydrophobicContact CB-CB 4.02Å; E34-D37 PolarHBondContact O-N 2.88Å; D37-R39 WeakPolarHBondContact OD1-CG 3.45Å; D37-R39 IonicContact OD1-CZ 3.59Å; D37-R39 IonicContact OD1-NE 2.81Å; D37-R39 PolarHBondContact OD1-NE 3.3Å; D37-R39 IonicContact OD1-NH2 3.52Å; D37-R39 IonicContact OD2-CZ 3.58Å; D37-R39 IonicContact OD2-NE 3.59Å; D37-R39 IonicContact OD2-NH2 2.74Å; D37-R39 PolarHBondContact OD2-NH2 2.87Å; D37-K85 HydrophobicContact CB-CD 4.32Å; D37-K85 VanDerWaalsContact CB-NZ 3.3Å; D37-K85 WeakPolarHBondContact OD1-CG 3.09Å; D37-K85 WeakPolarHBondContact OD2-CD 3.27Å; D37-K85 IonicContact OD2-NZ 3.73Å; D37-K85 PolarHBondContact OD2-NZ 2.96Å
38	F	83.3	Confident	81.6	Confident	13 Å²	13	51.4 Å²	51.4	6%	0.057	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134	174.8	-57.4	-69.2	0	0	0	110.4	L20 P22 C31 E32 V86	L20-F38 HydrophobicContact CB-CE1 4.47Å; L20-F38 HydrophobicContact CB-CE2 4.18Å; L20-F38 HydrophobicContact CB-CZ 3.72Å; L20-F38 HydrophobicContact CD2-CZ 4.36Å; P22-F38 HydrophobicContact CG-CD2 4.48Å; C31-F38 CarbonylContact O-C 3.41Å; C31-F38 WeakPolarHBondContact O-CA 3.03Å; E32-F38 HydrophobicContact CB-CD1 3.97Å; E32-F38 HydrophobicContact CB-CE1 3.84Å; E32-F38 HydrophobicContact CG-CD1 4.14Å; E32-F38 HydrophobicContact CG-CE1 3.72Å; E32-F38 HydrophobicContact CG-CZ 4.45Å; F38-V86 WeakPolarHBondContact O-CB 3.47Å; F38-V86 WeakPolarHBondContact O-CG2 3.03Å; F38-V86 PolarHBondContact O-N 3.3Å
39	R	86.2	Confident	82.3	Confident	53 Å²	53	49.7 Å²	49.7	20%	0.2	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.4	177.2	-61	-177.3	-162.8	177.3	-2.9	110.6	C31 V33 D37 G52 M82 S83	C31-R39 PolarHBondContact N-O 3.22Å; C31-R39 PolarHBondContact O-N 3.35Å; V33-R39 HydrophobicContact CG2-CB 4.44Å; V33-R39 HydrophobicContact CG2-CG 4.17Å; D37-R39 WeakPolarHBondContact OD1-CG 3.45Å; D37-R39 IonicContact OD1-CZ 3.59Å; D37-R39 IonicContact OD1-NE 2.81Å; D37-R39 PolarHBondContact OD1-NE 3.3Å; D37-R39 IonicContact OD1-NH2 3.52Å; D37-R39 IonicContact OD2-CZ 3.58Å; D37-R39 IonicContact OD2-NE 3.59Å; D37-R39 IonicContact OD2-NH2 2.74Å; D37-R39 PolarHBondContact OD2-NH2 2.87Å; R39-G52 PolarHBondContact NH1-O 3.18Å; R39-M82 HydrophobicContact CB-CB 4.3Å; R39-M82 HydrophobicContact CB-CE 3.61Å; R39-M82 HydrophobicContact CG-CE 4.44Å; R39-S83 WeakPolarHBondContact CD-O 3.45Å
40	C	87.4	Confident	82.2	Confident	20 Å²	20	55.1 Å²	55.1	14%	0.135	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.1	-179.5	-52.2	0	0	0	0	111.1	C25 S29 S83	C25-C40 WeakPolarHBondContact CA-SG 3.36Å; C25-C40 HydrophobicContact CB-CB 3.88Å; C25-C40 WeakPolarHBondContact CB-SG 3.38Å; C25-C40 WeakPolarHBondContact SG-CA 3.41Å; C25-C40 WeakPolarHBondContact SG-CB 3.09Å; C25-C40 CovalentContact SG-SG 2.05Å; C25-C40 PolarHBondContact SG-SG 2.82Å; S29-C40 CarbonylContact O-C 3.56Å; S29-C40 WeakPolarHBondContact O-CA 3.33Å; C40-S83 PolarHBondContact N-OG 2.73Å; C40-S83 PolarHBondContact O-N 3.22Å
41	C	86.6	Confident	82.1	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.02	31%	0.313	C	S	.	.			trans	-69.9	134.7	164.4	177.8	0	0	0	0	110.8	S29 Y43 C55	S29-C41 VanDerWaalsContact CB-O 3.32Å; S29-C41 WeakPolarHBondContact CB-O 3.49Å; S29-C41 WeakPolarHBondContact O-CB 3.39Å; S29-C41 PolarHBondContact O-N 2.8Å; S29-C41 PolarHBondContact OG-O 2.03Å; C41-Y43 PolarHBondContact O-N 2.87Å; C41-Y43 PolarHBondContact SG-N 2.86Å; C41-Y43 PolarHBondContact SG-O 3.42Å; C41-Y43 VanDerWaalsContact SG-O 3.37Å; C41-C55 HydrophobicContact CB-CB 3.66Å; C41-C55 WeakPolarHBondContact CB-SG 3Å; C41-C55 WeakPolarHBondContact SG-CB 3.01Å; C41-C55 CovalentContact SG-SG 2.02Å; C41-C55 PolarHBondContact SG-SG 3.05Å
42	P	85.1	Confident	81.8	Confident	61 Å²	61	56 Å²	56	40%	0.396	31%	0.314	S	S	.	.	S	Bend	trans	-72.8	-1.2	174.2	-22.7	36.4	0	0	0	115.5	K80 H81	P42-K80 HydrophobicContact CB-CB 4.2Å; P42-K80 HydrophobicContact CB-CD 3.81Å; P42-K80 HydrophobicContact CG-CB 3.93Å; P42-K80 HydrophobicContact CG-CD 4.4Å; P42-H81 WeakPolarHBondContact CG-O 3.32Å
43	Y	85.1	Confident	81.8	Confident	53 Å²	53	57.9 Å²	57.9	21%	0.208	32%	0.321	C	S	.	.	S	Bend	trans	-108.4	127.4	173.2	-61.2	-76.9	0	0	0	109.8	C41 N45 G46 C55 P57 L78 K80	C41-Y43 PolarHBondContact O-N 2.87Å; C41-Y43 PolarHBondContact SG-N 2.86Å; C41-Y43 PolarHBondContact SG-O 3.42Å; C41-Y43 VanDerWaalsContact SG-O 3.37Å; Y43-N45 PolarHBondContact O-N 2.02Å; Y43-G46 PolarHBondContact O-N 2.86Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; Y43-C55 WeakPolarHBondContact CE2-O 3.18Å; Y43-P57 HydrophobicContact CD1-CB 3.88Å; Y43-P57 HydrophobicContact CD2-CB 4.42Å; Y43-P57 HydrophobicContact CE1-CB 3.88Å; Y43-P57 HydrophobicContact CE1-CG 4.42Å; Y43-P57 HydrophobicContact CE2-CB 4.43Å; Y43-P57 HydrophobicContact CG-CB 4.15Å; Y43-L78 PolarHBondContact OH-O 3.22Å; Y43-K80 HydrophobicContact CD2-CD 4.46Å; Y43-K80 HydrophobicContact CE1-CD 4.22Å; Y43-K80 HydrophobicContact CE2-CB 3.87Å; Y43-K80 HydrophobicContact CE2-CD 3.76Å; Y43-K80 HydrophobicContact CE2-CG 3.72Å
44	A	73.1	Confident	82.1	Confident	60 Å²	60	57.3 Å²	57.3	50%	0.496	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	130.5	167.5	0	0	0	0	0	109.4	G46	A44-G46 PolarHBondContact O-N 2.97Å
45	N	77.1	Confident	82.8	Confident	67 Å²	67	50.9 Å²	50.9	36%	0.358	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	28.7	-171.1	-50.7	-33.3	0	0	0	114.2	G28 Y43 Q58	G28-N45 WeakPolarHBondContact O-CA 3.27Å; G28-N45 PolarHBondContact O-N 2.78Å; Y43-N45 PolarHBondContact O-N 2.02Å; N45-Q58 HydrophobicContact CB-CB 4.33Å; N45-Q58 VanDerWaalsContact CB-CD 3.42Å; N45-Q58 HydrophobicContact CB-CG 4.08Å; N45-Q58 PolarHBondContact ND2-OE1 3.33Å; N45-Q58 VanDerWaalsContact O-CB 3.23Å; N45-Q58 WeakPolarHBondContact O-CB 3.41Å; N45-Q58 WeakPolarHBondContact O-CG 3.46Å
46	G	84	Confident	83.5	Confident	16 Å²	16	42.7 Å²	42.7	17%	0.165	25%	0.248	C	C	.	.			trans	-65.2	159.8	177.6	0	0	0	0	0	113.8	Y43 A44 C56	Y43-G46 PolarHBondContact O-N 2.86Å; Y43-G46 VanDerWaalsContact O-N 3.1Å; A44-G46 PolarHBondContact O-N 2.97Å; G46-C56 CarbonylContact C-O 3.5Å; G46-C56 WeakPolarHBondContact CA-O 3.44Å
47	V	87.7	Confident	84.3	Confident	55 Å²	55	39.3 Å²	39.3	33%	0.333	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.6	176.2	-179.7	0	0	0	0	108.4	C55 C56	V47-C55 PolarHBondContact O-SG 3.35Å; V47-C56 HydrophobicContact CB-CB 4.32Å; V47-C56 PolarHBondContact N-O 3.34Å; V47-C56 PolarHBondContact O-N 3.4Å
48	C	88.5	Confident	84.4	Confident	54 Å²	54	45.1 Å²	45.1	37%	0.365	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	130.4	175.6	-49.6	0	0	0	0	110.4	C31	C31-C48 WeakPolarHBondContact CA-SG 2.99Å; C31-C48 HydrophobicContact CB-CB 3.7Å; C31-C48 WeakPolarHBondContact CB-SG 3.47Å; C31-C48 WeakPolarHBondContact SG-CB 3.38Å; C31-C48 CovalentContact SG-SG 2.03Å; C31-C48 PolarHBondContact SG-SG 2.87Å
49	C	87.2	Confident	84.4	Confident	12 Å²	12	47.2 Å²	47.2	8%	0.081	28%	0.283	C	S	.	.			trans	-88.1	152.7	175.8	-55	0	0	0	0	111.7	D51 G52 N54 C56 C62 M64	C49-D51 PolarHBondContact O-N 2.03Å; C49-G52 PolarHBondContact O-N 2.89Å; C49-N54 HydrophobicContact CB-CB 4.01Å; C49-N54 WeakPolarHBondContact CB-O 3.38Å; C49-N54 PolarHBondContact N-O 3.39Å; C49-N54 PolarHBondContact SG-O 3.37Å; C49-N54 VanDerWaalsContact SG-O 3.35Å; C49-C56 VanDerWaalsContact SG-SG 3.64Å; C49-C62 WeakPolarHBondContact CA-SG 3.37Å; C49-C62 HydrophobicContact CB-CB 3.69Å; C49-C62 WeakPolarHBondContact CB-SG 3.03Å; C49-C62 WeakPolarHBondContact SG-CB 2.98Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 2.84Å; C49-M64 HydrophobicContact CB-SD 4.25Å
50	S	82.8	Confident	84.5	Confident	118 Å²	118	45.2 Å²	45.2	83%	0.825	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-1	-174.9	-46.6	0	0	0	0	114.8
51	D	81.8	Confident	84.4	Confident	57 Å²	57	52.3 Å²	52.3	31%	0.305	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-8.6	175.4	62.4	8.1	0	0	0	113.4	C49 K53 N54 M64	C49-D51 PolarHBondContact O-N 2.03Å; D51-K53 PolarHBondContact O-N 3.49Å; D51-K53 VanDerWaalsContact O-N 3.15Å; D51-K53 PolarHBondContact OD1-N 2.81Å; D51-N54 PolarHBondContact OD1-N 2.84Å; D51-N54 WeakPolarHBondContact OD2-CB 3.4Å; D51-N54 PolarHBondContact OD2-ND2 3.36Å; D51-M64 HydrophobicContact CB-CE 3.9Å
52	G	78.2	Confident	84.5	Confident	4 Å²	4	53.8 Å²	53.8	4%	0.041	32%	0.315	C	S	.	.	S	Bend	trans	65.9	10.2	-176.4	0	0	0	0	0	115.2	V33 R39 C49	V33-G52 VanDerWaalsContact CG1-CA 3.49Å; R39-G52 PolarHBondContact NH1-O 3.18Å; C49-G52 PolarHBondContact O-N 2.89Å
53	K	83.4	Confident	84.4	Confident	117 Å²	117	52 Å²	52	51%	0.509	30%	0.302	S	S	.	.	S	Bend	trans	-121.6	-34.8	-174.3	-68.6	173.8	-175.2	176.7	0	111.6	D51 H81 M82	D51-K53 PolarHBondContact O-N 3.49Å; D51-K53 VanDerWaalsContact O-N 3.15Å; D51-K53 PolarHBondContact OD1-N 2.81Å; K53-H81 CarbonylContact O-C 3.59Å; K53-H81 VanDerWaalsContact O-CA 3.31Å; K53-H81 WeakPolarHBondContact O-CA 3.18Å; K53-M82 PolarHBondContact O-N 2.92Å
54	N	86.7	Confident	83.8	Confident	33 Å²	33	54.4 Å²	54.4	18%	0.176	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142	-177.5	-76.4	-67.3	0	0	0	111.8	C49 D51 S79 M82	C49-N54 HydrophobicContact CB-CB 4.01Å; C49-N54 WeakPolarHBondContact CB-O 3.38Å; C49-N54 PolarHBondContact N-O 3.39Å; C49-N54 PolarHBondContact SG-O 3.37Å; C49-N54 VanDerWaalsContact SG-O 3.35Å; D51-N54 PolarHBondContact OD1-N 2.84Å; D51-N54 WeakPolarHBondContact OD2-CB 3.4Å; D51-N54 PolarHBondContact OD2-ND2 3.36Å; N54-S79 WeakPolarHBondContact OD1-CB 3.13Å; N54-S79 PolarHBondContact OD1-OG 3.42Å; N54-M82 VanDerWaalsContact C-SD 3.54Å
55	C	89.4	Confident	83.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.1	166.5	-173.1	0	0	0	0	110.5	C41 Y43 V47 K80 M82	C41-C55 HydrophobicContact CB-CB 3.66Å; C41-C55 WeakPolarHBondContact CB-SG 3Å; C41-C55 WeakPolarHBondContact SG-CB 3.01Å; C41-C55 CovalentContact SG-SG 2.02Å; C41-C55 PolarHBondContact SG-SG 3.05Å; Y43-C55 WeakPolarHBondContact CE2-O 3.18Å; V47-C55 PolarHBondContact O-SG 3.35Å; C55-K80 PolarHBondContact N-O 3.19Å; C55-K80 PolarHBondContact O-N 2.77Å; C55-M82 HydrophobicContact CB-CG 3.71Å; C55-M82 HydrophobicContact CB-SD 4.12Å
56	C	89.7	Confident	83.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	155.3	-179.2	-77.2	0	0	0	0	111.9	G46 V47 C49 T60 C69	G46-C56 CarbonylContact C-O 3.5Å; G46-C56 WeakPolarHBondContact CA-O 3.44Å; V47-C56 HydrophobicContact CB-CB 4.32Å; V47-C56 PolarHBondContact N-O 3.34Å; V47-C56 PolarHBondContact O-N 3.4Å; C49-C56 VanDerWaalsContact SG-SG 3.64Å; C56-T60 WeakPolarHBondContact CB-OG1 3.39Å; C56-C69 WeakPolarHBondContact CA-SG 3.4Å; C56-C69 HydrophobicContact CB-CB 3.69Å; C56-C69 WeakPolarHBondContact CB-SG 3.26Å; C56-C69 VanDerWaalsContact SG-CA 3.56Å; C56-C69 WeakPolarHBondContact SG-CB 3.49Å; C56-C69 CovalentContact SG-SG 2.03Å; C56-C69 PolarHBondContact SG-SG 2.87Å
57	P	85.5	Confident	82.8	Confident	22 Å²	22	62.8 Å²	62.8	14%	0.143	35%	0.352	C	S	.	.			trans	-67.9	152.6	176.5	26.2	-31.9	0	0	0	112.3	Y43 G59 T60 L77	Y43-P57 HydrophobicContact CD1-CB 3.88Å; Y43-P57 HydrophobicContact CD2-CB 4.42Å; Y43-P57 HydrophobicContact CE1-CB 3.88Å; Y43-P57 HydrophobicContact CE1-CG 4.42Å; Y43-P57 HydrophobicContact CE2-CB 4.43Å; Y43-P57 HydrophobicContact CG-CB 4.15Å; P57-G59 PolarHBondContact O-N 3.39Å; P57-T60 HydrophobicContact CG-CG2 3.99Å; P57-T60 PolarHBondContact O-N 3.01Å; P57-T60 PolarHBondContact O-OG1 3.38Å; P57-L77 HydrophobicContact CG-CB 4.45Å; P57-L77 HydrophobicContact CG-CD1 3.93Å
58	Q	84.5	Confident	82.5	Confident	130 Å²	130	63.1 Å²	63.1	61%	0.607	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	129.9	179.7	-165.3	176.2	14.7	0	0	111.6	N45	N45-Q58 HydrophobicContact CB-CB 4.33Å; N45-Q58 VanDerWaalsContact CB-CD 3.42Å; N45-Q58 HydrophobicContact CB-CG 4.08Å; N45-Q58 PolarHBondContact ND2-OE1 3.33Å; N45-Q58 VanDerWaalsContact O-CB 3.23Å; N45-Q58 WeakPolarHBondContact O-CB 3.41Å; N45-Q58 WeakPolarHBondContact O-CG 3.46Å
59	G	82.7	Confident	82.4	Confident	56 Å²	56	60.5 Å²	60.5	58%	0.577	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	7.3	179.4	0	0	0	0	0	115.7	P57	P57-G59 PolarHBondContact O-N 3.39Å
60	T	88.2	Confident	82.4	Confident	12 Å²	12	66 Å²	66	7%	0.074	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	161.1	172.7	63.9	0	0	0	0	111.8	C56 P57 R70 L77	C56-T60 WeakPolarHBondContact CB-OG1 3.39Å; P57-T60 HydrophobicContact CG-CG2 3.99Å; P57-T60 PolarHBondContact O-N 3.01Å; P57-T60 PolarHBondContact O-OG1 3.38Å; T60-R70 WeakPolarHBondContact CA-O 3.2Å; T60-L77 HydrophobicContact CG2-CD1 3.99Å
61	K	85.5	Confident	82.3	Confident	168 Å²	168	61.8 Å²	61.8	73%	0.73	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	143.4	170.1	-72.2	-173.7	174.4	-174.6	0	110.4	D63 C69 R70	K61-D63 PolarHBondContact O-N 3.01Å; K61-C69 CarbonylContact O-C 3.42Å; K61-C69 WeakPolarHBondContact O-CA 3.32Å; K61-R70 PolarHBondContact N-O 3.48Å; K61-R70 PolarHBondContact O-N 3.06Å
62	C	87.2	Confident	82	Confident	34 Å²	34	64.9 Å²	64.9	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129	170	-56.4	0	0	0	0	110.6	C49 M64	C49-C62 WeakPolarHBondContact CA-SG 3.37Å; C49-C62 HydrophobicContact CB-CB 3.69Å; C49-C62 WeakPolarHBondContact CB-SG 3.03Å; C49-C62 WeakPolarHBondContact SG-CB 2.98Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 2.84Å; C62-M64 HydrophobicContact CB-SD 4.34Å
63	D	84.4	Confident	82	Confident	24 Å²	24	70.6 Å²	70.6	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	87.2	178.3	-160	-33.4	0	0	0	107.8	K61 E65 L66 G67 Q68 R70	K61-D63 PolarHBondContact O-N 3.01Å; D63-E65 VanDerWaalsContact C-N 3.25Å; D63-E65 PolarHBondContact O-N 3.4Å; D63-L66 PolarHBondContact O-N 3.19Å; D63-G67 PolarHBondContact O-N 3.02Å; D63-Q68 WeakPolarHBondContact CA-O 3.02Å; D63-Q68 HydrophobicContact CB-CB 4.27Å; D63-Q68 VanDerWaalsContact CB-O 3.31Å; D63-Q68 WeakPolarHBondContact CB-O 3.38Å; D63-Q68 PolarHBondContact N-O 3.38Å; D63-Q68 PolarHBondContact O-N 3.17Å; D63-R70 IonicContact OD2-CZ 3.14Å; D63-R70 IonicContact OD2-NE 2.8Å; D63-R70 PolarHBondContact OD2-NE 3.3Å; D63-R70 IonicContact OD2-NH2 2.66Å; D63-R70 PolarHBondContact OD2-NH2 3.11Å
64	M	72.3	Confident	81.7	Confident	103 Å²	103	67.5 Å²	67.5	51%	0.507	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.7	-165.3	-61.5	-73	-66.6	0	0	113.2	C49 D51 C62 L66	C49-M64 HydrophobicContact CB-SD 4.25Å; D51-M64 HydrophobicContact CB-CE 3.9Å; C62-M64 HydrophobicContact CB-SD 4.34Å; M64-L66 VanDerWaalsContact C-N 3.34Å
65	E	73.9	Confident	81.2	Confident	187 Å²	187	67.8 Å²	67.8	87%	0.874	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-24	178.6	-62	-175.8	162.1	0	0	112.4	D63	D63-E65 VanDerWaalsContact C-N 3.25Å; D63-E65 PolarHBondContact O-N 3.4Å
66	L	69.3	Low	80.8	Confident	95 Å²	95	71.9 Å²	71.9	50%	0.497	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-5.7	-174	-65.8	174.2	0	0	0	113.9	D63 M64 Q68	D63-L66 PolarHBondContact O-N 3.19Å; M64-L66 VanDerWaalsContact C-N 3.34Å; L66-Q68 VanDerWaalsContact C-N 3.25Å; L66-Q68 HydrophobicContact CB-CB 4.1Å; L66-Q68 HydrophobicContact CB-CG 4.12Å; L66-Q68 WeakPolarHBondContact O-CG 3.43Å; L66-Q68 PolarHBondContact O-N 3.49Å; L66-Q68 PolarHBondContact O-NE2 3.31Å
67	G	70.1	Confident	80.2	Confident	38 Å²	38	75.8 Å²	75.8	39%	0.392	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	29	-173.7	0	0	0	0	0	113	D63 S79	D63-G67 PolarHBondContact O-N 3.02Å; G67-S79 PolarHBondContact O-OG 3.49Å
68	Q	81.6	Confident	79.8	Confident	61 Å²	61	81.4 Å²	81.4	29%	0.285	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	167.1	-166.2	-78.5	165.7	26.5	0	0	112.3	D63 L66 V76	D63-Q68 WeakPolarHBondContact CA-O 3.02Å; D63-Q68 HydrophobicContact CB-CB 4.27Å; D63-Q68 VanDerWaalsContact CB-O 3.31Å; D63-Q68 WeakPolarHBondContact CB-O 3.38Å; D63-Q68 PolarHBondContact N-O 3.38Å; D63-Q68 PolarHBondContact O-N 3.17Å; L66-Q68 VanDerWaalsContact C-N 3.25Å; L66-Q68 HydrophobicContact CB-CB 4.1Å; L66-Q68 HydrophobicContact CB-CG 4.12Å; L66-Q68 WeakPolarHBondContact O-CG 3.43Å; L66-Q68 PolarHBondContact O-N 3.49Å; L66-Q68 PolarHBondContact O-NE2 3.31Å; Q68-V76 HydrophobicContact CB-CG1 4.1Å; Q68-V76 HydrophobicContact CG-CG1 3.89Å
69	C	86.8	Confident	79.7	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107	178.7	-56	0	0	0	0	109.3	C56 K61 L77 S79	C56-C69 WeakPolarHBondContact CA-SG 3.4Å; C56-C69 HydrophobicContact CB-CB 3.69Å; C56-C69 WeakPolarHBondContact CB-SG 3.26Å; C56-C69 VanDerWaalsContact SG-CA 3.56Å; C56-C69 WeakPolarHBondContact SG-CB 3.49Å; C56-C69 CovalentContact SG-SG 2.03Å; C56-C69 PolarHBondContact SG-SG 2.87Å; K61-C69 CarbonylContact O-C 3.42Å; K61-C69 WeakPolarHBondContact O-CA 3.32Å; C69-L77 HydrophobicContact CB-CB 4.08Å; C69-L77 WeakPolarHBondContact CB-O 3.25Å; C69-L77 PolarHBondContact N-O 2.96Å; C69-L77 PolarHBondContact O-N 3.07Å; C69-S79 WeakPolarHBondContact SG-CA 3.41Å
70	R	86.4	Confident	79.8	Confident	128 Å²	128	78.5 Å²	78.5	48%	0.483	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117.5	-177.1	-156.7	-175.5	-66.7	-148.3	4.6	110.5	T60 K61 D63	T60-R70 WeakPolarHBondContact CA-O 3.2Å; K61-R70 PolarHBondContact N-O 3.48Å; K61-R70 PolarHBondContact O-N 3.06Å; D63-R70 IonicContact OD2-CZ 3.14Å; D63-R70 IonicContact OD2-NE 2.8Å; D63-R70 PolarHBondContact OD2-NE 3.3Å; D63-R70 IonicContact OD2-NH2 2.66Å; D63-R70 PolarHBondContact OD2-NH2 3.11Å
71	S	81.3	Confident	79.6	Confident	28 Å²	28	84.2 Å²	84.2	20%	0.196	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	160.8	177.2	179	0	0	0	0	112.5	N73 G74 A75	S71-N73 WeakPolarHBondContact CB-OD1 3.06Å; S71-N73 PolarHBondContact O-N 2.64Å; S71-N73 PolarHBondContact OG-OD1 2.88Å; S71-G74 PolarHBondContact O-N 3.27Å; S71-A75 VanDerWaalsContact CB-O 3.27Å; S71-A75 WeakPolarHBondContact CB-O 3.42Å; S71-A75 PolarHBondContact N-O 3.23Å
72	S	75.9	Confident	79.4	Confident	123 Å²	123	76.6 Å²	76.6	86%	0.86	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21	177.2	58.3	0	0	0	0	114.2	G74	S72-G74 VanDerWaalsContact C-N 3.34Å
73	N	77.7	Confident	78.9	Confident	124 Å²	124	77.2 Å²	77.2	66%	0.663	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	11.9	171.5	69.2	-17.6	0	0	0	113.5	S71 A75	S71-N73 WeakPolarHBondContact CB-OD1 3.06Å; S71-N73 PolarHBondContact O-N 2.64Å; S71-N73 PolarHBondContact OG-OD1 2.88Å; N73-A75 PolarHBondContact O-N 2.92Å; N73-A75 VanDerWaalsContact OD1-CB 3.25Å; N73-A75 WeakPolarHBondContact OD1-CB 3.33Å; N73-A75 PolarHBondContact OD1-N 3.34Å
74	G	76.6	Confident	78.5	Confident	51 Å²	51	84.4 Å²	84.4	53%	0.526	46%	0.462	S	S	.	.	S	Bend	trans	77.6	-3.7	-177.4	0	0	0	0	0	115.1	S71 S72 V76	S71-G74 PolarHBondContact O-N 3.27Å; S72-G74 VanDerWaalsContact C-N 3.34Å; G74-V76 PolarHBondContact O-N 3.11Å
75	A	77.3	Confident	78.7	Confident	40 Å²	40	84.3 Å²	84.3	33%	0.331	46%	0.459	S	S	.	.			trans	-63.9	128.7	177.9	0	0	0	0	0	111.1	S71 N73	S71-A75 VanDerWaalsContact CB-O 3.27Å; S71-A75 WeakPolarHBondContact CB-O 3.42Å; S71-A75 PolarHBondContact N-O 3.23Å; N73-A75 PolarHBondContact O-N 2.92Å; N73-A75 VanDerWaalsContact OD1-CB 3.25Å; N73-A75 WeakPolarHBondContact OD1-CB 3.33Å; N73-A75 PolarHBondContact OD1-N 3.34Å
76	V	81	Confident	78.3	Confident	85 Å²	85	75.8 Å²	75.8	52%	0.515	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	128.8	172.7	171.5	0	0	0	0	108.8	Q68 G74	Q68-V76 HydrophobicContact CB-CG1 4.1Å; Q68-V76 HydrophobicContact CG-CG1 3.89Å; G74-V76 PolarHBondContact O-N 3.11Å
77	L	76.7	Confident	77.7	Confident	82 Å²	82	77 Å²	77	43%	0.429	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	148.9	173.8	-72	164.6	0	0	0	109.1	P57 T60 C69	P57-L77 HydrophobicContact CG-CB 4.45Å; P57-L77 HydrophobicContact CG-CD1 3.93Å; T60-L77 HydrophobicContact CG2-CD1 3.99Å; C69-L77 HydrophobicContact CB-CB 4.08Å; C69-L77 WeakPolarHBondContact CB-O 3.25Å; C69-L77 PolarHBondContact N-O 2.96Å; C69-L77 PolarHBondContact O-N 3.07Å
78	L	77.2	Confident	76.8	Confident	141 Å²	141	77.8 Å²	77.8	74%	0.738	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	138.4	172.8	-76.4	157.1	0	0	0	109.9	Y43	Y43-L78 PolarHBondContact OH-O 3.22Å
79	S	81.5	Confident	74.5	Confident	26 Å²	26	82.8 Å²	82.8	18%	0.182	46%	0.462	C	S	.	.			trans	-66.4	162.6	162.1	61.4	0	0	0	0	110.2	N54 G67 C69	N54-S79 WeakPolarHBondContact OD1-CB 3.13Å; N54-S79 PolarHBondContact OD1-OG 3.42Å; G67-S79 PolarHBondContact O-OG 3.49Å; C69-S79 WeakPolarHBondContact SG-CA 3.41Å
80	K	84.1	Confident	72.1	Confident	99 Å²	99	89.7 Å²	89.7	43%	0.43	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142	164.1	-72.8	-176.5	177.9	-174.6	0	109.9	P42 Y43 C55 M82	P42-K80 HydrophobicContact CB-CB 4.2Å; P42-K80 HydrophobicContact CB-CD 3.81Å; P42-K80 HydrophobicContact CG-CB 3.93Å; P42-K80 HydrophobicContact CG-CD 4.4Å; Y43-K80 HydrophobicContact CD2-CD 4.46Å; Y43-K80 HydrophobicContact CE1-CD 4.22Å; Y43-K80 HydrophobicContact CE2-CB 3.87Å; Y43-K80 HydrophobicContact CE2-CD 3.76Å; Y43-K80 HydrophobicContact CE2-CG 3.72Å; C55-K80 PolarHBondContact N-O 3.19Å; C55-K80 PolarHBondContact O-N 2.77Å; K80-M82 PolarHBondContact O-N 2.71Å
81	H	84.6	Confident	69.6	Low	131 Å²	131	92.4 Å²	92.4	61%	0.606	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	132.8	173.4	-144.8	-79.7	0	0	0	109.9	P42 K53	P42-H81 WeakPolarHBondContact CG-O 3.32Å; K53-H81 CarbonylContact O-C 3.59Å; K53-H81 VanDerWaalsContact O-CA 3.31Å; K53-H81 WeakPolarHBondContact O-CA 3.18Å
82	M	80.9	Confident	67.2	Low	9 Å²	9	97.7 Å²	97.7	4%	0.044	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-70.9	158.1	172.4	-71	162	48.5	0	0	110	C31 V33 R39 K53 N54 C55 K80	C31-M82 HydrophobicContact CB-CE 3.46Å; C31-M82 VanDerWaalsContact CB-CE 3.46Å; C31-M82 HydrophobicContact CB-SD 4.38Å; V33-M82 HydrophobicContact CG2-CE 3.65Å; R39-M82 HydrophobicContact CB-CB 4.3Å; R39-M82 HydrophobicContact CB-CE 3.61Å; R39-M82 HydrophobicContact CG-CE 4.44Å; K53-M82 PolarHBondContact O-N 2.92Å; N54-M82 VanDerWaalsContact C-SD 3.54Å; C55-M82 HydrophobicContact CB-CG 3.71Å; C55-M82 HydrophobicContact CB-SD 4.12Å; K80-M82 PolarHBondContact O-N 2.71Å
83	S	78	Confident	65.6	Low	46 Å²	46	97.2 Å²	97.2	32%	0.322	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-60.4	165.7	173.5	75.9	0	0	0	0	111.9	R39 C40	R39-S83 WeakPolarHBondContact CD-O 3.45Å; C40-S83 PolarHBondContact N-OG 2.73Å; C40-S83 PolarHBondContact O-N 3.22Å
84	E	74.9	Confident	63.5	Low	176 Å²	176	95.8 Å²	95.8	82%	0.822	55%	0.546	S	S	*	.	S	Bend	trans	-60.4	167.6	161.9	-59.3	-173.6	162.7	0	0	111.6	V86	E84-V86 PolarHBondContact O-N 3.34Å
85	K	76.4	Confident	61.8	Low	100 Å²	100	100.1 Å²	100.1	44%	0.435	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-60	120.9	-176	179.8	168.5	-171.2	140.2	0	111.4	N36 D37 I87	N36-K85 WeakPolarHBondContact O-CE 3.11Å; N36-K85 PolarHBondContact O-NZ 2.79Å; D37-K85 HydrophobicContact CB-CD 4.32Å; D37-K85 VanDerWaalsContact CB-NZ 3.3Å; D37-K85 WeakPolarHBondContact OD1-CG 3.09Å; D37-K85 WeakPolarHBondContact OD2-CD 3.27Å; D37-K85 IonicContact OD2-NZ 3.73Å; D37-K85 PolarHBondContact OD2-NZ 2.96Å; K85-I87 PolarHBondContact O-N 3.23Å
86	V	66.8	Low	59.9	Low	8 Å²	8	105.5 Å²	105.5	5%	0.048	58%	0.58	C	S	.	*			trans	-84.8	102	-179.4	-170.8	0	0	0	0	108.8	P22 Q24 F38 E84 G88	P22-V86 HydrophobicContact CB-CG1 3.61Å; P22-V86 HydrophobicContact CG-CB 4.35Å; P22-V86 HydrophobicContact CG-CG1 3.75Å; Q24-V86 HydrophobicContact CB-CG1 3.82Å; Q24-V86 HydrophobicContact CG-CG1 3.96Å; F38-V86 WeakPolarHBondContact O-CB 3.47Å; F38-V86 WeakPolarHBondContact O-CG2 3.03Å; F38-V86 PolarHBondContact O-N 3.3Å; E84-V86 PolarHBondContact O-N 3.34Å; V86-G88 PolarHBondContact O-N 3.1Å
87	I	56.9	Low	58.1	Low	121 Å²	121	105.8 Å²	105.8	62%	0.621	58%	0.582	S	S	*	*			trans	-70.8	128.5	-175.8	-57.1	173.7	0	0	0	110.4	K85	K85-I87 PolarHBondContact O-N 3.23Å
88	G	49.3	Very low	56.2	Low	54 Å²	54	107.2 Å²	107.2	56%	0.557	59%	0.594	S	S	*	*			trans	-77.9	121.7	171.4	0	0	0	0	0	112.1	V86 L90	V86-G88 PolarHBondContact O-N 3.1Å; G88-L90 PolarHBondContact O-N 3.37Å
89	D	33.6	Very low	54.5	Low	166 Å²	166	106.5 Å²	106.5	89%	0.888	59%	0.59	S	S	*	*	S	Bend	trans	28.3	65.5	164.4	-67.3	-15	0	0	0	118.4
90	L	36.7	Very low	52.7	Low	145 Å²	145	116.1 Å²	116.1	76%	0.759	62%	0.622	S	S	*	*			trans	-144.2	126.9	154.4	-141.5	73.4	0	0	0	113.6	G88	G88-L90 PolarHBondContact O-N 3.37Å
91	K	33.3	Very low	50.6	Low	185 Å²	185	118.8 Å²	118.8	80%	0.804	63%	0.63	S	S	*	*			trans	10.6	130.8	162.5	-62.9	173.6	-179.4	173.3	0	120.3
92	T	32.6	Very low	48.5	Very low	139 Å²	139	117.3 Å²	117.3	85%	0.853	63%	0.626	S	S	*	*			trans	63.3	107.5	145.1	53.4	0	0	0	0	120.6
93	S	41	Very low	46.8	Very low	114 Å²	114	120 Å²	120	80%	0.797	65%	0.646	S	S	*	*				-148.1	170	112.1	87	0	0	0	0	109.2
94	A	34.5	Very low	45.5	Very low	93 Å²	93	122.3 Å²	122.3	77%	0.769	67%	0.667	S	S	*	*			trans	-122.7	24.4	-155.5	0	0	0	0	0	116.7
95	L	40.8	Very low	45	Very low	142 Å²	142	119 Å²	119	74%	0.743	66%	0.656	S	S	*	*	S	Bend	trans	-103.7	-48.6	-170.1	-128.7	67.1	0	0	0	115.8	V97 V98	L95-V97 PolarHBondContact O-N 3.41Å; L95-V98 WeakPolarHBondContact O-CG2 2.93Å
96	D	37.1	Very low	44.7	Very low	153 Å²	153	118.7 Å²	118.7	82%	0.818	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-3.6	-162.2	-59	-67.5	0	0	0	116.9
97	V	42.5	Very low	45	Very low	92 Å²	92	121.6 Å²	121.6	56%	0.558	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-5	-173.7	-172.6	0	0	0	0	112.9	L95 L99	L95-V97 PolarHBondContact O-N 3.41Å; V97-L99 PolarHBondContact O-N 3.21Å
98	V	37.3	Very low	46.1	Very low	111 Å²	111	120.1 Å²	120.1	67%	0.673	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-67.2	-32.5	-164.2	177.7	0	0	0	0	114.3	L95 R100	L95-V98 WeakPolarHBondContact O-CG2 2.93Å; V98-R100 PolarHBondContact O-N 3.32Å
99	L	41.8	Very low	47.8	Very low	126 Å²	126	117.7 Å²	117.7	66%	0.66	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-78.2	0.4	-166	-102.8	80.1	0	0	0	117.7	V97	V97-L99 PolarHBondContact O-N 3.21Å
100	R	42.9	Very low	50	Low	229 Å²	229	114.1 Å²	114.1	86%	0.864	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-123.1	10.6	-162.1	-65.6	-166.7	-177.5	-177.3	4.8	118.4	V98	V98-R100 PolarHBondContact O-N 3.32Å
101	R	41.8	Very low	52	Low	154 Å²	154	109.1 Å²	109.1	58%	0.581	59%	0.593	S	S	*	*			trans	-138	48.4	-176.8	-59.9	-166.8	-164.7	-138.7	-1	115.8	E621	R101-E621 IonicContact CZ-OE2 2.64Å; R101-E621 PolarHBondContact NH1-O 2.7Å; R101-E621 IonicContact NH1-OE2 2.78Å; R101-E621 IonicContact NH2-OE2 3.53Å; R101-E621 PolarHBondContact NH2-OE2 2.72Å
102	L	40.5	Very low	53.9	Low	101 Å²	101	108.9 Å²	108.9	53%	0.529	59%	0.587	S	S	.	*			trans	-72	141.8	155.9	-76.6	167.1	0	0	0	109.6	Y106 V115	L102-Y106 HydrophobicContact CB-CD2 4.08Å; L102-Y106 HydrophobicContact CB-CG 4.19Å; L102-Y106 HydrophobicContact CD2-CD2 4.13Å; L102-Y106 HydrophobicContact CD2-CE2 4.08Å; L102-Y106 HydrophobicContact CD2-CG 4.49Å; L102-V115 HydrophobicContact CD1-CB 4.01Å; L102-V115 HydrophobicContact CD1-CG1 3.54Å; L102-V115 HydrophobicContact CD1-CG2 4.08Å
103	S	44.3	Very low	55.9	Low	66 Å²	66	109.1 Å²	109.1	46%	0.462	58%	0.582	S	S	.	*			trans	-71.6	167.6	-173.4	52.1	0	0	0	0	112.9	N105 Y106	S103-N105 PolarHBondContact O-N 3.37Å; S103-Y106 PolarHBondContact O-N 2.05Å
104	A	51.6	Low	57.8	Low	94 Å²	94	105 Å²	105	78%	0.777	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	68.1	164.6	0	0	0	0	0	111.4
105	N	64.2	Low	60	Low	107 Å²	107	102.7 Å²	102.7	57%	0.572	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.7	17.7	167.5	-88.1	-13.6	0	0	0	107.9	S103 Q117 D118	S103-N105 PolarHBondContact O-N 3.37Å; N105-Q117 CarbonylContact O-C 3.57Å; N105-Q117 WeakPolarHBondContact O-CA 3.38Å; N105-D118 VanDerWaalsContact CA-CG 3.44Å; N105-D118 WeakPolarHBondContact CA-OD2 3.42Å; N105-D118 PolarHBondContact N-OD2 3.01Å; N105-D118 VanDerWaalsContact N-OD2 3.07Å; N105-D118 PolarHBondContact O-N 3.39Å
106	Y	68.4	Low	62.1	Low	93 Å²	93	96 Å²	96	37%	0.365	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	135.4	-171.1	-67.9	-84	0	0	0	113.3	L102 S103 V115 C116 Q117 D118	L102-Y106 HydrophobicContact CB-CD2 4.08Å; L102-Y106 HydrophobicContact CB-CG 4.19Å; L102-Y106 HydrophobicContact CD2-CD2 4.13Å; L102-Y106 HydrophobicContact CD2-CE2 4.08Å; L102-Y106 HydrophobicContact CD2-CG 4.49Å; S103-Y106 PolarHBondContact O-N 2.05Å; Y106-V115 HydrophobicContact CD1-CG1 4.11Å; Y106-V115 HydrophobicContact CG-CG1 4.35Å; Y106-C116 CarbonylContact C-O 3.45Å; Y106-C116 WeakPolarHBondContact CA-O 3.29Å; Y106-C116 WeakPolarHBondContact CB-O 3.2Å; Y106-C116 WeakPolarHBondContact CD1-O 3.4Å; Y106-Q117 HydrophobicContact CD1-CG 4.2Å; Y106-Q117 HydrophobicContact CE1-CG 3.88Å; Y106-D118 WeakPolarHBondContact CA-OD1 3.45Å; Y106-D118 PolarHBondContact N-OD1 3.15Å; Y106-D118 PolarHBondContact N-OD2 3.07Å
107	I	74.7	Confident	64.1	Low	68 Å²	68	94.3 Å²	94.3	35%	0.349	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119	176.4	-58.8	170.5	0	0	0	108.8	C116 D118 T120	I107-C116 PolarHBondContact N-O 3.44Å; I107-C116 PolarHBondContact O-N 2.97Å; I107-D118 WeakPolarHBondContact CG1-OD1 3.44Å; I107-T120 WeakPolarHBondContact CD1-O 3.44Å
108	M	79.5	Confident	65.1	Low	91 Å²	91	93.2 Å²	93.2	45%	0.448	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	131.6	169	-85	-97	175.2	0	0	110.4	V115	M108-V115 HydrophobicContact CE-CG2 3.65Å; M108-V115 HydrophobicContact CG-CG2 4.26Å; M108-V115 HydrophobicContact SD-CG2 3.72Å
109	C	83.9	Confident	66.7	Low	3 Å²	3	93.8 Å²	93.8	2%	0.02	47%	0.472	C	S	.	.			trans	-79.3	160.8	174.8	-56.4	0	0	0	0	111.9	D111 R112 S114 C116 C122 W130	C109-D111 PolarHBondContact O-N 2.88Å; C109-D111 VanDerWaalsContact O-N 3.16Å; C109-R112 PolarHBondContact O-N 3.5Å; C109-S114 WeakPolarHBondContact CB-O 3.46Å; C109-S114 PolarHBondContact N-O 2.92Å; C109-C116 PolarHBondContact SG-SG 2.96Å; C109-C122 WeakPolarHBondContact CA-SG 3.4Å; C109-C122 HydrophobicContact CB-CB 3.77Å; C109-C122 WeakPolarHBondContact CB-SG 3.43Å; C109-C122 WeakPolarHBondContact SG-CB 3.02Å; C109-C122 CovalentContact SG-SG 2.05Å; C109-C122 PolarHBondContact SG-SG 2.85Å; C109-W130 HydrophobicContact CB-CB 3.59Å; C109-W130 HydrophobicContact CB-CD2 4.23Å; C109-W130 HydrophobicContact CB-CE3 4.38Å; C109-W130 HydrophobicContact CB-CG 3.92Å
110	P	79.8	Confident	68.8	Low	91 Å²	91	88.8 Å²	88.8	59%	0.591	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.2	-177	-31.2	39.1	0	0	0	116.3	R112 W130	P110-R112 PolarHBondContact O-N 2.03Å; P110-W130 HydrophobicContact CB-CH2 4.32Å; P110-W130 HydrophobicContact CB-CZ2 3.78Å; P110-W130 HydrophobicContact CG-CD2 4.37Å; P110-W130 HydrophobicContact CG-CE3 4.39Å; P110-W130 HydrophobicContact CG-CH2 3.65Å; P110-W130 HydrophobicContact CG-CZ2 3.62Å; P110-W130 HydrophobicContact CG-CZ3 4.04Å
111	D	80	Confident	71	Confident	40 Å²	40	79.1 Å²	79.1	21%	0.214	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.3	172	61	13.7	0	0	0	113.9	C109 L113 S114 W130	C109-D111 PolarHBondContact O-N 2.88Å; C109-D111 VanDerWaalsContact O-N 3.16Å; D111-L113 HydrophobicContact CB-CB 4.43Å; D111-L113 PolarHBondContact O-N 2.9Å; D111-L113 PolarHBondContact OD1-N 3.21Å; D111-S114 PolarHBondContact OD1-N 3.23Å; D111-W130 HydrophobicContact CB-CG 4.46Å; D111-W130 VanDerWaalsContact CG-CD1 3.49Å; D111-W130 WeakPolarHBondContact OD2-CB 3.45Å; D111-W130 VanDerWaalsContact OD2-CD1 3.29Å; D111-W130 PolarHBondContact OD2-N 2.03Å; D111-W130 VanDerWaalsContact OD2-N 3.11Å
112	R	72.7	Confident	73.3	Confident	180 Å²	180	72.7 Å²	72.7	68%	0.679	39%	0.392	S	S	*	.	S	Bend	trans	59.7	18	-171.1	-48.4	178.8	179.4	-174.9	-0.8	114.2	C109 P110	C109-R112 PolarHBondContact O-N 3.5Å; P110-R112 PolarHBondContact O-N 2.03Å
113	L	75.7	Confident	75.7	Confident	144 Å²	144	68.2 Å²	68.2	75%	0.754	37%	0.368	S	S	*	.	S	Bend	trans	-105.8	-42.5	174.4	-62.5	176	0	0	0	110	D111	D111-L113 HydrophobicContact CB-CB 4.43Å; D111-L113 PolarHBondContact O-N 2.9Å; D111-L113 PolarHBondContact OD1-N 3.21Å
114	S	79.6	Confident	77.7	Confident	27 Å²	27	68.2 Å²	68.2	19%	0.189	37%	0.367	C	S	.	.			trans	-93	142.9	178	-77.7	0	0	0	0	112.5	C109 D111 W130	C109-S114 WeakPolarHBondContact CB-O 3.46Å; C109-S114 PolarHBondContact N-O 2.92Å; D111-S114 PolarHBondContact OD1-N 3.23Å; S114-W130 WeakPolarHBondContact CB-O 3.27Å; S114-W130 PolarHBondContact OG-O 3.42Å
115	V	80.2	Confident	79	Confident	44 Å²	44	68.2 Å²	68.2	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.2	-179	-171.7	0	0	0	0	109.9	L102 Y106 M108	L102-V115 HydrophobicContact CD1-CB 4.01Å; L102-V115 HydrophobicContact CD1-CG1 3.54Å; L102-V115 HydrophobicContact CD1-CG2 4.08Å; Y106-V115 HydrophobicContact CD1-CG1 4.11Å; Y106-V115 HydrophobicContact CG-CG1 4.35Å; M108-V115 HydrophobicContact CE-CG2 3.65Å; M108-V115 HydrophobicContact CG-CG2 4.26Å; M108-V115 HydrophobicContact SD-CG2 3.72Å
116	C	84.8	Confident	79.4	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.02	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	168.7	-178.6	-53.2	0	0	0	0	110.5	Y106 I107 C109 T120 C132	Y106-C116 CarbonylContact C-O 3.45Å; Y106-C116 WeakPolarHBondContact CA-O 3.29Å; Y106-C116 WeakPolarHBondContact CB-O 3.2Å; Y106-C116 WeakPolarHBondContact CD1-O 3.4Å; I107-C116 PolarHBondContact N-O 3.44Å; I107-C116 PolarHBondContact O-N 2.97Å; C109-C116 PolarHBondContact SG-SG 2.96Å; C116-T120 VanDerWaalsContact CB-OG1 3.27Å; C116-T120 WeakPolarHBondContact CB-OG1 2.99Å; C116-C132 WeakPolarHBondContact CA-SG 3.42Å; C116-C132 HydrophobicContact CB-CB 3.65Å; C116-C132 WeakPolarHBondContact CB-SG 3.47Å; C116-C132 WeakPolarHBondContact SG-CA 3.35Å; C116-C132 WeakPolarHBondContact SG-CB 3.31Å; C116-C132 CovalentContact SG-SG 2.03Å; C116-C132 PolarHBondContact SG-SG 3.1Å
117	Q	80.3	Confident	79.5	Confident	117 Å²	117	66 Å²	66	55%	0.547	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	152.9	178.5	-68.8	176.7	-9.7	0	0	111.3	N105 Y106 N119 T120	N105-Q117 CarbonylContact O-C 3.57Å; N105-Q117 WeakPolarHBondContact O-CA 3.38Å; Y106-Q117 HydrophobicContact CD1-CG 4.2Å; Y106-Q117 HydrophobicContact CE1-CG 3.88Å; Q117-N119 PolarHBondContact O-N 2.61Å; Q117-T120 HydrophobicContact CB-CG2 4.08Å; Q117-T120 PolarHBondContact N-OG1 3.05Å; Q117-T120 WeakPolarHBondContact O-CB 3.33Å; Q117-T120 PolarHBondContact O-N 3.31Å; Q117-T120 PolarHBondContact O-OG1 3.19Å
118	D	62.9	Low	79	Confident	69 Å²	69	71.8 Å²	71.8	37%	0.369	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	137.8	165.6	-74.6	-6.9	0	0	0	108.2	N105 Y106 I107	N105-D118 VanDerWaalsContact CA-CG 3.44Å; N105-D118 WeakPolarHBondContact CA-OD2 3.42Å; N105-D118 PolarHBondContact N-OD2 3.01Å; N105-D118 VanDerWaalsContact N-OD2 3.07Å; N105-D118 PolarHBondContact O-N 3.39Å; Y106-D118 WeakPolarHBondContact CA-OD1 3.45Å; Y106-D118 PolarHBondContact N-OD1 3.15Å; Y106-D118 PolarHBondContact N-OD2 3.07Å; I107-D118 WeakPolarHBondContact CG1-OD1 3.44Å
119	N	71.8	Confident	78.8	Confident	123 Å²	123	72 Å²	72	66%	0.658	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	18.4	-167.6	-154	84.8	0	0	0	115.5	Q117 A136	Q117-N119 PolarHBondContact O-N 2.61Å; N119-A136 PolarHBondContact O-N 3.25Å
120	T	85.3	Confident	79	Confident	21 Å²	21	75.2 Å²	75.2	13%	0.129	41%	0.408	C	S	.	.	S	Bend	trans	-121	171.9	162.5	65.9	0	0	0	0	110.4	I107 C116 Q117 C133	I107-T120 WeakPolarHBondContact CD1-O 3.44Å; C116-T120 VanDerWaalsContact CB-OG1 3.27Å; C116-T120 WeakPolarHBondContact CB-OG1 2.99Å; Q117-T120 HydrophobicContact CB-CG2 4.08Å; Q117-T120 PolarHBondContact N-OG1 3.05Å; Q117-T120 WeakPolarHBondContact O-CB 3.33Å; Q117-T120 PolarHBondContact O-N 3.31Å; Q117-T120 PolarHBondContact O-OG1 3.19Å; T120-C133 CarbonylContact C-O 3.56Å; T120-C133 WeakPolarHBondContact CA-O 3.49Å; T120-C133 WeakPolarHBondContact CB-O 3.33Å
121	T	88.5	Confident	79.2	Confident	26 Å²	26	71.3 Å²	71.3	16%	0.16	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.3	-177	-52.2	0	0	0	0	111.2	C123 C133 H135 N137 A138	T121-C123 PolarHBondContact O-N 3.1Å; T121-C133 PolarHBondContact N-O 2.96Å; T121-C133 WeakPolarHBondContact O-CB 3.21Å; T121-C133 PolarHBondContact O-N 2.91Å; T121-H135 PolarHBondContact N-O 2.86Å; T121-H135 PolarHBondContact OG1-O 2.64Å; T121-N137 PolarHBondContact OG1-N 2.86Å; T121-A138 HydrophobicContact CG2-CB 4.21Å; T121-A138 PolarHBondContact OG1-N 3.44Å
122	C	90.7	Very high	79.6	Confident	19 Å²	19	72.4 Å²	72.4	13%	0.128	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.4	169.1	-74.6	0	0	0	0	109.9	C109 W130 G131	C109-C122 WeakPolarHBondContact CA-SG 3.4Å; C109-C122 HydrophobicContact CB-CB 3.77Å; C109-C122 WeakPolarHBondContact CB-SG 3.43Å; C109-C122 WeakPolarHBondContact SG-CB 3.02Å; C109-C122 CovalentContact SG-SG 2.05Å; C109-C122 PolarHBondContact SG-SG 2.85Å; C122-W130 HydrophobicContact CB-CE3 3.84Å; C122-W130 HydrophobicContact CB-CZ3 4.24Å; C122-G131 WeakPolarHBondContact CA-O 3.36Å
123	C	91.4	Very high	80.4	Confident	6 Å²	6	64.4 Å²	64.4	4%	0.041	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.5	175.5	-73.5	0	0	0	0	111	T121 W130 G131 C133 C140	T121-C123 PolarHBondContact O-N 3.1Å; C123-W130 VanDerWaalsContact C-CE3 3.47Å; C123-W130 CarbonylContact O-C 3.52Å; C123-W130 WeakPolarHBondContact O-CA 3.09Å; C123-G131 PolarHBondContact N-O 3.16Å; C123-G131 PolarHBondContact O-N 2.87Å; C123-C133 PolarHBondContact SG-SG 2.83Å; C123-C140 WeakPolarHBondContact CA-SG 3.49Å; C123-C140 HydrophobicContact CB-CB 3.59Å; C123-C140 WeakPolarHBondContact CB-SG 3.39Å; C123-C140 WeakPolarHBondContact SG-CA 3.34Å; C123-C140 WeakPolarHBondContact SG-CB 3.17Å; C123-C140 CovalentContact SG-SG 2.03Å; C123-C140 PolarHBondContact SG-SG 2.84Å
124	P	86.6	Confident	80.9	Confident	66 Å²	66	65.7 Å²	65.7	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.5	171.1	29.9	-34.3	0	0	0	110.1
125	M	78.9	Confident	81	Confident	95 Å²	95	68.5 Å²	68.5	47%	0.468	38%	0.378	S	S	.	.			trans	-106.7	171.2	171.3	-60.8	-172.9	74.4	0	0	110.1	G127 I129	M125-G127 PolarHBondContact O-N 2.92Å; M125-I129 PolarHBondContact N-O 2.79Å
126	S	72.2	Confident	80.8	Confident	88 Å²	88	68.1 Å²	68.1	62%	0.615	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	125.7	170.5	59.1	0	0	0	0	111.4
127	G	69.3	Low	80.5	Confident	65 Å²	65	73.6 Å²	73.6	67%	0.67	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.8	26.3	175.6	0	0	0	0	0	116.6	M125 I129	M125-G127 PolarHBondContact O-N 2.92Å; G127-I129 WeakPolarHBondContact O-CG1 3.31Å; G127-I129 PolarHBondContact O-N 3.39Å
128	E	65.3	Low	80.8	Confident	190 Å²	190	68.6 Å²	68.6	89%	0.888	39%	0.387	S	S	*	.	S	Bend	trans	67.1	7	178.1	-52.7	-171.5	155.3	0	0	115.6
129	I	74.3	Confident	82.1	Confident	95 Å²	95	68.5 Å²	68.5	49%	0.487	39%	0.386	S	S	.	.			trans	-89.7	145.7	177.4	-33.5	-179.1	0	0	0	110.1	M125 G127	M125-I129 PolarHBondContact N-O 2.79Å; G127-I129 WeakPolarHBondContact O-CG1 3.31Å; G127-I129 PolarHBondContact O-N 3.39Å
130	W	88.1	Confident	83	Confident	71 Å²	71	64.9 Å²	64.9	27%	0.269	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	146	170.4	-67.4	68	0	0	0	112.6	C109 P110 D111 S114 C122 C123	C109-W130 HydrophobicContact CB-CB 3.59Å; C109-W130 HydrophobicContact CB-CD2 4.23Å; C109-W130 HydrophobicContact CB-CE3 4.38Å; C109-W130 HydrophobicContact CB-CG 3.92Å; P110-W130 HydrophobicContact CB-CH2 4.32Å; P110-W130 HydrophobicContact CB-CZ2 3.78Å; P110-W130 HydrophobicContact CG-CD2 4.37Å; P110-W130 HydrophobicContact CG-CE3 4.39Å; P110-W130 HydrophobicContact CG-CH2 3.65Å; P110-W130 HydrophobicContact CG-CZ2 3.62Å; P110-W130 HydrophobicContact CG-CZ3 4.04Å; D111-W130 HydrophobicContact CB-CG 4.46Å; D111-W130 VanDerWaalsContact CG-CD1 3.49Å; D111-W130 WeakPolarHBondContact OD2-CB 3.45Å; D111-W130 VanDerWaalsContact OD2-CD1 3.29Å; D111-W130 PolarHBondContact OD2-N 2.03Å; D111-W130 VanDerWaalsContact OD2-N 3.11Å; S114-W130 WeakPolarHBondContact CB-O 3.27Å; S114-W130 PolarHBondContact OG-O 3.42Å; C122-W130 HydrophobicContact CB-CE3 3.84Å; C122-W130 HydrophobicContact CB-CZ3 4.24Å; C123-W130 VanDerWaalsContact C-CE3 3.47Å; C123-W130 CarbonylContact O-C 3.52Å; C123-W130 WeakPolarHBondContact O-CA 3.09Å
131	G	84.1	Confident	83.2	Confident	9 Å²	9	64.2 Å²	64.2	9%	0.093	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	173.1	177.6	0	0	0	0	0	113.1	C122 C123	C122-G131 WeakPolarHBondContact CA-O 3.36Å; C123-G131 PolarHBondContact N-O 3.16Å; C123-G131 PolarHBondContact O-N 2.87Å
132	C	89.5	Confident	83	Confident	63 Å²	63	67.7 Å²	67.7	43%	0.426	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	105.2	-168.2	-59.3	0	0	0	0	113	C116	C116-C132 WeakPolarHBondContact CA-SG 3.42Å; C116-C132 HydrophobicContact CB-CB 3.65Å; C116-C132 WeakPolarHBondContact CB-SG 3.47Å; C116-C132 WeakPolarHBondContact SG-CA 3.35Å; C116-C132 WeakPolarHBondContact SG-CB 3.31Å; C116-C132 CovalentContact SG-SG 2.03Å; C116-C132 PolarHBondContact SG-SG 3.1Å
133	C	89.4	Confident	82.6	Confident	11 Å²	11	68.4 Å²	68.4	7%	0.074	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123	178.5	-72.4	0	0	0	0	111.6	T120 T121 C123 H135 A138 C147	T120-C133 CarbonylContact C-O 3.56Å; T120-C133 WeakPolarHBondContact CA-O 3.49Å; T120-C133 WeakPolarHBondContact CB-O 3.33Å; T121-C133 PolarHBondContact N-O 2.96Å; T121-C133 WeakPolarHBondContact O-CB 3.21Å; T121-C133 PolarHBondContact O-N 2.91Å; C123-C133 PolarHBondContact SG-SG 2.83Å; C133-H135 PolarHBondContact O-N 2.05Å; C133-A138 HydrophobicContact CB-CB 3.76Å; C133-C147 HydrophobicContact CB-CB 3.95Å; C133-C147 WeakPolarHBondContact CB-SG 3.08Å; C133-C147 WeakPolarHBondContact SG-CB 3.43Å; C133-C147 CovalentContact SG-SG 2.02Å; C133-C147 PolarHBondContact SG-SG 2.94Å
134	Q	85.2	Confident	82.1	Confident	172 Å²	172	68.7 Å²	68.7	80%	0.804	40%	0.395	S	S	*	.	S	Bend	trans	-66.5	-2.3	-170.1	-58.9	-175.9	18.9	0	0	115.2
135	H	82.1	Confident	81.7	Confident	85 Å²	85	72.6 Å²	72.6	39%	0.394	41%	0.408	S	S	.	.	S	Bend	trans	-100.1	139	172.9	-51.8	-50.7	0	0	0	110.3	T121 C133 A138	T121-H135 PolarHBondContact N-O 2.86Å; T121-H135 PolarHBondContact OG1-O 2.64Å; C133-H135 PolarHBondContact O-N 2.05Å; H135-A138 HydrophobicContact CB-CB 4.06Å
136	A	76.9	Confident	82.1	Confident	36 Å²	36	69.7 Å²	69.7	30%	0.298	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	138.2	163.6	0	0	0	0	0	109.8	N119 A138	N119-A136 PolarHBondContact O-N 3.25Å; A136-A138 VanDerWaalsContact C-N 3.28Å; A136-A138 PolarHBondContact O-N 3.41Å
137	N	77.6	Confident	82.9	Confident	118 Å²	118	67 Å²	67	63%	0.631	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	43.2	-174.7	-53.8	-12.5	0	0	0	112.8	T121 H150	T121-N137 PolarHBondContact OG1-N 2.86Å; N137-H150 HydrophobicContact CB-CB 4.4Å; N137-H150 WeakPolarHBondContact O-CB 3.47Å
138	A	87.5	Confident	83.9	Confident	12 Å²	12	63.9 Å²	63.9	10%	0.099	34%	0.342	C	S	.	.			trans	-65.4	147.9	175.6	0	0	0	0	0	111.3	T121 C133 H135 A136 C148	T121-A138 HydrophobicContact CG2-CB 4.21Å; T121-A138 PolarHBondContact OG1-N 3.44Å; C133-A138 HydrophobicContact CB-CB 3.76Å; H135-A138 HydrophobicContact CB-CB 4.06Å; A136-A138 VanDerWaalsContact C-N 3.28Å; A136-A138 PolarHBondContact O-N 3.41Å; A138-C148 CarbonylContact C-O 3.58Å; A138-C148 WeakPolarHBondContact CA-O 3.4Å
139	I	88.8	Confident	84.9	Confident	68 Å²	68	57.3 Å²	57.3	35%	0.349	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	108.1	171	-65.4	163.3	0	0	0	106.7	C141 C147 C148 S152	I139-C141 PolarHBondContact O-N 2.78Å; I139-C147 CarbonylContact O-C 3.58Å; I139-C147 VanDerWaalsContact O-CA 3.3Å; I139-C147 WeakPolarHBondContact O-CA 3.28Å; I139-C147 WeakPolarHBondContact O-CB 3.23Å; I139-C148 HydrophobicContact CB-CB 4.37Å; I139-C148 PolarHBondContact N-O 2.89Å; I139-C148 PolarHBondContact O-N 3.07Å; I139-S152 WeakPolarHBondContact CD1-O 3.01Å
140	C	91.5	Very high	85.3	Confident	46 Å²	46	59.7 Å²	59.7	31%	0.311	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	123.6	176.2	-48.7	0	0	0	0	109.5	C123	C123-C140 WeakPolarHBondContact CA-SG 3.49Å; C123-C140 HydrophobicContact CB-CB 3.59Å; C123-C140 WeakPolarHBondContact CB-SG 3.39Å; C123-C140 WeakPolarHBondContact SG-CA 3.34Å; C123-C140 WeakPolarHBondContact SG-CB 3.17Å; C123-C140 CovalentContact SG-SG 2.03Å; C123-C140 PolarHBondContact SG-SG 2.84Å
141	C	89.6	Confident	85	Confident	7 Å²	7	58.7 Å²	58.7	5%	0.047	34%	0.336	C	S	.	.			trans	-82.8	143	-178	-61.1	0	0	0	0	111.6	I139 D143 G144 H146 C148 C154	I139-C141 PolarHBondContact O-N 2.78Å; C141-D143 WeakPolarHBondContact CB-OD2 3.34Å; C141-D143 PolarHBondContact O-N 2.96Å; C141-G144 PolarHBondContact O-N 2.78Å; C141-H146 VanDerWaalsContact CB-O 3.31Å; C141-H146 WeakPolarHBondContact CB-O 3.37Å; C141-H146 PolarHBondContact N-O 2.93Å; C141-H146 VanDerWaalsContact SG-CD2 3.58Å; C141-H146 PolarHBondContact SG-NE2 3.19Å; C141-H146 VanDerWaalsContact SG-NE2 3.35Å; C141-C148 PolarHBondContact SG-SG 2.81Å; C141-C154 WeakPolarHBondContact CA-SG 2.94Å; C141-C154 HydrophobicContact CB-CB 3.77Å; C141-C154 WeakPolarHBondContact CB-SG 3.39Å; C141-C154 WeakPolarHBondContact SG-CB 2.96Å; C141-C154 CovalentContact SG-SG 2.04Å; C141-C154 PolarHBondContact SG-SG 3.17Å
142	P	84.3	Confident	85.2	Confident	99 Å²	99	58.9 Å²	58.9	64%	0.643	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-10.3	-176.9	-29.2	34.7	0	0	0	117.5	M156	P142-M156 HydrophobicContact CB-CE 4.08Å; P142-M156 HydrophobicContact CB-SD 4.23Å; P142-M156 HydrophobicContact CG-SD 4.13Å
143	D	82.9	Confident	85	Confident	35 Å²	35	60 Å²	60	19%	0.187	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-30.2	173.2	40.5	63.3	0	0	0	112.3	C141 E145 H146 M156	C141-D143 WeakPolarHBondContact CB-OD2 3.34Å; C141-D143 PolarHBondContact O-N 2.96Å; D143-E145 HydrophobicContact CB-CB 4.42Å; D143-E145 HydrophobicContact CB-CG 4.47Å; D143-E145 PolarHBondContact O-N 2.85Å; D143-E145 PolarHBondContact OD1-N 2.69Å; D143-H146 PolarHBondContact OD1-N 2.8Å; D143-H146 VanDerWaalsContact OD1-N 3.1Å; D143-H146 IonicContact OD1-ND1 2.61Å; D143-H146 PolarHBondContact OD1-ND1 3.44Å; D143-H146 IonicContact OD2-CE1 2.77Å; D143-H146 PolarHBondContact OD2-CE1 3.47Å; D143-H146 IonicContact OD2-ND1 3.19Å; D143-H146 PolarHBondContact OD2-ND1 3.05Å; D143-M156 HydrophobicContact CB-CE 3.8Å; D143-M156 WeakPolarHBondContact OD2-CE 3Å
144	G	79.4	Confident	85	Confident	12 Å²	12	60.7 Å²	60.7	12%	0.124	35%	0.345	C	S	.	.	S	Bend	trans	72.7	11.5	-171.1	0	0	0	0	0	113.8	C141	C141-G144 PolarHBondContact O-N 2.78Å
145	E	79.6	Confident	85.1	Confident	147 Å²	147	53.1 Å²	53.1	69%	0.687	31%	0.31	S	S	*	.	S	Bend	trans	-100.4	-37.9	177.7	-64.9	-160	163.7	0	0	112	D143 H159	D143-E145 HydrophobicContact CB-CB 4.42Å; D143-E145 HydrophobicContact CB-CG 4.47Å; D143-E145 PolarHBondContact O-N 2.85Å; D143-E145 PolarHBondContact OD1-N 2.69Å; E145-H159 IonicContact OE2-CD2 3.67Å
146	H	86.2	Confident	85.1	Confident	35 Å²	35	53.1 Å²	53.1	16%	0.162	31%	0.312	C	S	.	.			trans	-132.7	174.4	177.1	77.3	-72.3	0	0	0	114	C141 D143 C148 D155 S160	C141-H146 VanDerWaalsContact CB-O 3.31Å; C141-H146 WeakPolarHBondContact CB-O 3.37Å; C141-H146 PolarHBondContact N-O 2.93Å; C141-H146 VanDerWaalsContact SG-CD2 3.58Å; C141-H146 PolarHBondContact SG-NE2 3.19Å; C141-H146 VanDerWaalsContact SG-NE2 3.35Å; D143-H146 PolarHBondContact OD1-N 2.8Å; D143-H146 VanDerWaalsContact OD1-N 3.1Å; D143-H146 IonicContact OD1-ND1 2.61Å; D143-H146 PolarHBondContact OD1-ND1 3.44Å; D143-H146 IonicContact OD2-CE1 2.77Å; D143-H146 PolarHBondContact OD2-CE1 3.47Å; D143-H146 IonicContact OD2-ND1 3.19Å; D143-H146 PolarHBondContact OD2-ND1 3.05Å; H146-C148 PolarHBondContact NE2-SG 3.33Å; H146-D155 PolarHBondContact CE1-O 2.81Å; H146-S160 WeakPolarHBondContact NE2-CA 3.2Å; H146-S160 PolarHBondContact NE2-N 3.42Å; H146-S160 VanDerWaalsContact NE2-N 3.17Å; H146-S160 PolarHBondContact NE2-O 2.93Å
147	C	89.6	Confident	85.4	Confident	30 Å²	30	57 Å²	57	20%	0.203	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	148.1	178.8	47.4	0	0	0	0	110.3	C133 I139	C133-C147 HydrophobicContact CB-CB 3.95Å; C133-C147 WeakPolarHBondContact CB-SG 3.08Å; C133-C147 WeakPolarHBondContact SG-CB 3.43Å; C133-C147 CovalentContact SG-SG 2.02Å; C133-C147 PolarHBondContact SG-SG 2.94Å; I139-C147 CarbonylContact O-C 3.58Å; I139-C147 VanDerWaalsContact O-CA 3.3Å; I139-C147 WeakPolarHBondContact O-CA 3.28Å; I139-C147 WeakPolarHBondContact O-CB 3.23Å
148	C	90.9	Very high	85.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.1	-164	-68.6	0	0	0	0	112.5	A138 I139 C141 H146 S152 C161	A138-C148 CarbonylContact C-O 3.58Å; A138-C148 WeakPolarHBondContact CA-O 3.4Å; I139-C148 HydrophobicContact CB-CB 4.37Å; I139-C148 PolarHBondContact N-O 2.89Å; I139-C148 PolarHBondContact O-N 3.07Å; C141-C148 PolarHBondContact SG-SG 2.81Å; H146-C148 PolarHBondContact NE2-SG 3.33Å; C148-S152 WeakPolarHBondContact CB-OG 3.28Å; C148-C161 WeakPolarHBondContact CA-SG 3.04Å; C148-C161 HydrophobicContact CB-CB 3.74Å; C148-C161 WeakPolarHBondContact CB-SG 3.27Å; C148-C161 WeakPolarHBondContact SG-CA 3.05Å; C148-C161 WeakPolarHBondContact SG-CB 3.01Å; C148-C161 CovalentContact SG-SG 2.03Å; C148-C161 PolarHBondContact SG-SG 2.65Å
149	P	86.1	Confident	85.4	Confident	53 Å²	53	60.7 Å²	60.7	34%	0.344	35%	0.346	S	S	.	.			trans	-63	147.3	176.7	25.3	-33.1	0	0	0	111.4	G151 S152	P149-G151 PolarHBondContact O-N 2.8Å; P149-G151 VanDerWaalsContact O-N 3.14Å; P149-S152 VanDerWaalsContact CD-OG 3.29Å; P149-S152 WeakPolarHBondContact CD-OG 3.3Å; P149-S152 WeakPolarHBondContact CG-OG 3.46Å; P149-S152 PolarHBondContact O-N 3.42Å; P149-S152 PolarHBondContact O-OG 3.33Å
150	H	81.8	Confident	85.3	Confident	144 Å²	144	59.7 Å²	59.7	67%	0.667	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	117.1	-178.8	-177.1	-82.8	0	0	0	112.7	N137	N137-H150 HydrophobicContact CB-CB 4.4Å; N137-H150 WeakPolarHBondContact O-CB 3.47Å
151	G	81.4	Confident	85.2	Confident	50 Å²	50	59.8 Å²	59.8	52%	0.515	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	96	15.2	-177.6	0	0	0	0	0	115.6	P149 A164	P149-G151 PolarHBondContact O-N 2.8Å; P149-G151 VanDerWaalsContact O-N 3.14Å; G151-A164 WeakPolarHBondContact O-CB 3.13Å; G151-A164 PolarHBondContact O-N 2.98Å
152	S	88.1	Confident	85	Confident	13 Å²	13	64.9 Å²	64.9	9%	0.091	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	161.5	169	58.1	0	0	0	0	111.6	I139 C148 P149 K162	I139-S152 WeakPolarHBondContact CD1-O 3.01Å; C148-S152 WeakPolarHBondContact CB-OG 3.28Å; P149-S152 VanDerWaalsContact CD-OG 3.29Å; P149-S152 WeakPolarHBondContact CD-OG 3.3Å; P149-S152 WeakPolarHBondContact CG-OG 3.46Å; P149-S152 PolarHBondContact O-N 3.42Å; P149-S152 PolarHBondContact O-OG 3.33Å; S152-K162 CarbonylContact C-O 3.55Å; S152-K162 WeakPolarHBondContact CA-O 3.49Å; S152-K162 VanDerWaalsContact CB-O 3.26Å; S152-K162 WeakPolarHBondContact CB-O 3.42Å
153	V	86.8	Confident	84.8	Confident	86 Å²	86	65.1 Å²	65.1	52%	0.521	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.3	-172.7	-175.8	0	0	0	0	109.6	D155 K162 A164	V153-D155 PolarHBondContact O-N 3.39Å; V153-K162 PolarHBondContact N-O 3.5Å; V153-K162 PolarHBondContact O-N 2.9Å; V153-A164 HydrophobicContact CG2-CB 4.35Å
154	C	88.9	Confident	84	Confident	26 Å²	26	66.2 Å²	66.2	18%	0.176	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	120.7	174.7	-60.6	0	0	0	0	111	C141 M156	C141-C154 WeakPolarHBondContact CA-SG 2.94Å; C141-C154 HydrophobicContact CB-CB 3.77Å; C141-C154 WeakPolarHBondContact CB-SG 3.39Å; C141-C154 WeakPolarHBondContact SG-CB 2.96Å; C141-C154 CovalentContact SG-SG 2.04Å; C141-C154 PolarHBondContact SG-SG 3.17Å; C154-M156 HydrophobicContact CB-SD 4.24Å
155	D	87.3	Confident	82.7	Confident	13 Å²	13	73.1 Å²	73.1	7%	0.07	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	97.3	166.1	-172.1	-23.8	0	0	0	109.4	H146 V153 V157 N158 H159 S160 K162	H146-D155 PolarHBondContact CE1-O 2.81Å; V153-D155 PolarHBondContact O-N 3.39Å; D155-V157 PolarHBondContact O-N 2.2Å; D155-V157 WeakPolarHBondContact OD1-CA 3.41Å; D155-V157 WeakPolarHBondContact OD1-CB 3.03Å; D155-V157 PolarHBondContact OD1-N 2.04Å; D155-N158 HydrophobicContact CB-CB 4.46Å; D155-N158 PolarHBondContact O-N 3.47Å; D155-N158 PolarHBondContact OD1-N 3.49Å; D155-N158 PolarHBondContact OD1-ND2 3.46Å; D155-N158 PolarHBondContact OD2-ND2 2.83Å; D155-H159 WeakPolarHBondContact O-CA 3.36Å; D155-H159 PolarHBondContact O-N 2.02Å; D155-S160 PolarHBondContact N-O 3.33Å; D155-S160 PolarHBondContact O-N 2.83Å; D155-K162 HydrophobicContact CB-CD 4.13Å; D155-K162 HydrophobicContact CB-CG 4.35Å; D155-K162 WeakPolarHBondContact OD2-CE 3.36Å; D155-K162 IonicContact OD2-NZ 3.67Å; D155-K162 PolarHBondContact OD2-NZ 2.97Å
156	M	82.4	Confident	80.8	Confident	86 Å²	86	70.8 Å²	70.8	42%	0.424	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.7	178.3	-57.3	-55.1	-50.7	0	0	114.3	P142 D143 C154	P142-M156 HydrophobicContact CB-CE 4.08Å; P142-M156 HydrophobicContact CB-SD 4.23Å; P142-M156 HydrophobicContact CG-SD 4.13Å; D143-M156 HydrophobicContact CB-CE 3.8Å; D143-M156 WeakPolarHBondContact OD2-CE 3Å; C154-M156 HydrophobicContact CB-SD 4.24Å
157	V	82.6	Confident	78.5	Confident	116 Å²	116	75.4 Å²	75.4	70%	0.703	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-46.7	178.7	-176.1	0	0	0	0	109.5	D155 H159	D155-V157 PolarHBondContact O-N 2.2Å; D155-V157 WeakPolarHBondContact OD1-CA 3.41Å; D155-V157 WeakPolarHBondContact OD1-CB 3.03Å; D155-V157 PolarHBondContact OD1-N 2.04Å; V157-H159 PolarHBondContact O-ND1 2.03Å
158	N	83.5	Confident	75.9	Confident	105 Å²	105	81.2 Å²	81.2	56%	0.561	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	11.5	-175.9	-60	-74.7	0	0	0	113.7	D155 S160	D155-N158 HydrophobicContact CB-CB 4.46Å; D155-N158 PolarHBondContact O-N 3.47Å; D155-N158 PolarHBondContact OD1-N 3.49Å; D155-N158 PolarHBondContact OD1-ND2 3.46Å; D155-N158 PolarHBondContact OD2-ND2 2.83Å; N158-S160 WeakPolarHBondContact CB-OG 3.5Å; N158-S160 VanDerWaalsContact O-CB 3.29Å; N158-S160 WeakPolarHBondContact O-CB 3.46Å; N158-S160 PolarHBondContact O-N 2.03Å; N158-S160 VanDerWaalsContact O-N 3.1Å; N158-S160 PolarHBondContact O-OG 3.35Å
159	H	81.2	Confident	73	Confident	104 Å²	104	87.4 Å²	87.4	48%	0.481	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	45.8	177.9	-60.3	63.3	0	0	0	112.3	E145 D155 V157	E145-H159 IonicContact OE2-CD2 3.67Å; D155-H159 WeakPolarHBondContact O-CA 3.36Å; D155-H159 PolarHBondContact O-N 2.02Å; V157-H159 PolarHBondContact O-ND1 2.03Å
160	S	87.2	Confident	70.5	Confident	46 Å²	46	90.9 Å²	90.9	32%	0.322	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	177.8	-167.6	53.9	0	0	0	0	112.8	H146 D155 N158	H146-S160 WeakPolarHBondContact NE2-CA 3.2Å; H146-S160 PolarHBondContact NE2-N 3.42Å; H146-S160 VanDerWaalsContact NE2-N 3.17Å; H146-S160 PolarHBondContact NE2-O 2.93Å; D155-S160 PolarHBondContact N-O 3.33Å; D155-S160 PolarHBondContact O-N 2.83Å; N158-S160 WeakPolarHBondContact CB-OG 3.5Å; N158-S160 VanDerWaalsContact O-CB 3.29Å; N158-S160 WeakPolarHBondContact O-CB 3.46Å; N158-S160 PolarHBondContact O-N 2.03Å; N158-S160 VanDerWaalsContact O-N 3.1Å; N158-S160 PolarHBondContact O-OG 3.35Å
161	C	89.2	Confident	68.1	Low	49 Å²	49	92.1 Å²	92.1	33%	0.331	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110	-174.9	-56.2	0	0	0	0	110.3	C148	C148-C161 WeakPolarHBondContact CA-SG 3.04Å; C148-C161 HydrophobicContact CB-CB 3.74Å; C148-C161 WeakPolarHBondContact CB-SG 3.27Å; C148-C161 WeakPolarHBondContact SG-CA 3.05Å; C148-C161 WeakPolarHBondContact SG-CB 3.01Å; C148-C161 CovalentContact SG-SG 2.03Å; C148-C161 PolarHBondContact SG-SG 2.65Å
162	K	86.3	Confident	65.6	Low	113 Å²	113	97.5 Å²	97.5	49%	0.491	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.3	171.7	-79.8	169.8	167.2	158.4	0	109	S152 V153 D155 A164	S152-K162 CarbonylContact C-O 3.55Å; S152-K162 WeakPolarHBondContact CA-O 3.49Å; S152-K162 VanDerWaalsContact CB-O 3.26Å; S152-K162 WeakPolarHBondContact CB-O 3.42Å; V153-K162 PolarHBondContact N-O 3.5Å; V153-K162 PolarHBondContact O-N 2.9Å; D155-K162 HydrophobicContact CB-CD 4.13Å; D155-K162 HydrophobicContact CB-CG 4.35Å; D155-K162 WeakPolarHBondContact OD2-CE 3.36Å; D155-K162 IonicContact OD2-NZ 3.67Å; D155-K162 PolarHBondContact OD2-NZ 2.97Å; K162-A164 PolarHBondContact O-N 2.61Å
163	P	78.6	Confident	63	Low	104 Å²	104	105.3 Å²	105.3	68%	0.675	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.8	142.6	167.9	27.3	-34	0	0	0	108.8	K165	P163-K165 PolarHBondContact O-N 3.42Å
164	A	66.8	Low	60.3	Low	59 Å²	59	109.7 Å²	109.7	49%	0.488	58%	0.58	S	S	.	*			trans	-62.6	103.2	172.4	0	0	0	0	0	108.6	G151 V153 K162 S166	G151-A164 WeakPolarHBondContact O-CB 3.13Å; G151-A164 PolarHBondContact O-N 2.98Å; V153-A164 HydrophobicContact CG2-CB 4.35Å; K162-A164 PolarHBondContact O-N 2.61Å; A164-S166 PolarHBondContact O-N 2.87Å
165	K	51.2	Low	57.6	Low	156 Å²	156	113.1 Å²	113.1	68%	0.678	61%	0.605	S	S	*	*			trans	-60.7	109.9	179	-85.3	-169.9	173.2	-172.9	0	109.2	P163 E168	P163-K165 PolarHBondContact O-N 3.42Å; K165-E168 IonicContact NZ-OE1 3.59Å; K165-E168 PolarHBondContact NZ-OE1 2.78Å; K165-E168 IonicContact NZ-OE2 2.75Å
166	S	41	Very low	54.9	Low	98 Å²	98	121.8 Å²	121.8	69%	0.685	64%	0.642	S	S	*	*			trans	-69	143.6	152.4	43.7	0	0	0	0	109.2	A164	A164-S166 PolarHBondContact O-N 2.87Å
167	N	37.3	Very low	52.7	Low	133 Å²	133	123.6 Å²	123.6	71%	0.711	66%	0.66	S	S	*	*			trans	68.1	69.9	165.9	-48.3	-13.8	0	0	0	117.2
168	E	34.9	Very low	50.4	Low	152 Å²	152	123.1 Å²	123.1	71%	0.71	66%	0.658	S	S	*	*			trans	-122	114.8	138.9	-91.9	163.7	-141.2	0	0	107.1	K165	K165-E168 IonicContact NZ-OE1 3.59Å; K165-E168 PolarHBondContact NZ-OE1 2.78Å; K165-E168 IonicContact NZ-OE2 2.75Å
169	I	31.1	Very low	48	Very low	129 Å²	129	123.3 Å²	123.3	66%	0.662	66%	0.658	S	S	*	*			trans	-127.4	127.8	-167.6	-63.4	169.5	0	0	0	109.4
170	P	32.7	Very low	45.7	Very low	127 Å²	127	126.6 Å²	126.6	83%	0.825	67%	0.674	S	S	*	*			trans	-88.4	136.8	147.7	-15	32.5	0	0	0	110.4
171	E	31.7	Very low	43.1	Very low	169 Å²	169	127.6 Å²	127.6	79%	0.79	68%	0.675	S	S	*	*			trans	-80.6	135.6	-160.8	-54.3	165.3	127.5	0	0	114
172	M	29.6	Very low	40.7	Very low	163 Å²	163	131 Å²	131	80%	0.803	69%	0.694	S	S	*	*				-171.8	120.8	111.5	-104.2	174.8	-79.8	0	0	115.2
173	K	32.6	Very low	38.2	Very low	178 Å²	178	130.7 Å²	130.7	77%	0.774	71%	0.706	S	S	*	*			trans	60.1	101.2	143.5	-64.7	176.2	-180	176.7	0	120.6
174	E	30.1	Very low	36.1	Very low	177 Å²	177	128.1 Å²	128.1	83%	0.827	69%	0.693	S	S	*	*				63.7	103.4	127.3	-65.8	179.1	-158	0	0	120.5
175	S	32.3	Very low	34.7	Very low	98 Å²	98	131 Å²	131	69%	0.685	71%	0.71	S	S	*	*				131.7	123.1	110.3	73.8	0	0	0	0	117
176	F	31.4	Very low	33.9	Very low	195 Å²	195	127 Å²	127	86%	0.855	71%	0.706	S	S	*	*			trans	66.7	151.4	166.8	-56.8	-67.6	0	0	0	119.2
177	P	36	Very low	33.7	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-92	132.3	-153.8	-8.3	28.6	0	0	0	114.7
178	T	32.8	Very low	33.6	Very low	107 Å²	107	124.6 Å²	124.6	66%	0.656	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-57.8	147.1	178	-30.9	0	0	0	0	113.4
179	L	34.3	Very low	33.6	Very low	109 Å²	109	127.9 Å²	127.9	57%	0.571	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-80.1	118.8	157.8	-117.9	72.4	0	0	0	108.8	L181 K467	L179-L181 PolarHBondContact O-N 3.47Å; L179-L181 VanDerWaalsContact O-N 3.08Å; L179-K467 VanDerWaalsContact CD2-NZ 3.34Å
180	H	32.6	Very low	33.8	Very low	173 Å²	173	128.1 Å²	128.1	80%	0.801	71%	0.71	S	S	*	*			trans	-63.6	114.1	174.5	-81.9	-83.7	0	0	0	110.9	V182	H180-V182 PolarHBondContact O-N 3.25Å
181	L	33.4	Very low	33.9	Very low	67 Å²	67	128.8 Å²	128.8	35%	0.351	71%	0.706	S	S	.	*			trans	-53.1	121	145.9	-99.6	63.4	0	0	0	107.6	L179 S183 A243 G256 E257	L179-L181 PolarHBondContact O-N 3.47Å; L179-L181 VanDerWaalsContact O-N 3.08Å; L181-S183 PolarHBondContact O-N 2.97Å; L181-S183 VanDerWaalsContact O-N 3.15Å; L181-A243 HydrophobicContact CD2-CB 3.56Å; L181-A243 HydrophobicContact CG-CB 3.96Å; L181-G256 WeakPolarHBondContact CD2-O 3.45Å; L181-E257 WeakPolarHBondContact CD1-O 3.42Å
182	V	37	Very low	34.2	Very low	120 Å²	120	125.3 Å²	125.3	73%	0.727	70%	0.699	S	S	*	*			trans	-76.6	102.8	169.7	-178.3	0	0	0	0	106.7	H180 A184	H180-V182 PolarHBondContact O-N 3.25Å; V182-A184 PolarHBondContact O-N 2.72Å
183	S	35.6	Very low	34.4	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	70%	0.7	S	S	*	*			trans	-57.9	125.4	175.9	52.2	0	0	0	0	110.4	L181 S185	L181-S183 PolarHBondContact O-N 2.97Å; L181-S183 VanDerWaalsContact O-N 3.15Å; S183-S185 PolarHBondContact O-N 2.03Å
184	A	34.2	Very low	34.6	Very low	50 Å²	50	122.8 Å²	122.8	41%	0.413	70%	0.701	S	S	.	*			trans	-65.2	128.1	-176.7	0	0	0	0	0	112.2	V182 A186 Y226	V182-A184 PolarHBondContact O-N 2.72Å; A184-A186 PolarHBondContact O-N 2.82Å; A184-Y226 HydrophobicContact CB-CD1 3.5Å; A184-Y226 HydrophobicContact CB-CE1 3.74Å
185	S	37.1	Very low	34.6	Very low	120 Å²	120	123.7 Å²	123.7	84%	0.839	70%	0.702	S	S	*	*			trans	-85.1	88.8	177.3	56.3	0	0	0	0	111.3	S183	S183-S185 PolarHBondContact O-N 2.03Å
186	A	34	Very low	34.6	Very low	73 Å²	73	125.1 Å²	125.1	60%	0.603	71%	0.709	S	S	*	*			trans	-66.8	156.1	158.2	0	0	0	0	0	109.4	A184	A184-A186 PolarHBondContact O-N 2.82Å
187	P	36.1	Very low	34.6	Very low	101 Å²	101	121 Å²	121	66%	0.656	71%	0.705	S	S	*	*				-151.1	162.8	70.6	40.7	-22.6	0	0	0	117.8
188	A	35.9	Very low	34.3	Very low	79 Å²	79	124.9 Å²	124.9	65%	0.653	71%	0.709	S	S	*	*			trans	66	155.4	142.5	0	0	0	0	0	119.5
189	R	34.1	Very low	34.3	Very low	221 Å²	221	124.8 Å²	124.8	83%	0.834	72%	0.719	S	S	*	*			cis	-171.1	161.9	-9.3	-102.8	169.6	-158	-109.3	1.3	105.4
190	L	36.8	Very low	34.1	Very low	133 Å²	133	124.2 Å²	124.2	70%	0.696	72%	0.724	S	S	*	*			cis	-144.4	131.7	-5.8	-95.8	159.6	0	0	0	105.8
191	N	33.7	Very low	34.2	Very low	141 Å²	141	126.2 Å²	126.2	75%	0.754	73%	0.725	S	S	*	*				83.1	170.2	93.8	-133.4	18.2	0	0	0	114.3
192	P	37.5	Very low	34.3	Very low	96 Å²	96	133.8 Å²	133.8	62%	0.623	75%	0.749	S	S	*	*				-132.9	163.9	-105.4	41.9	-25.5	0	0	0	115.6
193	N	35.3	Very low	34.2	Very low	155 Å²	155	138.4 Å²	138.4	83%	0.829	76%	0.759	S	S	*	*			trans	-160.8	145.6	147.6	-121.7	-51.6	0	0	0	116.4
194	V	35.8	Very low	34.2	Very low	133 Å²	133	140 Å²	140	81%	0.806	76%	0.76	S	S	*	*			trans	62.5	131.9	166.4	-170.3	0	0	0	0	118.7
195	K	30.9	Very low	34.3	Very low	196 Å²	196	144.4 Å²	144.4	85%	0.852	77%	0.774	S	S	*	*			trans	-89.3	163.1	-178.5	-82.7	-177.5	-178.1	-178.7	0	113.2
196	P	31.9	Very low	34.1	Very low	128 Å²	128	147.1 Å²	147.1	83%	0.831	77%	0.774	S	S	*	*			trans	-91.3	151.8	-161.9	35.1	-37	0	0	0	115.6
197	S	30.5	Very low	34.2	Very low	108 Å²	108	152.9 Å²	152.9	76%	0.755	79%	0.788	S	S	*	*			trans	-149.5	104.5	166.2	63	0	0	0	0	114.4
198	K	30.3	Very low	34	Very low	206 Å²	206	152.7 Å²	152.7	90%	0.896	79%	0.786	S	S	*	*			trans	51.3	141.1	141.1	-59.6	173.5	-179.3	174.6	0	120.5
199	A	32.3	Very low	33.9	Very low	106 Å²	106	154.8 Å²	154.8	88%	0.876	80%	0.796	S	S	*	*			trans	74.6	146.3	165.3	0	0	0	0	0	116.7
200	S	31.6	Very low	34.3	Very low	96 Å²	96	149 Å²	149	67%	0.671	80%	0.796	S	S	*	*			cis	-159.1	129.8	-21.6	-171	0	0	0	0	112.6
201	R	34.3	Very low	34.6	Very low	215 Å²	215	152 Å²	152	81%	0.811	80%	0.803	S	S	*	*			trans	55.9	138.7	146.9	-71.6	179.6	175.3	-174.7	-1.3	122.5
202	R	35.6	Very low	34.5	Very low	227 Å²	227	155.8 Å²	155.8	86%	0.857	81%	0.809	S	S	*	*			trans	76.6	79.2	152.9	-69.4	170.3	176.8	175.8	-2.8	118.4
203	K	34.8	Very low	34.5	Very low	216 Å²	216	158.1 Å²	158.1	94%	0.939	82%	0.815	S	S	*	*			trans	-67.2	157.8	140.2	-83.3	-172.6	174.8	-178.3	0	110.5
204	N	36.5	Very low	34.3	Very low	141 Å²	141	159.1 Å²	159.1	75%	0.754	82%	0.82	S	S	*	*			trans	-151.3	157.7	-176.8	-158.7	8.6	0	0	0	108.6
205	I	36	Very low	34.2	Very low	141 Å²	141	156 Å²	156	72%	0.723	81%	0.807	S	S	*	*	S	Bend	trans	71	154.4	161.8	-65.2	158.4	0	0	0	118
206	H	33.1	Very low	34.5	Very low	178 Å²	178	153.7 Å²	153.7	82%	0.824	79%	0.794	S	S	*	*			trans	-51.8	156.9	-178.5	-53.3	-86.8	0	0	0	117.1
207	Q	35.4	Very low	35.3	Very low	194 Å²	194	151 Å²	151	91%	0.907	78%	0.779	S	S	*	*			trans	-148.6	149.7	149.6	-120.9	171.9	-5.2	0	0	112.3
208	P	32.3	Very low	36.8	Very low	96 Å²	96	146.9 Å²	146.9	62%	0.623	75%	0.753	S	S	*	*			trans	-115.5	169.2	-171.9	42	-33.1	0	0	0	115.5
209	S	32.3	Very low	39.1	Very low	123 Å²	123	139.7 Å²	139.7	86%	0.86	73%	0.726	S	S	*	*			trans	51.4	74.1	148.1	-60	0	0	0	0	119.3
210	A	43.1	Very low	41.5	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	71%	0.71	S	S	*	*			trans	-93.8	118.4	160.8	0	0	0	0	0	111.4
211	K	42.7	Very low	44.1	Very low	195 Å²	195	134.6 Å²	134.6	85%	0.848	68%	0.68	S	S	*	*			trans	-98.1	144.2	166.4	-94.5	178.2	174.1	175.5	0	109.2
212	Y	31.4	Very low	46.4	Very low	221 Å²	221	129.2 Å²	129.2	87%	0.867	67%	0.673	S	S	*	*			trans	58.1	79.5	173.7	-77.7	-84.5	0	0	0	116
213	L	37.8	Very low	48.4	Very low	146 Å²	146	121 Å²	121	76%	0.764	65%	0.646	S	S	*	*			trans	-109.6	119.2	141	-80.3	169.4	0	0	0	108.1	A215	L213-A215 VanDerWaalsContact C-N 3.28Å; L213-A215 HydrophobicContact CB-CB 4.03Å; L213-A215 PolarHBondContact O-N 3Å
214	L	31.9	Very low	50.1	Low	176 Å²	176	116 Å²	116	92%	0.921	64%	0.636	S	S	*	*			trans	-81.8	91.2	145.6	-82	169.6	0	0	0	104.9
215	A	33.4	Very low	51.7	Low	66 Å²	66	115.5 Å²	115.5	55%	0.545	63%	0.632	S	S	.	*			trans	-129.8	137.1	170.9	0	0	0	0	0	106.8	L213 S217	L213-A215 VanDerWaalsContact C-N 3.28Å; L213-A215 HydrophobicContact CB-CB 4.03Å; L213-A215 PolarHBondContact O-N 3Å; A215-S217 PolarHBondContact O-N 2.93Å
216	Y	38.2	Very low	53.8	Low	149 Å²	149	110.8 Å²	110.8	58%	0.584	61%	0.606	S	S	*	*			trans	-58.6	133.8	160.4	-168.5	-98.7	0	0	0	107.2	E227 P229	Y216-E227 HydrophobicContact CD1-CG 4.44Å; Y216-E227 HydrophobicContact CE1-CG 4.35Å; Y216-P229 WeakPolarHBondContact OH-CA 3.46Å; Y216-P229 WeakPolarHBondContact OH-CB 3.41Å; Y216-P229 WeakPolarHBondContact OH-CD 3.32Å; Y216-P229 VanDerWaalsContact OH-CG 3.26Å; Y216-P229 WeakPolarHBondContact OH-CG 2.99Å
217	S	46.8	Very low	56.1	Low	71 Å²	71	106.8 Å²	106.8	50%	0.497	59%	0.588	S	S	.	*			trans	-103.2	118.1	169.4	-177.8	0	0	0	0	106.3	A215 D230	A215-S217 PolarHBondContact O-N 2.93Å; S217-D230 WeakPolarHBondContact CB-OD1 3.01Å; S217-D230 VanDerWaalsContact CB-OD2 3.27Å; S217-D230 WeakPolarHBondContact CB-OD2 3.41Å; S217-D230 VanDerWaalsContact O-CG 3.25Å; S217-D230 PolarHBondContact O-N 3.16Å; S217-D230 VanDerWaalsContact O-N 3.09Å; S217-D230 VanDerWaalsContact OG-CG 3.27Å; S217-D230 PolarHBondContact OG-OD1 3.33Å; S217-D230 PolarHBondContact OG-OD2 2.82Å
218	G	63.2	Low	58.6	Low	21 Å²	21	97.6 Å²	97.6	22%	0.216	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.2	-174	0	0	0	0	0	113.2	V220 E227 C228	G218-V220 PolarHBondContact O-N 2.86Å; G218-E227 VanDerWaalsContact CA-OE1 3.27Å; G218-E227 WeakPolarHBondContact CA-OE1 3.03Å; G218-E227 PolarHBondContact N-OE1 3.12Å; G218-C228 CarbonylContact C-O 3.59Å; G218-C228 VanDerWaalsContact C-O 3.3Å; G218-C228 WeakPolarHBondContact CA-O 3.27Å
219	V	77.6	Confident	61	Low	55 Å²	55	95.5 Å²	95.5	33%	0.333	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	100.1	168.7	-174.8	0	0	0	0	107	C221 C228 C234	V219-C221 PolarHBondContact O-N 2.86Å; V219-C228 PolarHBondContact N-O 2.82Å; V219-C228 PolarHBondContact O-N 3.2Å; V219-C234 PolarHBondContact O-SG 3.43Å; V219-C234 VanDerWaalsContact O-SG 3.35Å
220	V	83.7	Confident	63.1	Low	88 Å²	88	94 Å²	94	53%	0.533	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	126.8	169.9	-178.7	0	0	0	0	108.6	G218 E227	G218-V220 PolarHBondContact O-N 2.86Å; V220-E227 HydrophobicContact CG2-CG 4.26Å
221	C	86	Confident	64.9	Low	7 Å²	7	95.2 Å²	95.2	5%	0.047	51%	0.506	C	S	.	.			trans	-79.6	166.4	-178.4	-56.7	0	0	0	0	111.9	V219 D223 Y226 C234 W242	V219-C221 PolarHBondContact O-N 2.86Å; C221-D223 CarbonylContact O-C 3.58Å; C221-D223 PolarHBondContact O-N 2.04Å; C221-Y226 WeakPolarHBondContact CB-O 3.24Å; C221-Y226 PolarHBondContact N-O 3.24Å; C221-C234 WeakPolarHBondContact CA-SG 3.42Å; C221-C234 HydrophobicContact CB-CB 3.67Å; C221-C234 WeakPolarHBondContact CB-SG 3.35Å; C221-C234 WeakPolarHBondContact SG-CB 3.31Å; C221-C234 CovalentContact SG-SG 2.04Å; C221-C234 PolarHBondContact SG-SG 3.31Å; C221-W242 HydrophobicContact CB-CB 3.96Å; C221-W242 HydrophobicContact CB-CD2 3.89Å; C221-W242 HydrophobicContact CB-CE3 4.18Å; C221-W242 HydrophobicContact CB-CG 3.76Å
222	P	83.5	Confident	67.1	Low	102 Å²	102	87 Å²	87	66%	0.662	47%	0.472	S	S	*	.	S	Bend	trans	-60.5	-22	178.9	-27.9	37.4	0	0	0	115.2	W242	P222-W242 HydrophobicContact CB-CH2 4.07Å; P222-W242 HydrophobicContact CB-CZ2 3.64Å; P222-W242 HydrophobicContact CG-CH2 3.53Å; P222-W242 HydrophobicContact CG-CZ2 3.63Å; P222-W242 HydrophobicContact CG-CZ3 4.08Å
223	D	76.5	Confident	69.8	Low	54 Å²	54	77.5 Å²	77.5	29%	0.289	44%	0.437	S	S	.	.	S	Bend	trans	-91.9	116.9	155.5	-177.1	-8.2	0	0	0	109.3	C221 L225 Y226 W242	C221-D223 CarbonylContact O-C 3.58Å; C221-D223 PolarHBondContact O-N 2.04Å; D223-L225 PolarHBondContact O-N 2.95Å; D223-L225 WeakPolarHBondContact OD1-CB 3.41Å; D223-L225 WeakPolarHBondContact OD1-CG 3.02Å; D223-L225 PolarHBondContact OD1-N 2.85Å; D223-Y226 HydrophobicContact CB-CD2 3.94Å; D223-Y226 HydrophobicContact CB-CE2 4.45Å; D223-Y226 PolarHBondContact O-N 3.47Å; D223-Y226 VanDerWaalsContact O-N 3.09Å; D223-Y226 WeakPolarHBondContact OD2-CE2 3.33Å; D223-W242 VanDerWaalsContact CB-CD1 3.49Å
224	P	69.8	Low	72.4	Confident	111 Å²	111	71.4 Å²	71.4	72%	0.721	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-8.7	177.8	-23.5	34.7	0	0	0	115.8	Y226	P224-Y226 PolarHBondContact O-N 2.82Å
225	L	72	Confident	75.2	Confident	131 Å²	131	63.5 Å²	63.5	69%	0.686	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.4	171.4	-66.1	172	0	0	0	113.4	D223	D223-L225 PolarHBondContact O-N 2.95Å; D223-L225 WeakPolarHBondContact OD1-CB 3.41Å; D223-L225 WeakPolarHBondContact OD1-CG 3.02Å; D223-L225 PolarHBondContact OD1-N 2.85Å
226	Y	79.2	Confident	77.7	Confident	42 Å²	42	63.1 Å²	63.1	17%	0.165	36%	0.359	C	S	.	.			trans	-128.1	126.9	-174.5	-61.7	-99.4	0	0	0	111.3	A184 C221 D223 P224 K241 W242	A184-Y226 HydrophobicContact CB-CD1 3.5Å; A184-Y226 HydrophobicContact CB-CE1 3.74Å; C221-Y226 WeakPolarHBondContact CB-O 3.24Å; C221-Y226 PolarHBondContact N-O 3.24Å; D223-Y226 HydrophobicContact CB-CD2 3.94Å; D223-Y226 HydrophobicContact CB-CE2 4.45Å; D223-Y226 PolarHBondContact O-N 3.47Å; D223-Y226 VanDerWaalsContact O-N 3.09Å; D223-Y226 WeakPolarHBondContact OD2-CE2 3.33Å; P224-Y226 PolarHBondContact O-N 2.82Å; Y226-K241 HydrophobicContact CE1-CB 4.08Å; Y226-K241 VanDerWaalsContact OH-CG 3.3Å; Y226-K241 WeakPolarHBondContact OH-CG 2.99Å; Y226-W242 HydrophobicContact CD1-CB 3.89Å; Y226-W242 WeakPolarHBondContact CD1-O 3.26Å; Y226-W242 HydrophobicContact CD2-CB 4.19Å; Y226-W242 AromaticContact CD2-CD1 3.94Å; Y226-W242 HydrophobicContact CD2-CG 4.45Å; Y226-W242 WeakPolarHBondContact CE1-O 3.09Å; Y226-W242 HydrophobicContact CG-CB 3.67Å; Y226-W242 HydrophobicContact CG-CG 4.36Å
227	E	82.3	Confident	79.6	Confident	95 Å²	95	57 Å²	57	44%	0.444	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.5	174.2	-174.7	178.4	178.3	0	0	109.3	Y216 G218 V220	Y216-E227 HydrophobicContact CD1-CG 4.44Å; Y216-E227 HydrophobicContact CE1-CG 4.35Å; G218-E227 VanDerWaalsContact CA-OE1 3.27Å; G218-E227 WeakPolarHBondContact CA-OE1 3.03Å; G218-E227 PolarHBondContact N-OE1 3.12Å; V220-E227 HydrophobicContact CG2-CG 4.26Å
228	C	86.2	Confident	80.9	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.007	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	156.6	179.8	-65.4	0	0	0	0	111.1	G218 V219 T232 C244	G218-C228 CarbonylContact C-O 3.59Å; G218-C228 VanDerWaalsContact C-O 3.3Å; G218-C228 WeakPolarHBondContact CA-O 3.27Å; V219-C228 PolarHBondContact N-O 2.82Å; V219-C228 PolarHBondContact O-N 3.2Å; C228-T232 WeakPolarHBondContact CB-OG1 3.44Å; C228-C244 WeakPolarHBondContact CA-SG 3.29Å; C228-C244 HydrophobicContact CB-CB 3.59Å; C228-C244 WeakPolarHBondContact CB-SG 3.4Å; C228-C244 WeakPolarHBondContact SG-CA 3.48Å; C228-C244 WeakPolarHBondContact SG-CB 3.37Å; C228-C244 CovalentContact SG-SG 2.03Å; C228-C244 PolarHBondContact SG-SG 2.85Å
229	P	83.6	Confident	81.3	Confident	52 Å²	52	61.7 Å²	61.7	34%	0.338	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	157.3	-178.4	-11.7	17.1	0	0	0	114.1	Y216 N231 T232	Y216-P229 WeakPolarHBondContact OH-CA 3.46Å; Y216-P229 WeakPolarHBondContact OH-CB 3.41Å; Y216-P229 WeakPolarHBondContact OH-CD 3.32Å; Y216-P229 VanDerWaalsContact OH-CG 3.26Å; Y216-P229 WeakPolarHBondContact OH-CG 2.99Å; P229-N231 PolarHBondContact O-N 3.29Å; P229-T232 HydrophobicContact CB-CG2 3.9Å; P229-T232 HydrophobicContact CG-CG2 3.85Å; P229-T232 WeakPolarHBondContact O-CB 3.22Å; P229-T232 WeakPolarHBondContact O-CG2 3.48Å; P229-T232 PolarHBondContact O-N 3.07Å; P229-T232 PolarHBondContact O-OG1 2.86Å
230	D	77.2	Confident	80.9	Confident	90 Å²	90	67.5 Å²	67.5	48%	0.481	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.8	139.1	163.4	-89.8	-12.1	0	0	0	112.1	S217 T232	S217-D230 WeakPolarHBondContact CB-OD1 3.01Å; S217-D230 VanDerWaalsContact CB-OD2 3.27Å; S217-D230 WeakPolarHBondContact CB-OD2 3.41Å; S217-D230 VanDerWaalsContact O-CG 3.25Å; S217-D230 PolarHBondContact O-N 3.16Å; S217-D230 VanDerWaalsContact O-N 3.09Å; S217-D230 VanDerWaalsContact OG-CG 3.27Å; S217-D230 PolarHBondContact OG-OD1 3.33Å; S217-D230 PolarHBondContact OG-OD2 2.82Å; D230-T232 VanDerWaalsContact C-N 3.3Å; D230-T232 PolarHBondContact O-N 2.86Å
231	N	79.6	Confident	80.7	Confident	127 Å²	127	67.9 Å²	67.9	68%	0.679	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	20.6	-177.6	-52.5	-68.3	0	0	0	116.3	P229 P248	P229-N231 PolarHBondContact O-N 3.29Å; N231-P248 WeakPolarHBondContact O-CB 3.31Å; N231-P248 VanDerWaalsContact O-CD 3.32Å; N231-P248 WeakPolarHBondContact O-CD 3.48Å
232	T	88.6	Confident	80.7	Confident	21 Å²	21	70.4 Å²	70.4	13%	0.129	39%	0.386	C	S	.	.			trans	-104.9	177	169.6	67.6	0	0	0	0	111.8	C228 P229 D230 C245	C228-T232 WeakPolarHBondContact CB-OG1 3.44Å; P229-T232 HydrophobicContact CB-CG2 3.9Å; P229-T232 HydrophobicContact CG-CG2 3.85Å; P229-T232 WeakPolarHBondContact O-CB 3.22Å; P229-T232 WeakPolarHBondContact O-CG2 3.48Å; P229-T232 PolarHBondContact O-N 3.07Å; P229-T232 PolarHBondContact O-OG1 2.86Å; D230-T232 VanDerWaalsContact C-N 3.3Å; D230-T232 PolarHBondContact O-N 2.86Å; T232-C245 CarbonylContact C-O 3.59Å; T232-C245 VanDerWaalsContact CA-O 3.32Å; T232-C245 WeakPolarHBondContact CA-O 3.34Å; T232-C245 WeakPolarHBondContact CB-O 3.44Å
233	T	89.3	Confident	80.7	Confident	23 Å²	23	66 Å²	66	14%	0.141	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.1	173.9	-53.3	0	0	0	0	110.7	C235 C245 I247 Q249 A250	T233-C235 PolarHBondContact O-N 3Å; T233-C245 PolarHBondContact N-O 2.9Å; T233-C245 WeakPolarHBondContact O-CB 3.23Å; T233-C245 PolarHBondContact O-N 3.18Å; T233-I247 WeakPolarHBondContact CB-O 3.39Å; T233-I247 PolarHBondContact N-O 2.8Å; T233-I247 PolarHBondContact OG1-O 3.14Å; T233-Q249 PolarHBondContact OG1-N 3.25Å; T233-A250 HydrophobicContact CG2-CB 4.22Å; T233-A250 PolarHBondContact OG1-N 3.4Å
234	C	91.2	Very high	81.4	Confident	18 Å²	18	65.5 Å²	65.5	12%	0.122	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	120.4	168.4	-69.5	0	0	0	0	110.5	V219 C221 W242	V219-C234 PolarHBondContact O-SG 3.43Å; V219-C234 VanDerWaalsContact O-SG 3.35Å; C221-C234 WeakPolarHBondContact CA-SG 3.42Å; C221-C234 HydrophobicContact CB-CB 3.67Å; C221-C234 WeakPolarHBondContact CB-SG 3.35Å; C221-C234 WeakPolarHBondContact SG-CB 3.31Å; C221-C234 CovalentContact SG-SG 2.04Å; C221-C234 PolarHBondContact SG-SG 3.31Å; C234-W242 HydrophobicContact CB-CE3 3.73Å; C234-W242 HydrophobicContact CB-CZ3 4.12Å
235	C	91.3	Very high	82.4	Confident	10 Å²	10	60.6 Å²	60.6	7%	0.068	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.6	173.5	-71.2	0	0	0	0	110.9	T233 W242 A243 C252	T233-C235 PolarHBondContact O-N 3Å; C235-W242 CarbonylContact O-C 3.54Å; C235-W242 WeakPolarHBondContact O-CA 3.4Å; C235-A243 PolarHBondContact N-O 3.31Å; C235-A243 PolarHBondContact O-N 2.61Å; C235-C252 WeakPolarHBondContact CA-SG 3.49Å; C235-C252 HydrophobicContact CB-CB 3.59Å; C235-C252 WeakPolarHBondContact CB-SG 3.22Å; C235-C252 VanDerWaalsContact SG-CA 3.58Å; C235-C252 WeakPolarHBondContact SG-CB 3.39Å; C235-C252 CovalentContact SG-SG 2.03Å; C235-C252 PolarHBondContact SG-SG 3.38Å
236	S	86.6	Confident	83.3	Confident	57 Å²	57	59 Å²	59	40%	0.399	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.3	165.9	-170.2	0	0	0	0	108.5	G256	S236-G256 WeakPolarHBondContact O-CA 2.97Å
237	S	77.5	Confident	83.7	Confident	22 Å²	22	59.7 Å²	59.7	15%	0.154	33%	0.331	C	S	.	.			trans	-88.9	173.4	166.6	-161.1	0	0	0	0	110.3	D239 E240 K241 G256	S237-D239 PolarHBondContact O-N 3.09Å; S237-E240 PolarHBondContact O-N 2.63Å; S237-K241 PolarHBondContact N-O 2.78Å; S237-G256 WeakPolarHBondContact CA-O 3.36Å; S237-G256 PolarHBondContact OG-O 2.86Å
238	S	73.3	Confident	83.8	Confident	89 Å²	89	58.6 Å²	58.6	62%	0.622	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.7	177	47.1	0	0	0	0	113.3	E240	S238-E240 VanDerWaalsContact C-N 3.28Å; S238-E240 PolarHBondContact O-N 3.24Å
239	D	71.7	Confident	83.8	Confident	101 Å²	101	65.3 Å²	65.3	54%	0.54	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	10.3	-177.4	-115.8	11.7	0	0	0	114.7	S237 K241	S237-D239 PolarHBondContact O-N 3.09Å; D239-K241 HydrophobicContact CB-CB 4.34Å; D239-K241 HydrophobicContact CB-CD 3.88Å; D239-K241 HydrophobicContact CB-CG 4.09Å; D239-K241 PolarHBondContact O-N 3.47Å; D239-K241 VanDerWaalsContact O-N 3.07Å; D239-K241 WeakPolarHBondContact OD2-CE 3.26Å; D239-K241 IonicContact OD2-NZ 3.67Å; D239-K241 PolarHBondContact OD2-NZ 2.88Å
240	E	69.3	Low	84	Confident	177 Å²	177	63.5 Å²	63.5	83%	0.827	35%	0.352	S	S	*	.	S	Bend	trans	58.8	4.4	-165	-59	-167	146.4	0	0	115.4	S237 S238	S237-E240 PolarHBondContact O-N 2.63Å; S238-E240 VanDerWaalsContact C-N 3.28Å; S238-E240 PolarHBondContact O-N 3.24Å
241	K	80	Confident	84.7	Confident	96 Å²	96	61.9 Å²	61.9	42%	0.417	35%	0.345	S	S	.	.	S	Bend	trans	-88.2	167.1	178.3	-61.6	168.8	-161.9	162.1	0	111.3	Y226 S237 D239	Y226-K241 HydrophobicContact CE1-CB 4.08Å; Y226-K241 VanDerWaalsContact OH-CG 3.3Å; Y226-K241 WeakPolarHBondContact OH-CG 2.99Å; S237-K241 PolarHBondContact N-O 2.78Å; D239-K241 HydrophobicContact CB-CB 4.34Å; D239-K241 HydrophobicContact CB-CD 3.88Å; D239-K241 HydrophobicContact CB-CG 4.09Å; D239-K241 PolarHBondContact O-N 3.47Å; D239-K241 VanDerWaalsContact O-N 3.07Å; D239-K241 WeakPolarHBondContact OD2-CE 3.26Å; D239-K241 IonicContact OD2-NZ 3.67Å; D239-K241 PolarHBondContact OD2-NZ 2.88Å
242	W	86.9	Confident	85.2	Confident	59 Å²	59	58.2 Å²	58.2	22%	0.223	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	144	174.6	-63.5	82.1	0	0	0	113.1	C221 P222 D223 Y226 C234 C235	C221-W242 HydrophobicContact CB-CB 3.96Å; C221-W242 HydrophobicContact CB-CD2 3.89Å; C221-W242 HydrophobicContact CB-CE3 4.18Å; C221-W242 HydrophobicContact CB-CG 3.76Å; P222-W242 HydrophobicContact CB-CH2 4.07Å; P222-W242 HydrophobicContact CB-CZ2 3.64Å; P222-W242 HydrophobicContact CG-CH2 3.53Å; P222-W242 HydrophobicContact CG-CZ2 3.63Å; P222-W242 HydrophobicContact CG-CZ3 4.08Å; D223-W242 VanDerWaalsContact CB-CD1 3.49Å; Y226-W242 HydrophobicContact CD1-CB 3.89Å; Y226-W242 WeakPolarHBondContact CD1-O 3.26Å; Y226-W242 HydrophobicContact CD2-CB 4.19Å; Y226-W242 AromaticContact CD2-CD1 3.94Å; Y226-W242 HydrophobicContact CD2-CG 4.45Å; Y226-W242 WeakPolarHBondContact CE1-O 3.09Å; Y226-W242 HydrophobicContact CG-CB 3.67Å; Y226-W242 HydrophobicContact CG-CG 4.36Å; C234-W242 HydrophobicContact CB-CE3 3.73Å; C234-W242 HydrophobicContact CB-CZ3 4.12Å; C235-W242 CarbonylContact O-C 3.54Å; C235-W242 WeakPolarHBondContact O-CA 3.4Å
243	A	83.8	Confident	85.3	Confident	11 Å²	11	57.7 Å²	57.7	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.1	176.3	0	0	0	0	0	110.9	L181 C235	L181-A243 HydrophobicContact CD2-CB 3.56Å; L181-A243 HydrophobicContact CG-CB 3.96Å; C235-A243 PolarHBondContact N-O 3.31Å; C235-A243 PolarHBondContact O-N 2.61Å
244	C	90.4	Very high	85.1	Confident	43 Å²	43	62.1 Å²	62.1	29%	0.291	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	99.2	-170.5	-54.7	0	0	0	0	111.8	C228	C228-C244 WeakPolarHBondContact CA-SG 3.29Å; C228-C244 HydrophobicContact CB-CB 3.59Å; C228-C244 WeakPolarHBondContact CB-SG 3.4Å; C228-C244 WeakPolarHBondContact SG-CA 3.48Å; C228-C244 WeakPolarHBondContact SG-CB 3.37Å; C228-C244 CovalentContact SG-SG 2.03Å; C228-C244 PolarHBondContact SG-SG 2.85Å
245	C	91.2	Very high	84.7	Confident	7 Å²	7	63.2 Å²	63.2	5%	0.047	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.4	172.5	175.4	0	0	0	0	110.5	T232 T233 I247 A250 C259	T232-C245 CarbonylContact C-O 3.59Å; T232-C245 VanDerWaalsContact CA-O 3.32Å; T232-C245 WeakPolarHBondContact CA-O 3.34Å; T232-C245 WeakPolarHBondContact CB-O 3.44Å; T233-C245 PolarHBondContact N-O 2.9Å; T233-C245 WeakPolarHBondContact O-CB 3.23Å; T233-C245 PolarHBondContact O-N 3.18Å; C245-I247 PolarHBondContact O-N 2.68Å; C245-A250 HydrophobicContact CB-CB 4.18Å; C245-A250 WeakPolarHBondContact SG-CB 3.39Å; C245-C259 HydrophobicContact CB-CB 3.64Å; C245-C259 WeakPolarHBondContact CB-SG 2.99Å; C245-C259 WeakPolarHBondContact SG-CB 3.32Å; C245-C259 CovalentContact SG-SG 2.02Å; C245-C259 PolarHBondContact SG-SG 3.17Å
246	P	89.4	Confident	84.3	Confident	98 Å²	98	63.1 Å²	63.1	64%	0.636	36%	0.364	S	S	*	.	S	Bend	trans	-73.5	7.4	-176.5	31.6	-37.4	0	0	0	114.6
247	I	87.6	Confident	84.1	Confident	57 Å²	57	65.7 Å²	65.7	29%	0.292	37%	0.37	S	S	.	.	S	Bend	trans	-105.4	130.8	176.3	-54.8	169.5	0	0	0	107.9	T233 C245 A250 P261	T233-I247 WeakPolarHBondContact CB-O 3.39Å; T233-I247 PolarHBondContact N-O 2.8Å; T233-I247 PolarHBondContact OG1-O 3.14Å; C245-I247 PolarHBondContact O-N 2.68Å; I247-A250 HydrophobicContact CB-CB 4.17Å; I247-A250 HydrophobicContact CG2-CB 4.48Å; I247-P261 HydrophobicContact CG2-CB 4.21Å
248	P	85.9	Confident	84.6	Confident	71 Å²	71	69.2 Å²	69.2	46%	0.461	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	138.1	173	27.9	-32.3	0	0	0	111.2	N231	N231-P248 WeakPolarHBondContact O-CB 3.31Å; N231-P248 VanDerWaalsContact O-CD 3.32Å; N231-P248 WeakPolarHBondContact O-CD 3.48Å
249	Q	84.6	Confident	85.4	Confident	143 Å²	143	66.4 Å²	66.4	67%	0.668	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	42.4	-176.8	-54.7	-177.5	-9.3	0	0	114	T233 N262	T233-Q249 PolarHBondContact OG1-N 3.25Å; Q249-N262 HydrophobicContact CB-CB 4.43Å; Q249-N262 WeakPolarHBondContact O-CB 3.23Å; Q249-N262 PolarHBondContact OE1-ND2 3.28Å
250	A	89.4	Confident	86.4	Confident	13 Å²	13	61.7 Å²	61.7	11%	0.107	34%	0.338	C	S	.	.			trans	-72	148.6	179.2	0	0	0	0	0	112.8	T233 C245 I247 C259 C260	T233-A250 HydrophobicContact CG2-CB 4.22Å; T233-A250 PolarHBondContact OG1-N 3.4Å; C245-A250 HydrophobicContact CB-CB 4.18Å; C245-A250 WeakPolarHBondContact SG-CB 3.39Å; I247-A250 HydrophobicContact CB-CB 4.17Å; I247-A250 HydrophobicContact CG2-CB 4.48Å; A250-C259 HydrophobicContact CB-CB 3.98Å; A250-C260 CarbonylContact C-O 3.51Å; A250-C260 VanDerWaalsContact CA-O 3.24Å; A250-C260 WeakPolarHBondContact CA-O 3.37Å; A250-C260 WeakPolarHBondContact CB-O 3.39Å
251	V	90.4	Very high	87.3	Confident	56 Å²	56	55.5 Å²	55.5	34%	0.339	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	107.4	163.1	178.5	0	0	0	0	107.2	C259 C260 Y264	V251-C259 CarbonylContact O-C 3.53Å; V251-C259 WeakPolarHBondContact O-CA 3.37Å; V251-C260 HydrophobicContact CB-CB 4.4Å; V251-C260 PolarHBondContact N-O 3.39Å; V251-C260 PolarHBondContact O-N 2.89Å; V251-Y264 WeakPolarHBondContact CG2-O 3.27Å
252	C	91.2	Very high	87.6	Confident	51 Å²	51	55.8 Å²	55.8	35%	0.345	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.4	176.2	-53.1	0	0	0	0	110	C235	C235-C252 WeakPolarHBondContact CA-SG 3.49Å; C235-C252 HydrophobicContact CB-CB 3.59Å; C235-C252 WeakPolarHBondContact CB-SG 3.22Å; C235-C252 VanDerWaalsContact SG-CA 3.58Å; C235-C252 WeakPolarHBondContact SG-CB 3.39Å; C235-C252 CovalentContact SG-SG 2.03Å; C235-C252 PolarHBondContact SG-SG 3.38Å
253	C	89.5	Confident	87.5	Confident	9 Å²	9	54.8 Å²	54.8	6%	0.061	33%	0.328	C	S	.	.			trans	-81.2	152.3	-179.8	-54.6	0	0	0	0	111	D255 G256 H258 C266 L268	C253-D255 WeakPolarHBondContact CB-OD1 3.12Å; C253-D255 PolarHBondContact O-N 2.92Å; C253-D255 VanDerWaalsContact O-N 3.17Å; C253-G256 PolarHBondContact O-N 3.34Å; C253-G256 VanDerWaalsContact O-N 3.09Å; C253-H258 HydrophobicContact CB-CB 3.85Å; C253-H258 VanDerWaalsContact CB-O 3.23Å; C253-H258 WeakPolarHBondContact CB-O 3.14Å; C253-H258 PolarHBondContact N-O 3.03Å; C253-H258 VanDerWaalsContact SG-CB 3.57Å; C253-H258 PolarHBondContact SG-O 3.09Å; C253-H258 VanDerWaalsContact SG-O 3.35Å; C253-C266 WeakPolarHBondContact CA-SG 3.45Å; C253-C266 HydrophobicContact CB-CB 3.61Å; C253-C266 WeakPolarHBondContact CB-SG 3.28Å; C253-C266 WeakPolarHBondContact SG-CB 3.39Å; C253-C266 CovalentContact SG-SG 2.03Å; C253-C266 PolarHBondContact SG-SG 2.89Å; C253-L268 HydrophobicContact CB-CD2 4.08Å
254	S	85.7	Confident	87.8	Confident	116 Å²	116	58.2 Å²	58.2	81%	0.811	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	3.4	-174.5	55.2	0	0	0	0	114.7	L268	S254-L268 WeakPolarHBondContact OG-CD1 3.36Å
255	D	83.4	Confident	87.6	Confident	41 Å²	41	59.2 Å²	59.2	22%	0.219	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.5	166.4	57	11.1	0	0	0	112.5	C253 E257 H258 L268	C253-D255 WeakPolarHBondContact CB-OD1 3.12Å; C253-D255 PolarHBondContact O-N 2.92Å; C253-D255 VanDerWaalsContact O-N 3.17Å; D255-E257 PolarHBondContact O-N 3.27Å; D255-E257 PolarHBondContact OD1-N 2.96Å; D255-H258 PolarHBondContact OD1-N 3.02Å; D255-H258 IonicContact OD2-CE1 2.8Å; D255-H258 IonicContact OD2-CG 2.73Å; D255-H258 IonicContact OD2-ND1 3.33Å; D255-H258 PolarHBondContact OD2-ND1 2.67Å; D255-L268 HydrophobicContact CB-CD1 4.17Å; D255-L268 HydrophobicContact CB-CD2 4.14Å; D255-L268 WeakPolarHBondContact OD2-CD2 3.49Å
256	G	82.1	Confident	87.5	Confident	9 Å²	9	60.1 Å²	60.1	9%	0.093	35%	0.35	C	S	.	.	S	Bend	trans	72.7	12.2	-174.4	0	0	0	0	0	114.9	L181 S236 S237 C253	L181-G256 WeakPolarHBondContact CD2-O 3.45Å; S236-G256 WeakPolarHBondContact O-CA 2.97Å; S237-G256 WeakPolarHBondContact CA-O 3.36Å; S237-G256 PolarHBondContact OG-O 2.86Å; C253-G256 PolarHBondContact O-N 3.34Å; C253-G256 VanDerWaalsContact O-N 3.09Å
257	E	83.1	Confident	87.4	Confident	111 Å²	111	57.7 Å²	57.7	52%	0.519	33%	0.332	S	S	.	.	S	Bend	trans	-116.8	-32.8	177	-63.6	-163.7	151.5	0	0	112.1	L181 D255	L181-E257 WeakPolarHBondContact CD1-O 3.42Å; D255-E257 PolarHBondContact O-N 3.27Å; D255-E257 PolarHBondContact OD1-N 2.96Å
258	H	86.8	Confident	87.1	Confident	95 Å²	95	58.9 Å²	58.9	44%	0.44	34%	0.339	S	S	.	.			trans	-102.6	155.3	-178.8	-65.5	93.8	0	0	0	112.6	C253 D255	C253-H258 HydrophobicContact CB-CB 3.85Å; C253-H258 VanDerWaalsContact CB-O 3.23Å; C253-H258 WeakPolarHBondContact CB-O 3.14Å; C253-H258 PolarHBondContact N-O 3.03Å; C253-H258 VanDerWaalsContact SG-CB 3.57Å; C253-H258 PolarHBondContact SG-O 3.09Å; C253-H258 VanDerWaalsContact SG-O 3.35Å; D255-H258 PolarHBondContact OD1-N 3.02Å; D255-H258 IonicContact OD2-CE1 2.8Å; D255-H258 IonicContact OD2-CG 2.73Å; D255-H258 IonicContact OD2-ND1 3.33Å; D255-H258 PolarHBondContact OD2-ND1 2.67Å
259	C	90.8	Very high	86.8	Confident	30 Å²	30	60.5 Å²	60.5	20%	0.203	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	130.5	171.2	61.9	0	0	0	0	110.7	C245 A250 V251	C245-C259 HydrophobicContact CB-CB 3.64Å; C245-C259 WeakPolarHBondContact CB-SG 2.99Å; C245-C259 WeakPolarHBondContact SG-CB 3.32Å; C245-C259 CovalentContact SG-SG 2.02Å; C245-C259 PolarHBondContact SG-SG 3.17Å; A250-C259 HydrophobicContact CB-CB 3.98Å; V251-C259 CarbonylContact O-C 3.53Å; V251-C259 WeakPolarHBondContact O-CA 3.37Å
260	C	92.2	Very high	86.3	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	148.9	-179.6	-72.4	0	0	0	0	111.8	A250 V251 C273	A250-C260 CarbonylContact C-O 3.51Å; A250-C260 VanDerWaalsContact CA-O 3.24Å; A250-C260 WeakPolarHBondContact CA-O 3.37Å; A250-C260 WeakPolarHBondContact CB-O 3.39Å; V251-C260 HydrophobicContact CB-CB 4.4Å; V251-C260 PolarHBondContact N-O 3.39Å; V251-C260 PolarHBondContact O-N 2.89Å; C260-C273 WeakPolarHBondContact CA-SG 3.33Å; C260-C273 HydrophobicContact CB-CB 3.77Å; C260-C273 WeakPolarHBondContact CB-SG 3.34Å; C260-C273 WeakPolarHBondContact SG-CA 3.05Å; C260-C273 WeakPolarHBondContact SG-CB 3.32Å; C260-C273 CovalentContact SG-SG 2.04Å; C260-C273 PolarHBondContact SG-SG 3Å
261	P	89.4	Confident	85.6	Confident	47 Å²	47	60.1 Å²	60.1	31%	0.305	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-64.7	154.6	173.5	26.1	-32.1	0	0	0	111.8	I247 G263 Y264	I247-P261 HydrophobicContact CG2-CB 4.21Å; P261-G263 PolarHBondContact O-N 3.07Å; P261-Y264 HydrophobicContact CB-CD2 4.41Å; P261-Y264 HydrophobicContact CG-CD2 3.73Å; P261-Y264 HydrophobicContact CG-CE2 4.03Å; P261-Y264 HydrophobicContact CG-CG 4.18Å; P261-Y264 WeakPolarHBondContact O-CB 3.35Å; P261-Y264 PolarHBondContact O-N 3.33Å; P261-Y264 VanDerWaalsContact O-N 3.14Å
262	N	86.4	Confident	85.2	Confident	102 Å²	102	63.4 Å²	63.4	55%	0.545	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	134.2	-178.5	-161	-14.2	0	0	0	112	Q249	Q249-N262 HydrophobicContact CB-CB 4.43Å; Q249-N262 WeakPolarHBondContact O-CB 3.23Å; Q249-N262 PolarHBondContact OE1-ND2 3.28Å
263	G	84	Confident	85.1	Confident	39 Å²	39	63.2 Å²	63.2	40%	0.402	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-0	-175.3	0	0	0	0	0	115.7	P261 N276	P261-G263 PolarHBondContact O-N 3.07Å; G263-N276 PolarHBondContact O-N 2.77Å
264	Y	90.3	Very high	84.8	Confident	82 Å²	82	66.7 Å²	66.7	32%	0.322	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.1	174	-67.1	-110.5	0	0	0	111.4	V251 P261 C273 I274 K275	V251-Y264 WeakPolarHBondContact CG2-O 3.27Å; P261-Y264 HydrophobicContact CB-CD2 4.41Å; P261-Y264 HydrophobicContact CG-CD2 3.73Å; P261-Y264 HydrophobicContact CG-CE2 4.03Å; P261-Y264 HydrophobicContact CG-CG 4.18Å; P261-Y264 WeakPolarHBondContact O-CB 3.35Å; P261-Y264 PolarHBondContact O-N 3.33Å; P261-Y264 VanDerWaalsContact O-N 3.14Å; Y264-C273 HydrophobicContact CD1-CB 3.86Å; Y264-C273 VanDerWaalsContact CD1-O 3.29Å; Y264-C273 WeakPolarHBondContact CD1-O 3.04Å; Y264-C273 HydrophobicContact CG-CB 4.23Å; Y264-I274 CarbonylContact C-O 3.48Å; Y264-I274 WeakPolarHBondContact CA-O 3.41Å; Y264-K275 HydrophobicContact CD1-CB 3.88Å; Y264-K275 HydrophobicContact CE1-CB 3.72Å; Y264-K275 HydrophobicContact CE1-CG 4.35Å; Y264-K275 HydrophobicContact CG-CB 4.48Å
265	T	86.7	Confident	84.6	Confident	65 Å²	65	67.9 Å²	67.9	40%	0.399	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.7	171.6	-60.6	0	0	0	0	108.8	I274 N276	T265-I274 PolarHBondContact N-O 3.49Å; T265-I274 PolarHBondContact O-N 3.4Å; T265-N276 PolarHBondContact OG1-ND2 3.05Å; T265-N276 PolarHBondContact OG1-OD1 3.27Å
266	C	88	Confident	83.7	Confident	26 Å²	26	71.1 Å²	71.1	18%	0.176	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	126	176	-49.7	0	0	0	0	110.9	C253 L268	C253-C266 WeakPolarHBondContact CA-SG 3.45Å; C253-C266 HydrophobicContact CB-CB 3.61Å; C253-C266 WeakPolarHBondContact CB-SG 3.28Å; C253-C266 WeakPolarHBondContact SG-CB 3.39Å; C253-C266 CovalentContact SG-SG 2.03Å; C253-C266 PolarHBondContact SG-SG 2.89Å; C266-L268 HydrophobicContact CB-CD2 4.47Å
267	D	87.1	Confident	81.8	Confident	47 Å²	47	75.7 Å²	75.7	25%	0.251	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	97.1	164.7	-168.7	-23.4	0	0	0	109.6	S269 V270 G271 E272 I274	D267-S269 PolarHBondContact O-N 2.72Å; D267-S269 WeakPolarHBondContact OD1-CA 3.39Å; D267-S269 VanDerWaalsContact OD1-CB 3.32Å; D267-S269 WeakPolarHBondContact OD1-CB 3.07Å; D267-S269 PolarHBondContact OD1-N 3.44Å; D267-S269 PolarHBondContact OD1-OG 3.37Å; D267-V270 PolarHBondContact O-N 2.88Å; D267-G271 PolarHBondContact O-N 2.91Å; D267-E272 PolarHBondContact N-O 2.9Å; D267-E272 PolarHBondContact O-N 2.82Å; D267-I274 HydrophobicContact CB-CD1 3.61Å; D267-I274 HydrophobicContact CB-CG1 3.92Å; D267-I274 WeakPolarHBondContact OD2-CD1 3.29Å
268	L	82.6	Confident	79.7	Confident	82 Å²	82	79 Å²	79	43%	0.429	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.7	178.5	-61	-173.1	0	0	0	113.6	C253 S254 D255 C266	C253-L268 HydrophobicContact CB-CD2 4.08Å; S254-L268 WeakPolarHBondContact OG-CD1 3.36Å; D255-L268 HydrophobicContact CB-CD1 4.17Å; D255-L268 HydrophobicContact CB-CD2 4.14Å; D255-L268 WeakPolarHBondContact OD2-CD2 3.49Å; C266-L268 HydrophobicContact CB-CD2 4.47Å
269	S	79.4	Confident	77.2	Confident	104 Å²	104	80.1 Å²	80.1	73%	0.727	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-19	176	75.4	0	0	0	0	113.2	D267	D267-S269 PolarHBondContact O-N 2.72Å; D267-S269 WeakPolarHBondContact OD1-CA 3.39Å; D267-S269 VanDerWaalsContact OD1-CB 3.32Å; D267-S269 WeakPolarHBondContact OD1-CB 3.07Å; D267-S269 PolarHBondContact OD1-N 3.44Å; D267-S269 PolarHBondContact OD1-OG 3.37Å
270	V	74.1	Confident	74.6	Confident	93 Å²	93	83.3 Å²	83.3	56%	0.564	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-21.3	178.2	-168.2	0	0	0	0	111.9	D267 E272	D267-V270 PolarHBondContact O-N 2.88Å; V270-E272 VanDerWaalsContact C-N 3.29Å; V270-E272 HydrophobicContact CB-CB 4.29Å; V270-E272 HydrophobicContact CG1-CB 4.1Å; V270-E272 HydrophobicContact CG1-CG 3.94Å
271	G	74.4	Confident	71.5	Confident	55 Å²	55	90.5 Å²	90.5	57%	0.567	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	20.3	-170.1	0	0	0	0	0	112.7	D267	D267-G271 PolarHBondContact O-N 2.91Å
272	E	82.3	Confident	68.8	Low	125 Å²	125	96.8 Å²	96.8	58%	0.584	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.1	157.9	-174.6	-77.8	-163.8	160	0	0	113	D267 V270	D267-E272 PolarHBondContact N-O 2.9Å; D267-E272 PolarHBondContact O-N 2.82Å; V270-E272 VanDerWaalsContact C-N 3.29Å; V270-E272 HydrophobicContact CB-CB 4.29Å; V270-E272 HydrophobicContact CG1-CB 4.1Å; V270-E272 HydrophobicContact CG1-CG 3.94Å
273	C	88	Confident	66.2	Low	48 Å²	48	97 Å²	97	32%	0.324	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.3	113	172.8	-63	0	0	0	0	109.4	C260 Y264	C260-C273 WeakPolarHBondContact CA-SG 3.33Å; C260-C273 HydrophobicContact CB-CB 3.77Å; C260-C273 WeakPolarHBondContact CB-SG 3.34Å; C260-C273 WeakPolarHBondContact SG-CA 3.05Å; C260-C273 WeakPolarHBondContact SG-CB 3.32Å; C260-C273 CovalentContact SG-SG 2.04Å; C260-C273 PolarHBondContact SG-SG 3Å; Y264-C273 HydrophobicContact CD1-CB 3.86Å; Y264-C273 VanDerWaalsContact CD1-O 3.29Å; Y264-C273 WeakPolarHBondContact CD1-O 3.04Å; Y264-C273 HydrophobicContact CG-CB 4.23Å
274	I	84.9	Confident	63.8	Low	82 Å²	82	104.7 Å²	104.7	42%	0.421	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.6	126	178.3	-60.2	-174	0	0	0	109.7	Y264 T265 D267 N276	Y264-I274 CarbonylContact C-O 3.48Å; Y264-I274 WeakPolarHBondContact CA-O 3.41Å; T265-I274 PolarHBondContact N-O 3.49Å; T265-I274 PolarHBondContact O-N 3.4Å; D267-I274 HydrophobicContact CB-CD1 3.61Å; D267-I274 HydrophobicContact CB-CG1 3.92Å; D267-I274 WeakPolarHBondContact OD2-CD1 3.29Å; I274-N276 PolarHBondContact O-N 3.06Å
275	K	80.5	Confident	60.8	Low	141 Å²	141	109.6 Å²	109.6	61%	0.613	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.4	127.5	177.7	-170.4	175.4	-178.5	176.6	0	110.2	Y264 S277	Y264-K275 HydrophobicContact CD1-CB 3.88Å; Y264-K275 HydrophobicContact CE1-CB 3.72Å; Y264-K275 HydrophobicContact CE1-CG 4.35Å; Y264-K275 HydrophobicContact CG-CB 4.48Å; K275-S277 PolarHBondContact O-N 3.26Å
276	N	65.1	Low	58	Low	109 Å²	109	114.9 Å²	114.9	58%	0.583	63%	0.626	S	S	*	*			trans	-66.4	107.1	-178.9	-78.3	-31.7	0	0	0	111.8	G263 T265 I274	G263-N276 PolarHBondContact O-N 2.77Å; T265-N276 PolarHBondContact OG1-ND2 3.05Å; T265-N276 PolarHBondContact OG1-OD1 3.27Å; I274-N276 PolarHBondContact O-N 3.06Å
277	S	42	Very low	55	Low	104 Å²	104	118.1 Å²	118.1	73%	0.727	65%	0.649	S	S	*	*			trans	-120.4	80.6	-177.5	61.3	0	0	0	0	112.1	K275	K275-S277 PolarHBondContact O-N 3.26Å
278	H	39.4	Very low	52.1	Low	182 Å²	182	120.8 Å²	120.8	84%	0.843	67%	0.671	S	S	*	*			trans	-135.6	142.5	174.3	-94.3	-92.1	0	0	0	112.7
279	S	34.3	Very low	49.4	Very low	118 Å²	118	124 Å²	124	83%	0.825	69%	0.689	S	S	*	*			trans	65.5	128.3	-175.8	70.8	0	0	0	0	116.6
280	S	34.9	Very low	46.9	Very low	96 Å²	96	124.9 Å²	124.9	67%	0.671	69%	0.69	S	S	*	*			cis	-162.1	138.5	-14.5	51.6	0	0	0	0	113.1
281	N	28.2	Very low	44.7	Very low	153 Å²	153	128 Å²	128	82%	0.818	70%	0.702	S	S	*	*			trans	75.6	152.5	154.8	-59.4	-13.9	0	0	0	121
282	E	32.2	Very low	42.4	Very low	180 Å²	180	132.6 Å²	132.6	84%	0.841	71%	0.713	S	S	*	*			trans	65.4	93.3	172	-51.9	-141.8	112.8	0	0	116.8
283	S	32	Very low	39.8	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	72%	0.719	S	S	*	*			cis	89.5	78.9	37.1	-53.4	0	0	0	0	116.7
284	K	32.9	Very low	37.1	Very low	200 Å²	200	134.8 Å²	134.8	87%	0.87	74%	0.743	S	S	*	*			trans	-177.2	125.2	140.6	-91.4	138.2	-164.6	168.2	0	108
285	K	27	Very low	34.4	Very low	185 Å²	185	137.1 Å²	137.1	80%	0.804	76%	0.755	S	S	*	*				54.1	128.2	72.9	-70.4	-167.2	172.1	-177.7	0	112.2
286	F	27.9	Very low	32.1	Very low	177 Å²	177	136 Å²	136	78%	0.776	76%	0.763	S	S	*	*			cis	-147.7	140.3	15.3	-130.6	-139.5	0	0	0	108.4
287	S	25.8	Very low	30.4	Very low	93 Å²	93	136.4 Å²	136.4	65%	0.65	76%	0.763	S	S	*	*				68.7	102.7	81.4	-158.6	0	0	0	0	117.2
288	S	25.8	Very low	29.9	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	77%	0.772	S	S	*	*			trans	22.7	147.3	149.8	-52.4	0	0	0	0	125.2
289	N	27.4	Very low	29.6	Very low	149 Å²	149	137.8 Å²	137.8	80%	0.797	76%	0.758	S	S	*	*			trans	74.6	123.2	158.7	-60.2	-8.8	0	0	0	118.9
290	T	25.9	Very low	29.3	Very low	123 Å²	123	136.3 Å²	136.3	76%	0.755	76%	0.761	S	S	*	*				168.2	131.8	108.6	-70.9	0	0	0	0	113.2
291	I	28.8	Very low	29.4	Very low	159 Å²	159	135.1 Å²	135.1	82%	0.815	75%	0.753	S	S	*	*			trans	64.6	121.1	162.4	-69.2	164.7	0	0	0	120.9
292	L	25.4	Very low	30.1	Very low	152 Å²	152	132.5 Å²	132.5	80%	0.796	74%	0.739	S	S	*	*			trans	-69.6	140.2	171.6	-176.5	79.8	0	0	0	113.7
293	S	26.8	Very low	31.2	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	71%	0.712	S	S	*	*			trans	-163.8	147.9	148.8	33.9	0	0	0	0	112.1
294	S	32.4	Very low	32.9	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	70%	0.701	S	S	*	*			trans	48.9	92.8	176.1	51.3	0	0	0	0	118
295	L	27.8	Very low	35	Very low	131 Å²	131	115.8 Å²	115.8	69%	0.686	66%	0.66	S	S	*	*			trans	-76.5	170.6	146.4	-99.3	65.4	0	0	0	109.3	I297	L295-I297 HydrophobicContact CD2-CD1 4.3Å; L295-I297 HydrophobicContact CD2-CG1 3.85Å; L295-I297 HydrophobicContact CG-CG1 4.19Å
296	P	32.5	Very low	37.3	Very low	118 Å²	118	110.6 Å²	110.6	77%	0.766	65%	0.646	S	S	*	*			cis	-126.6	171	12.8	37.6	-20.7	0	0	0	114.8
297	I	28.8	Very low	39.3	Very low	116 Å²	116	110.3 Å²	110.3	60%	0.595	65%	0.652	S	S	*	*			cis	-155.2	147.8	-21.4	-107.9	163.3	0	0	0	106	L295 I299	L295-I297 HydrophobicContact CD2-CD1 4.3Å; L295-I297 HydrophobicContact CD2-CG1 3.85Å; L295-I297 HydrophobicContact CG-CG1 4.19Å; I297-I299 HydrophobicContact CG2-CD1 4.04Å; I297-I299 HydrophobicContact CG2-CG1 3.41Å; I297-I299 VanDerWaalsContact CG2-CG1 3.41Å
298	K	31	Very low	41.3	Very low	209 Å²	209	107.4 Å²	107.4	91%	0.909	63%	0.632	S	S	*	*			trans	-84	121.3	165	-72.5	175.6	178.3	174.7	0	109.2
299	I	33.8	Very low	43.3	Very low	107 Å²	107	109.9 Å²	109.9	55%	0.549	64%	0.637	S	S	.	*			trans	-120.7	90.4	159.1	-41.3	-168.5	0	0	0	109.3	I297 S301	I297-I299 HydrophobicContact CG2-CD1 4.04Å; I297-I299 HydrophobicContact CG2-CG1 3.41Å; I297-I299 VanDerWaalsContact CG2-CG1 3.41Å; I299-S301 VanDerWaalsContact CG2-O 3.24Å; I299-S301 WeakPolarHBondContact CG2-O 2.97Å; I299-S301 WeakPolarHBondContact CG2-OG 3.46Å; I299-S301 PolarHBondContact O-N 3.05Å
300	G	28.5	Very low	45.3	Very low	86 Å²	86	103.6 Å²	103.6	89%	0.887	60%	0.604	S	S	*	*			trans	-90.7	52.3	169.7	0	0	0	0	0	111.2
301	S	36.3	Very low	47.5	Very low	72 Å²	72	100.9 Å²	100.9	50%	0.503	58%	0.581	S	S	.	*	S	Bend	trans	-167.8	149.3	-177.9	48.6	0	0	0	0	109.8	I299 A303	I299-S301 VanDerWaalsContact CG2-O 3.24Å; I299-S301 WeakPolarHBondContact CG2-O 2.97Å; I299-S301 WeakPolarHBondContact CG2-OG 3.46Å; I299-S301 PolarHBondContact O-N 3.05Å; S301-A303 PolarHBondContact O-N 2.81Å
302	N	42.9	Very low	49.7	Very low	97 Å²	97	93.3 Å²	93.3	52%	0.519	54%	0.542	S	S	.	.	S	Bend	trans	34.7	67	143.8	-78.5	29.3	0	0	0	115.5	L304 Y311	N302-L304 PolarHBondContact O-N 2.83Å; N302-Y311 VanDerWaalsContact C-CE2 3.48Å; N302-Y311 WeakPolarHBondContact CA-OH 3.37Å; N302-Y311 HydrophobicContact CB-CE2 3.74Å; N302-Y311 WeakPolarHBondContact CB-OH 3.29Å; N302-Y311 VanDerWaalsContact CG-OH 3.22Å; N302-Y311 PolarHBondContact OD1-OH 2.88Å
303	A	55.6	Low	51.8	Low	33 Å²	33	88.1 Å²	88.1	27%	0.273	52%	0.519	S	S	.	.			trans	-66.8	95.3	-162.8	0	0	0	0	0	113.9	S301 C312	S301-A303 PolarHBondContact O-N 2.81Å; A303-C312 PolarHBondContact O-N 2.64Å
304	L	67.3	Low	53.2	Low	99 Å²	99	88.7 Å²	88.7	52%	0.518	51%	0.514	S	S	.	.	B	Isolated β-bridge	trans	-69	130.4	158.6	-167.8	74.4	0	0	0	108.6	N302 S308	N302-L304 PolarHBondContact O-N 2.83Å; L304-S308 VanDerWaalsContact CD1-O 3.25Å; L304-S308 WeakPolarHBondContact CD1-O 3.38Å; L304-S308 WeakPolarHBondContact CG-O 3.37Å
305	C	76.9	Confident	54.8	Low	3 Å²	3	89.1 Å²	89.1	2%	0.02	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-72.9	148.9	175.7	-58.2	0	0	0	0	111.4	D307 S308 V310 C312 C318 W325	C305-D307 PolarHBondContact O-N 3.35Å; C305-S308 PolarHBondContact O-N 3.17Å; C305-V310 HydrophobicContact CB-CB 4.35Å; C305-V310 HydrophobicContact CB-CG1 4.38Å; C305-V310 PolarHBondContact N-O 3.2Å; C305-C312 PolarHBondContact SG-SG 3.19Å; C305-C318 WeakPolarHBondContact CA-SG 3.49Å; C305-C318 HydrophobicContact CB-CB 3.8Å; C305-C318 WeakPolarHBondContact CB-SG 3.38Å; C305-C318 WeakPolarHBondContact SG-CB 3.39Å; C305-C318 CovalentContact SG-SG 2.04Å; C305-C318 PolarHBondContact SG-SG 2.04Å; C305-W325 HydrophobicContact CB-CB 3.98Å; C305-W325 HydrophobicContact CB-CD2 3.6Å; C305-W325 HydrophobicContact CB-CE3 3.66Å; C305-W325 HydrophobicContact CB-CG 3.76Å; C305-W325 HydrophobicContact CB-CZ3 4.34Å
306	P	75.6	Confident	57.1	Low	76 Å²	76	83.7 Å²	83.7	49%	0.494	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	136.7	176.3	-26.4	34	0	0	0	112.1	S308 W325	P306-S308 PolarHBondContact O-N 2.86Å; P306-S308 VanDerWaalsContact O-N 3.14Å; P306-W325 HydrophobicContact CB-CH2 4.15Å; P306-W325 HydrophobicContact CB-CZ2 3.84Å; P306-W325 HydrophobicContact CG-CH2 3.89Å; P306-W325 HydrophobicContact CG-CZ2 4.11Å; P306-W325 WeakPolarHBondContact O-CZ2 3.16Å; P306-W325 PolarHBondContact O-NE1 3Å
307	D	70.5	Confident	59.7	Low	171 Å²	171	79.4 Å²	79.4	91%	0.914	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	37.4	175.7	-52	-40.4	0	0	0	114.6	C305	C305-D307 PolarHBondContact O-N 3.35Å
308	S	68.1	Low	62.5	Low	33 Å²	33	75.3 Å²	75.3	23%	0.231	43%	0.433	C	S	.	.	S	Bend	trans	-153.7	147	-173.5	-153.6	0	0	0	0	115.8	L304 C305 P306 V310	L304-S308 VanDerWaalsContact CD1-O 3.25Å; L304-S308 WeakPolarHBondContact CD1-O 3.38Å; L304-S308 WeakPolarHBondContact CG-O 3.37Å; C305-S308 PolarHBondContact O-N 3.17Å; P306-S308 PolarHBondContact O-N 2.86Å; P306-S308 VanDerWaalsContact O-N 3.14Å; S308-V310 PolarHBondContact O-N 3.32Å; S308-V310 VanDerWaalsContact O-N 3.17Å; S308-V310 WeakPolarHBondContact OG-CG2 3.24Å; S308-V310 PolarHBondContact OG-N 2.55Å
309	D	67.3	Low	65.2	Low	155 Å²	155	65.4 Å²	65.4	83%	0.829	39%	0.39	S	S	*	.	S	Bend	trans	-70.4	1.2	165.8	-56.9	-42.2	0	0	0	113.1	Y311	D309-Y311 PolarHBondContact O-N 3.26Å
310	V	68.6	Low	67.7	Low	17 Å²	17	65 Å²	65	10%	0.103	39%	0.386	C	S	.	.			trans	-76.9	113.3	-175.4	167.8	0	0	0	0	111.1	C305 S308 W325 P373	C305-V310 HydrophobicContact CB-CB 4.35Å; C305-V310 HydrophobicContact CB-CG1 4.38Å; C305-V310 PolarHBondContact N-O 3.2Å; S308-V310 PolarHBondContact O-N 3.32Å; S308-V310 VanDerWaalsContact O-N 3.17Å; S308-V310 WeakPolarHBondContact OG-CG2 3.24Å; S308-V310 PolarHBondContact OG-N 2.55Å; V310-W325 HydrophobicContact CB-CB 3.72Å; V310-W325 HydrophobicContact CG1-CB 3.74Å; V310-W325 HydrophobicContact CG2-CB 3.83Å; V310-P373 HydrophobicContact CB-CB 4.2Å; V310-P373 HydrophobicContact CB-CG 4.11Å; V310-P373 HydrophobicContact CG1-CB 3.72Å; V310-P373 HydrophobicContact CG1-CG 3.56Å; V310-P373 HydrophobicContact CG2-CB 3.79Å; V310-P373 HydrophobicContact CG2-CG 3.44Å; V310-P373 VanDerWaalsContact CG2-CG 3.44Å
311	Y	73.2	Confident	70	Confident	65 Å²	65	64.4 Å²	64.4	26%	0.255	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-93.7	126.2	172.3	-174.3	-92	0	0	0	112.4	N302 D309 C327 K374	N302-Y311 VanDerWaalsContact C-CE2 3.48Å; N302-Y311 WeakPolarHBondContact CA-OH 3.37Å; N302-Y311 HydrophobicContact CB-CE2 3.74Å; N302-Y311 WeakPolarHBondContact CB-OH 3.29Å; N302-Y311 VanDerWaalsContact CG-OH 3.22Å; N302-Y311 PolarHBondContact OD1-OH 2.88Å; D309-Y311 PolarHBondContact O-N 3.26Å; Y311-C327 PolarHBondContact O-SG 3.16Å; Y311-K374 HydrophobicContact CD1-CB 4.49Å; Y311-K374 HydrophobicContact CD1-CD 4.38Å; Y311-K374 PolarHBondContact O-N 3.47Å
312	C	74.3	Confident	72	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.367	C	S	.	.			trans	-109.5	140.4	170.3	-61.3	0	0	0	0	110.7	A303 C305 S316 C318 C327	A303-C312 PolarHBondContact O-N 2.64Å; C305-C312 PolarHBondContact SG-SG 3.19Å; C312-S316 WeakPolarHBondContact CB-OG 3.3Å; C312-C318 VanDerWaalsContact SG-SG 3.66Å; C312-C327 WeakPolarHBondContact CA-SG 3.49Å; C312-C327 HydrophobicContact CB-CB 3.8Å; C312-C327 WeakPolarHBondContact CB-SG 3.44Å; C312-C327 VanDerWaalsContact SG-CA 3.5Å; C312-C327 WeakPolarHBondContact SG-CB 2.92Å; C312-C327 CovalentContact SG-SG 2.04Å; C312-C327 PolarHBondContact SG-SG 2.9Å
313	S	69.7	Low	73.2	Confident	44 Å²	44	71.4 Å²	71.4	31%	0.308	38%	0.382	S	S	.	.			trans	-70.5	162.1	-178.2	48.7	0	0	0	0	112.6	N315 S316	S313-N315 PolarHBondContact O-N 3.11Å; S313-S316 PolarHBondContact N-OG 2.85Å; S313-S316 VanDerWaalsContact N-OG 3.08Å; S313-S316 WeakPolarHBondContact O-CB 3.38Å; S313-S316 PolarHBondContact O-N 2.97Å; S313-S316 VanDerWaalsContact O-N 3.09Å; S313-S316 PolarHBondContact O-OG 3.02Å; S313-S316 PolarHBondContact OG-OG 3.39Å
314	D	55.4	Low	74	Confident	113 Å²	113	77.1 Å²	77.1	60%	0.604	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	137.9	171.4	-52.7	-65.7	0	0	0	110.9
315	N	65.9	Low	74.8	Confident	126 Å²	126	74.4 Å²	74.4	67%	0.674	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	24.8	-175.2	-128.5	30.4	0	0	0	116.1	S313 F330 P331	S313-N315 PolarHBondContact O-N 3.11Å; N315-F330 CarbonylContact O-C 3.46Å; N315-P331 WeakPolarHBondContact O-CD 3.2Å; N315-P331 VanDerWaalsContact O-N 3.16Å
316	S	77.6	Confident	75	Confident	17 Å²	17	74.6 Å²	74.6	12%	0.119	39%	0.386	C	S	.	.			trans	-122.4	153.4	171	64.9	0	0	0	0	113	C312 S313 C328	C312-S316 WeakPolarHBondContact CB-OG 3.3Å; S313-S316 PolarHBondContact N-OG 2.85Å; S313-S316 VanDerWaalsContact N-OG 3.08Å; S313-S316 WeakPolarHBondContact O-CB 3.38Å; S313-S316 PolarHBondContact O-N 2.97Å; S313-S316 VanDerWaalsContact O-N 3.09Å; S313-S316 PolarHBondContact O-OG 3.02Å; S313-S316 PolarHBondContact OG-OG 3.39Å; S316-C328 CarbonylContact C-O 3.56Å; S316-C328 WeakPolarHBondContact CA-O 3Å; S316-C328 WeakPolarHBondContact CB-O 3.43Å
317	T	86.6	Confident	75.6	Confident	29 Å²	29	71.2 Å²	71.2	18%	0.178	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131.1	-176.5	-75	0	0	0	0	112.1	C328 F330 N332 A333	T317-C328 PolarHBondContact N-O 2.64Å; T317-C328 PolarHBondContact O-N 3.49Å; T317-F330 PolarHBondContact N-O 2.77Å; T317-F330 PolarHBondContact OG1-O 3.35Å; T317-N332 WeakPolarHBondContact OG1-CA 3.46Å; T317-N332 PolarHBondContact OG1-N 3.42Å; T317-A333 HydrophobicContact CG2-CB 4.07Å; T317-A333 PolarHBondContact OG1-N 3.37Å; T317-A333 VanDerWaalsContact OG1-N 3.16Å
318	C	87.4	Confident	76.4	Confident	30 Å²	30	63 Å²	63	20%	0.203	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128	168.8	-73.9	0	0	0	0	111.6	C305 C312 W325	C305-C318 WeakPolarHBondContact CA-SG 3.49Å; C305-C318 HydrophobicContact CB-CB 3.8Å; C305-C318 WeakPolarHBondContact CB-SG 3.38Å; C305-C318 WeakPolarHBondContact SG-CB 3.39Å; C305-C318 CovalentContact SG-SG 2.04Å; C305-C318 PolarHBondContact SG-SG 2.04Å; C312-C318 VanDerWaalsContact SG-SG 3.66Å; C318-W325 HydrophobicContact CB-CE3 3.73Å; C318-W325 HydrophobicContact CB-CZ3 3.73Å
319	C	88.1	Confident	77	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.007	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	113.7	174.2	-75	0	0	0	0	111.4	G326 C328 C335 K370	C319-G326 PolarHBondContact N-O 3.17Å; C319-G326 PolarHBondContact O-N 2.71Å; C319-C328 PolarHBondContact SG-SG 3.06Å; C319-C335 VanDerWaalsContact CA-SG 3.56Å; C319-C335 HydrophobicContact CB-CB 3.69Å; C319-C335 WeakPolarHBondContact CB-SG 3.36Å; C319-C335 VanDerWaalsContact SG-CA 3.5Å; C319-C335 WeakPolarHBondContact SG-CB 3.48Å; C319-C335 CovalentContact SG-SG 2.03Å; C319-C335 PolarHBondContact SG-SG 2.03Å; C319-K370 HydrophobicContact CB-CD 4.13Å; C319-K370 VanDerWaalsContact CB-CE 3.45Å; C319-K370 PolarHBondContact O-NZ 2.03Å
320	E	85.1	Confident	77.6	Confident	98 Å²	98	63 Å²	63	46%	0.458	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	159.9	173.9	-153	-169	154.8	0	0	112.2	K323 K324 W325 K370	E320-K323 WeakPolarHBondContact OE1-CA 3.21Å; E320-K324 CarbonylContact C-O 3.4Å; E320-K324 WeakPolarHBondContact CA-O 3.27Å; E320-W325 HydrophobicContact CB-CD2 3.99Å; E320-W325 HydrophobicContact CB-CE3 3.97Å; E320-W325 HydrophobicContact CB-CH2 3.94Å; E320-W325 HydrophobicContact CB-CZ2 3.95Å; E320-W325 HydrophobicContact CB-CZ3 3.96Å; E320-W325 HydrophobicContact CG-CD2 4.08Å; E320-W325 HydrophobicContact CG-CH2 4.49Å; E320-W325 HydrophobicContact CG-CZ2 3.98Å; E320-K370 PolarHBondContact O-NZ 2.05Å
321	H	77.1	Confident	78.1	Confident	74 Å²	74	64.2 Å²	64.2	34%	0.343	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	141	152.9	-177	93.5	0	0	0	108.3	K323 K324 S337 G339	H321-K323 VanDerWaalsContact C-N 3.27Å; H321-K323 PolarHBondContact O-N 2.87Å; H321-K324 PolarHBondContact N-O 2.72Å; H321-K324 WeakPolarHBondContact O-CA 3.07Å; H321-K324 WeakPolarHBondContact O-CB 3.02Å; H321-K324 PolarHBondContact O-N 2.89Å; H321-S337 PolarHBondContact CE1-O 3.18Å; H321-S337 PolarHBondContact ND1-O 3.12Å; H321-G339 WeakPolarHBondContact ND1-CA 3.49Å
322	D	78.2	Confident	78.5	Confident	124 Å²	124	66.5 Å²	66.5	66%	0.663	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	45.4	-179.6	-73.2	-3.7	0	0	0	114.7	K324	D322-K324 PolarHBondContact O-N 3.46Å; D322-K324 VanDerWaalsContact O-N 3.15Å
323	K	68.2	Low	79.1	Confident	191 Å²	191	67 Å²	67	83%	0.83	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	21.5	-176.8	-50.2	-176.9	-178	-176.7	0	114.3	E320 H321	E320-K323 WeakPolarHBondContact OE1-CA 3.21Å; H321-K323 VanDerWaalsContact C-N 3.27Å; H321-K323 PolarHBondContact O-N 2.87Å
324	K	73.6	Confident	80.1	Confident	153 Å²	153	67.5 Å²	67.5	67%	0.665	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.1	177	-66.5	163.9	-174	160.7	0	109.5	E320 H321 D322	E320-K324 CarbonylContact C-O 3.4Å; E320-K324 WeakPolarHBondContact CA-O 3.27Å; H321-K324 PolarHBondContact N-O 2.72Å; H321-K324 WeakPolarHBondContact O-CA 3.07Å; H321-K324 WeakPolarHBondContact O-CB 3.02Å; H321-K324 PolarHBondContact O-N 2.89Å; D322-K324 PolarHBondContact O-N 3.46Å; D322-K324 VanDerWaalsContact O-N 3.15Å
325	W	83.8	Confident	81.7	Confident	43 Å²	43	65 Å²	65	16%	0.163	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.5	179.6	-68.2	86.6	0	0	0	111.6	C305 P306 V310 C318 E320 P373	C305-W325 HydrophobicContact CB-CB 3.98Å; C305-W325 HydrophobicContact CB-CD2 3.6Å; C305-W325 HydrophobicContact CB-CE3 3.66Å; C305-W325 HydrophobicContact CB-CG 3.76Å; C305-W325 HydrophobicContact CB-CZ3 4.34Å; P306-W325 HydrophobicContact CB-CH2 4.15Å; P306-W325 HydrophobicContact CB-CZ2 3.84Å; P306-W325 HydrophobicContact CG-CH2 3.89Å; P306-W325 HydrophobicContact CG-CZ2 4.11Å; P306-W325 WeakPolarHBondContact O-CZ2 3.16Å; P306-W325 PolarHBondContact O-NE1 3Å; V310-W325 HydrophobicContact CB-CB 3.72Å; V310-W325 HydrophobicContact CG1-CB 3.74Å; V310-W325 HydrophobicContact CG2-CB 3.83Å; C318-W325 HydrophobicContact CB-CE3 3.73Å; C318-W325 HydrophobicContact CB-CZ3 3.73Å; E320-W325 HydrophobicContact CB-CD2 3.99Å; E320-W325 HydrophobicContact CB-CE3 3.97Å; E320-W325 HydrophobicContact CB-CH2 3.94Å; E320-W325 HydrophobicContact CB-CZ2 3.95Å; E320-W325 HydrophobicContact CB-CZ3 3.96Å; E320-W325 HydrophobicContact CG-CD2 4.08Å; E320-W325 HydrophobicContact CG-CH2 4.49Å; E320-W325 HydrophobicContact CG-CZ2 3.98Å; W325-P373 WeakPolarHBondContact O-CG 3.28Å
326	G	81.3	Confident	82.9	Confident	6 Å²	6	59.3 Å²	59.3	6%	0.062	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.5	168.9	0	0	0	0	0	110.8	C319	C319-G326 PolarHBondContact N-O 3.17Å; C319-G326 PolarHBondContact O-N 2.71Å
327	C	86.5	Confident	83.3	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.034	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128.1	-173.6	-55.8	0	0	0	0	110.9	Y311 C312 K370 S371	Y311-C327 PolarHBondContact O-SG 3.16Å; C312-C327 WeakPolarHBondContact CA-SG 3.49Å; C312-C327 HydrophobicContact CB-CB 3.8Å; C312-C327 WeakPolarHBondContact CB-SG 3.44Å; C312-C327 VanDerWaalsContact SG-CA 3.5Å; C312-C327 WeakPolarHBondContact SG-CB 2.92Å; C312-C327 CovalentContact SG-SG 2.04Å; C312-C327 PolarHBondContact SG-SG 2.9Å; C327-K370 CarbonylContact O-C 3.48Å; C327-K370 WeakPolarHBondContact O-CA 3.26Å; C327-S371 WeakPolarHBondContact CB-OG 3.47Å; C327-S371 PolarHBondContact N-O 3.04Å; C327-S371 WeakPolarHBondContact O-CA 3.06Å; C327-S371 PolarHBondContact O-N 2.61Å; C327-S371 PolarHBondContact O-OG 2.94Å
328	C	87.3	Confident	83	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.4	170.8	-65.5	0	0	0	0	110.4	S316 T317 C319 F330 A333 C342	S316-C328 CarbonylContact C-O 3.56Å; S316-C328 WeakPolarHBondContact CA-O 3Å; S316-C328 WeakPolarHBondContact CB-O 3.43Å; T317-C328 PolarHBondContact N-O 2.64Å; T317-C328 PolarHBondContact O-N 3.49Å; C319-C328 PolarHBondContact SG-SG 3.06Å; C328-F330 PolarHBondContact O-N 3.42Å; C328-A333 HydrophobicContact CB-CB 3.28Å; C328-C342 WeakPolarHBondContact CA-SG 3.27Å; C328-C342 HydrophobicContact CB-CB 3.61Å; C328-C342 WeakPolarHBondContact CB-SG 3.35Å; C328-C342 WeakPolarHBondContact SG-CB 3.24Å; C328-C342 CovalentContact SG-SG 2.02Å; C328-C342 PolarHBondContact SG-SG 3.07Å
329	L	81.2	Confident	82.4	Confident	121 Å²	121	62.6 Å²	62.6	63%	0.634	33%	0.329	S	S	*	.	S	Bend	trans	-66.8	9.3	-178.2	-62.6	175.8	0	0	0	115.1	S371	L329-S371 WeakPolarHBondContact CD2-OG 3.37Å
330	F	79.7	Confident	82	Confident	65 Å²	65	67.2 Å²	67.2	29%	0.285	35%	0.352	S	S	.	.	S	Bend	trans	-111	141.5	172.1	-52.4	-61	0	0	0	109.9	N315 T317 C328 A333 P344 Q368	N315-F330 CarbonylContact O-C 3.46Å; T317-F330 PolarHBondContact N-O 2.77Å; T317-F330 PolarHBondContact OG1-O 3.35Å; C328-F330 PolarHBondContact O-N 3.42Å; F330-A333 HydrophobicContact CB-CB 4.18Å; F330-P344 HydrophobicContact CD1-CB 4.42Å; F330-P344 HydrophobicContact CD2-CB 4.06Å; F330-P344 HydrophobicContact CE1-CB 4.48Å; F330-P344 HydrophobicContact CE2-CB 4.12Å; F330-P344 HydrophobicContact CE2-CG 4.43Å; F330-P344 HydrophobicContact CG-CB 4.2Å; F330-P344 HydrophobicContact CZ-CB 4.32Å; F330-Q368 HydrophobicContact CE2-CB 4.07Å; F330-Q368 HydrophobicContact CE2-CG 3.58Å; F330-Q368 HydrophobicContact CZ-CB 4.47Å; F330-Q368 HydrophobicContact CZ-CG 3.56Å
331	P	79.2	Confident	82.2	Confident	43 Å²	43	64.2 Å²	64.2	28%	0.279	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	141.4	163	30.9	-33.4	0	0	0	109.6	N315 A333	N315-P331 WeakPolarHBondContact O-CD 3.2Å; N315-P331 VanDerWaalsContact O-N 3.16Å; P331-A333 VanDerWaalsContact C-N 3.29Å; P331-A333 PolarHBondContact O-N 2.04Å
332	N	81.9	Confident	82.8	Confident	113 Å²	113	60.7 Å²	60.7	60%	0.604	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	40.2	-176.7	-45.3	-43.6	0	0	0	113.3	T317 Q345	T317-N332 WeakPolarHBondContact OG1-CA 3.46Å; T317-N332 PolarHBondContact OG1-N 3.42Å; N332-Q345 HydrophobicContact CB-CB 4.12Å; N332-Q345 PolarHBondContact ND2-OE1 3.35Å; N332-Q345 VanDerWaalsContact ND2-OE1 3.12Å; N332-Q345 WeakPolarHBondContact O-CB 3.4Å
333	A	86.6	Confident	83.4	Confident	11 Å²	11	54.8 Å²	54.8	9%	0.091	29%	0.29	C	S	.	.			trans	-62.5	145.3	178.2	0	0	0	0	0	112.2	T317 C328 F330 P331 C343	T317-A333 HydrophobicContact CG2-CB 4.07Å; T317-A333 PolarHBondContact OG1-N 3.37Å; T317-A333 VanDerWaalsContact OG1-N 3.16Å; C328-A333 HydrophobicContact CB-CB 3.28Å; F330-A333 HydrophobicContact CB-CB 4.18Å; P331-A333 VanDerWaalsContact C-N 3.29Å; P331-A333 PolarHBondContact O-N 2.04Å; A333-C343 CarbonylContact C-O 3.47Å; A333-C343 VanDerWaalsContact CA-O 3.3Å; A333-C343 WeakPolarHBondContact CA-O 3.42Å
334	V	90.3	Very high	84.3	Confident	54 Å²	54	46.9 Å²	46.9	33%	0.327	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	114.6	166.8	175.8	0	0	0	0	107.8	C343 T347	V334-C343 HydrophobicContact CB-CB 4.14Å; V334-C343 PolarHBondContact N-O 2.54Å; V334-C343 PolarHBondContact O-N 2.94Å; V334-T347 WeakPolarHBondContact CG2-O 3.42Å
335	C	90.7	Very high	84.7	Confident	61 Å²	61	44.5 Å²	44.5	41%	0.412	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.5	175.4	-49.8	0	0	0	0	110.2	C319	C319-C335 VanDerWaalsContact CA-SG 3.56Å; C319-C335 HydrophobicContact CB-CB 3.69Å; C319-C335 WeakPolarHBondContact CB-SG 3.36Å; C319-C335 VanDerWaalsContact SG-CA 3.5Å; C319-C335 WeakPolarHBondContact SG-CB 3.48Å; C319-C335 CovalentContact SG-SG 2.03Å; C319-C335 PolarHBondContact SG-SG 2.03Å
336	C	89.8	Confident	84.6	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.041	28%	0.275	C	S	.	.			trans	-80.8	150.1	174.5	-66.4	0	0	0	0	112	D338 G339 H341 C349 V351	C336-D338 WeakPolarHBondContact CB-OD1 3.4Å; C336-D338 PolarHBondContact O-N 2.74Å; C336-G339 PolarHBondContact O-N 2.81Å; C336-G339 VanDerWaalsContact O-N 3.16Å; C336-H341 HydrophobicContact CB-CB 3.79Å; C336-H341 WeakPolarHBondContact CB-O 3.03Å; C336-H341 PolarHBondContact N-O 3.32Å; C336-H341 VanDerWaalsContact N-O 3.11Å; C336-C349 HydrophobicContact CB-CB 4.1Å; C336-C349 WeakPolarHBondContact CB-SG 3.19Å; C336-C349 WeakPolarHBondContact SG-CB 3.44Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 2.93Å; C336-V351 HydrophobicContact CB-CG2 4.31Å
337	S	85.7	Confident	84.8	Confident	101 Å²	101	48.9 Å²	48.9	71%	0.706	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.7	179.8	46.3	0	0	0	0	113.5	H321 G339	H321-S337 PolarHBondContact CE1-O 3.18Å; H321-S337 PolarHBondContact ND1-O 3.12Å; S337-G339 PolarHBondContact O-N 3.21Å
338	D	80.4	Confident	84.9	Confident	33 Å²	33	53.2 Å²	53.2	18%	0.176	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-10.7	172.7	61.4	30.5	0	0	0	114.7	C336 I340 H341 V351	C336-D338 WeakPolarHBondContact CB-OD1 3.4Å; C336-D338 PolarHBondContact O-N 2.74Å; D338-I340 PolarHBondContact O-N 2.69Å; D338-I340 PolarHBondContact OD1-N 3.09Å; D338-H341 IonicContact OD1-CG 3.94Å; D338-H341 PolarHBondContact OD1-N 2.02Å; D338-H341 IonicContact OD1-ND1 3.68Å; D338-H341 IonicContact OD2-CE1 2.72Å; D338-H341 IonicContact OD2-CG 3.68Å; D338-H341 IonicContact OD2-ND1 3.77Å; D338-H341 PolarHBondContact OD2-ND1 3.18Å; D338-V351 HydrophobicContact CB-CG1 3.85Å; D338-V351 HydrophobicContact CB-CG2 4.28Å
339	G	75	Confident	84.8	Confident	12 Å²	12	54.6 Å²	54.6	12%	0.124	31%	0.307	C	S	.	.	S	Bend	trans	69	-3.3	-179.7	0	0	0	0	0	116.6	H321 C336 S337 K370	H321-G339 WeakPolarHBondContact ND1-CA 3.49Å; C336-G339 PolarHBondContact O-N 2.81Å; C336-G339 VanDerWaalsContact O-N 3.16Å; S337-G339 PolarHBondContact O-N 3.21Å; G339-K370 WeakPolarHBondContact O-CD 3.08Å; G339-K370 WeakPolarHBondContact O-CE 3.35Å; G339-K370 PolarHBondContact O-NZ 2.96Å
340	I	81	Confident	85	Confident	97 Å²	97	51 Å²	51	50%	0.497	29%	0.288	S	S	.	.	S	Bend	trans	-104.8	-28.8	-176.6	-66.7	164.2	0	0	0	110.1	D338 L369 K370	D338-I340 PolarHBondContact O-N 2.69Å; D338-I340 PolarHBondContact OD1-N 3.09Å; I340-L369 HydrophobicContact CG2-CD2 4.34Å; I340-L369 HydrophobicContact CG2-CG 4.24Å; I340-L369 CarbonylContact O-C 3.52Å; I340-L369 WeakPolarHBondContact O-CA 3.33Å; I340-K370 PolarHBondContact O-N 2.85Å
341	H	87.9	Confident	85.1	Confident	35 Å²	35	50.6 Å²	50.6	16%	0.162	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	164.6	-169.6	-64.3	117.1	0	0	0	115.4	C336 D338 L367 Q368	C336-H341 HydrophobicContact CB-CB 3.79Å; C336-H341 WeakPolarHBondContact CB-O 3.03Å; C336-H341 PolarHBondContact N-O 3.32Å; C336-H341 VanDerWaalsContact N-O 3.11Å; D338-H341 IonicContact OD1-CG 3.94Å; D338-H341 PolarHBondContact OD1-N 2.02Å; D338-H341 IonicContact OD1-ND1 3.68Å; D338-H341 IonicContact OD2-CE1 2.72Å; D338-H341 IonicContact OD2-CG 3.68Å; D338-H341 IonicContact OD2-ND1 3.77Å; D338-H341 PolarHBondContact OD2-ND1 3.18Å; H341-L367 HydrophobicContact CB-CB 3.9Å; H341-L367 HydrophobicContact CB-CD1 3.93Å; H341-L367 HydrophobicContact CB-CD2 4.26Å; H341-L367 HydrophobicContact CB-CG 4.22Å; H341-L367 WeakPolarHBondContact ND1-CD1 3.45Å; H341-Q368 CarbonylContact C-O 3.59Å; H341-Q368 WeakPolarHBondContact CA-O 3.02Å
342	C	89.9	Confident	85	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.7	-176.9	-59.3	0	0	0	0	109.4	C328 Q368 K370	C328-C342 WeakPolarHBondContact CA-SG 3.27Å; C328-C342 HydrophobicContact CB-CB 3.61Å; C328-C342 WeakPolarHBondContact CB-SG 3.35Å; C328-C342 WeakPolarHBondContact SG-CB 3.24Å; C328-C342 CovalentContact SG-SG 2.02Å; C328-C342 PolarHBondContact SG-SG 3.07Å; C342-Q368 HydrophobicContact CB-CB 4.49Å; C342-Q368 WeakPolarHBondContact CB-O 3.03Å; C342-Q368 PolarHBondContact N-O 3.46Å; C342-Q368 PolarHBondContact O-N 2.84Å; C342-Q368 VanDerWaalsContact O-N 3.1Å; C342-K370 VanDerWaalsContact SG-CA 3.58Å; C342-K370 WeakPolarHBondContact SG-CG 3.03Å
343	C	90.9	Very high	84.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	149.3	169	-77.3	0	0	0	0	111.3	A333 V334 T347 C349 C356 L367	A333-C343 CarbonylContact C-O 3.47Å; A333-C343 VanDerWaalsContact CA-O 3.3Å; A333-C343 WeakPolarHBondContact CA-O 3.42Å; V334-C343 HydrophobicContact CB-CB 4.14Å; V334-C343 PolarHBondContact N-O 2.54Å; V334-C343 PolarHBondContact O-N 2.94Å; C343-T347 WeakPolarHBondContact CB-OG1 3.48Å; C343-C349 HydrophobicContact CB-CB 4.45Å; C343-C356 WeakPolarHBondContact CA-SG 3.3Å; C343-C356 HydrophobicContact CB-CB 3.76Å; C343-C356 WeakPolarHBondContact CB-SG 3.2Å; C343-C356 VanDerWaalsContact SG-CA 3.52Å; C343-C356 WeakPolarHBondContact SG-CB 3.4Å; C343-C356 CovalentContact SG-SG 2.04Å; C343-C356 PolarHBondContact SG-SG 2.86Å; C343-L367 WeakPolarHBondContact SG-CD2 3.3Å
344	P	86.5	Confident	84.4	Confident	25 Å²	25	62.3 Å²	62.3	16%	0.162	34%	0.336	C	S	.	.			trans	-67.8	157	176.3	28.8	-34.5	0	0	0	111.5	F330 T347	F330-P344 HydrophobicContact CD1-CB 4.42Å; F330-P344 HydrophobicContact CD2-CB 4.06Å; F330-P344 HydrophobicContact CE1-CB 4.48Å; F330-P344 HydrophobicContact CE2-CB 4.12Å; F330-P344 HydrophobicContact CE2-CG 4.43Å; F330-P344 HydrophobicContact CG-CB 4.2Å; F330-P344 HydrophobicContact CZ-CB 4.32Å; P344-T347 WeakPolarHBondContact CD-OG1 3.39Å; P344-T347 HydrophobicContact CG-CG2 3.98Å; P344-T347 PolarHBondContact O-N 2.92Å; P344-T347 PolarHBondContact O-OG1 2.03Å
345	Q	83.7	Confident	84.1	Confident	103 Å²	103	62.2 Å²	62.2	48%	0.481	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	140.9	175.9	64.5	-172.6	-7.5	0	0	112.5	N332 T347	N332-Q345 HydrophobicContact CB-CB 4.12Å; N332-Q345 PolarHBondContact ND2-OE1 3.35Å; N332-Q345 VanDerWaalsContact ND2-OE1 3.12Å; N332-Q345 WeakPolarHBondContact O-CB 3.4Å; Q345-T347 VanDerWaalsContact C-N 3.34Å; Q345-T347 PolarHBondContact O-N 3.17Å
346	N	80.2	Confident	83.7	Confident	131 Å²	131	59.3 Å²	59.3	70%	0.701	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	17.4	-175.5	-59.9	-26.5	0	0	0	117.2
347	T	86.9	Confident	83.4	Confident	10 Å²	10	61.6 Å²	61.6	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	154.7	168.1	62.2	0	0	0	0	112	V334 C343 P344 Q345 I357	V334-T347 WeakPolarHBondContact CG2-O 3.42Å; C343-T347 WeakPolarHBondContact CB-OG1 3.48Å; P344-T347 WeakPolarHBondContact CD-OG1 3.39Å; P344-T347 HydrophobicContact CG-CG2 3.98Å; P344-T347 PolarHBondContact O-N 2.92Å; P344-T347 PolarHBondContact O-OG1 2.03Å; Q345-T347 VanDerWaalsContact C-N 3.34Å; Q345-T347 PolarHBondContact O-N 3.17Å; T347-I357 CarbonylContact C-O 3.52Å; T347-I357 WeakPolarHBondContact CA-O 3.24Å
348	I	87.1	Confident	83.1	Confident	97 Å²	97	57.4 Å²	57.4	50%	0.497	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	134.5	174.7	-58.1	174.9	0	0	0	107.2	C356 I357	I348-C356 CarbonylContact O-C 3.57Å; I348-C356 WeakPolarHBondContact O-CA 3.35Å; I348-I357 PolarHBondContact N-O 3.06Å; I348-I357 PolarHBondContact O-N 2.65Å
349	C	86.7	Confident	82.5	Confident	29 Å²	29	64.2 Å²	64.2	20%	0.196	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	116.2	175.9	-177.4	0	0	0	0	110.9	C336 C343 L367	C336-C349 HydrophobicContact CB-CB 4.1Å; C336-C349 WeakPolarHBondContact CB-SG 3.19Å; C336-C349 WeakPolarHBondContact SG-CB 3.44Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 2.93Å; C343-C349 HydrophobicContact CB-CB 4.45Å; C349-L367 WeakPolarHBondContact SG-CD2 3.33Å
350	D	85.8	Confident	81.8	Confident	45 Å²	45	67.5 Å²	67.5	24%	0.241	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	105.1	167.4	-166.6	-36.2	0	0	0	109.3	Q352 E353 E354 M355 I357	D350-Q352 VanDerWaalsContact C-N 3.35Å; D350-Q352 WeakPolarHBondContact OD1-CA 3.43Å; D350-Q352 PolarHBondContact OD1-N 2.93Å; D350-E353 PolarHBondContact OD1-N 3.23Å; D350-E354 PolarHBondContact O-N 3.21Å; D350-M355 WeakPolarHBondContact CA-O 3.26Å; D350-M355 WeakPolarHBondContact CB-O 3.17Å; D350-M355 PolarHBondContact N-O 3.47Å; D350-M355 PolarHBondContact O-N 3.33Å; D350-I357 HydrophobicContact CB-CD1 3.86Å; D350-I357 HydrophobicContact CB-CG1 4.35Å
351	V	80.2	Confident	80.8	Confident	57 Å²	57	65 Å²	65	35%	0.345	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.6	179.6	176.2	0	0	0	0	111.8	C336 D338	C336-V351 HydrophobicContact CB-CG2 4.31Å; D338-V351 HydrophobicContact CB-CG1 3.85Å; D338-V351 HydrophobicContact CB-CG2 4.28Å
352	Q	78.7	Confident	79.3	Confident	180 Å²	180	70.1 Å²	70.1	84%	0.841	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-38.1	-177.1	-60.6	-173.9	3.1	0	0	111.2	D350	D350-Q352 VanDerWaalsContact C-N 3.35Å; D350-Q352 WeakPolarHBondContact OD1-CA 3.43Å; D350-Q352 PolarHBondContact OD1-N 2.93Å
353	E	78.3	Confident	77.4	Confident	125 Å²	125	75.4 Å²	75.4	58%	0.584	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-1	-179.8	-65.1	-65.1	138.1	0	0	114.3	D350 M355	D350-E353 PolarHBondContact OD1-N 3.23Å; E353-M355 HydrophobicContact CB-CB 4.47Å; E353-M355 HydrophobicContact CB-CE 3.85Å; E353-M355 HydrophobicContact CB-CG 4.06Å; E353-M355 HydrophobicContact CG-CE 4.39Å; E353-M355 WeakPolarHBondContact O-CG 2.97Å
354	E	77	Confident	76.1	Confident	108 Å²	108	80.2 Å²	80.2	51%	0.505	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	37.7	-168.6	-55.8	-173.8	160.8	0	0	114.4	D350 K366 L367	D350-E354 PolarHBondContact O-N 3.21Å; E354-K366 IonicContact OE2-NZ 3.81Å; E354-K366 PolarHBondContact OE2-NZ 2.03Å; E354-L367 VanDerWaalsContact C-CG 3.49Å; E354-L367 HydrophobicContact CB-CD1 4.42Å; E354-L367 PolarHBondContact O-N 2.8Å; E354-L367 VanDerWaalsContact O-N 3.16Å
355	M	83	Confident	75.1	Confident	51 Å²	51	81.3 Å²	81.3	25%	0.251	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	145.9	-172.8	-58.5	-157.1	-67.4	0	0	115.3	D350 E353 I357 I364	D350-M355 WeakPolarHBondContact CA-O 3.26Å; D350-M355 WeakPolarHBondContact CB-O 3.17Å; D350-M355 PolarHBondContact N-O 3.47Å; D350-M355 PolarHBondContact O-N 3.33Å; E353-M355 HydrophobicContact CB-CB 4.47Å; E353-M355 HydrophobicContact CB-CE 3.85Å; E353-M355 HydrophobicContact CB-CG 4.06Å; E353-M355 HydrophobicContact CG-CE 4.39Å; E353-M355 WeakPolarHBondContact O-CG 2.97Å; M355-I357 HydrophobicContact CB-CG1 4.3Å; M355-I364 HydrophobicContact CB-CG2 4.34Å; M355-I364 HydrophobicContact CE-CG2 4.45Å; M355-I364 HydrophobicContact CG-CG2 4.24Å; M355-I364 HydrophobicContact SD-CG2 3.34Å; M355-I364 WeakPolarHBondContact SD-CG2 3.47Å
356	C	83.7	Confident	74.7	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.9	163.4	-58.1	0	0	0	0	108.8	C343 I348 T365	C343-C356 WeakPolarHBondContact CA-SG 3.3Å; C343-C356 HydrophobicContact CB-CB 3.76Å; C343-C356 WeakPolarHBondContact CB-SG 3.2Å; C343-C356 VanDerWaalsContact SG-CA 3.52Å; C343-C356 WeakPolarHBondContact SG-CB 3.4Å; C343-C356 CovalentContact SG-SG 2.04Å; C343-C356 PolarHBondContact SG-SG 2.86Å; I348-C356 CarbonylContact O-C 3.57Å; I348-C356 WeakPolarHBondContact O-CA 3.35Å; C356-T365 WeakPolarHBondContact CB-O 3.48Å; C356-T365 PolarHBondContact N-O 2.81Å; C356-T365 PolarHBondContact O-N 3.34Å; C356-T365 VanDerWaalsContact O-N 3.16Å
357	I	84	Confident	74.5	Confident	54 Å²	54	77 Å²	77	28%	0.277	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.1	-173.2	-54.4	175.9	0	0	0	109.4	T347 I348 D350 M355	T347-I357 CarbonylContact C-O 3.52Å; T347-I357 WeakPolarHBondContact CA-O 3.24Å; I348-I357 PolarHBondContact N-O 3.06Å; I348-I357 PolarHBondContact O-N 2.65Å; D350-I357 HydrophobicContact CB-CD1 3.86Å; D350-I357 HydrophobicContact CB-CG1 4.35Å; M355-I357 HydrophobicContact CB-CG1 4.3Å
358	S	77.9	Confident	73.7	Confident	14 Å²	14	81 Å²	81	10%	0.098	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	150.1	174.6	59.3	0	0	0	0	113	S360 G361 M363	S358-S360 PolarHBondContact O-N 2.94Å; S358-G361 PolarHBondContact O-N 2.69Å; S358-G361 PolarHBondContact OG-N 3.03Å; S358-M363 VanDerWaalsContact CB-O 3.27Å; S358-M363 WeakPolarHBondContact CB-O 2.99Å; S358-M363 PolarHBondContact N-O 2.95Å; S358-M363 WeakPolarHBondContact OG-CA 3.38Å; S358-M363 PolarHBondContact OG-N 3.42Å; S358-M363 PolarHBondContact OG-O 2.76Å
359	K	67.5	Low	72.9	Confident	175 Å²	175	82 Å²	82	76%	0.761	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-6.3	175.7	-67.3	-171.7	176.9	-175.3	0	114.8
360	S	61.7	Low	71.8	Confident	81 Å²	81	81.8 Å²	81.8	57%	0.566	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-3.8	171.1	71.1	0	0	0	0	113.8	S358 D362	S358-S360 PolarHBondContact O-N 2.94Å; S360-D362 VanDerWaalsContact CB-OD2 3.26Å; S360-D362 WeakPolarHBondContact CB-OD2 3.43Å; S360-D362 PolarHBondContact O-N 2.8Å; S360-D362 VanDerWaalsContact O-N 3.07Å; S360-D362 PolarHBondContact OG-OD2 3.23Å
361	G	59	Low	70.5	Confident	45 Å²	45	81.2 Å²	81.2	46%	0.464	42%	0.421	S	S	.	.	S	Bend	trans	77.7	-31.7	-176.3	0	0	0	0	0	114.9	S358 M363	S358-G361 PolarHBondContact O-N 2.69Å; S358-G361 PolarHBondContact OG-N 3.03Å; G361-M363 VanDerWaalsContact C-N 3.31Å; G361-M363 PolarHBondContact O-N 2.89Å
362	D	57.9	Low	69.1	Low	142 Å²	142	84.2 Å²	84.2	76%	0.759	44%	0.44	S	S	*	.	S	Bend	trans	-63.4	-30.7	-172.2	-48.3	-69.2	0	0	0	114.8	S360	S360-D362 VanDerWaalsContact CB-OD2 3.26Å; S360-D362 WeakPolarHBondContact CB-OD2 3.43Å; S360-D362 PolarHBondContact O-N 2.8Å; S360-D362 VanDerWaalsContact O-N 3.07Å; S360-D362 PolarHBondContact OG-OD2 3.23Å
363	M	49.5	Very low	67.3	Low	111 Å²	111	77 Å²	77	55%	0.547	41%	0.408	S	S	.	.			trans	-108.3	114.8	-176.8	-167.3	177.2	-168.3	0	0	110.8	S358 G361 T365	S358-M363 VanDerWaalsContact CB-O 3.27Å; S358-M363 WeakPolarHBondContact CB-O 2.99Å; S358-M363 PolarHBondContact N-O 2.95Å; S358-M363 WeakPolarHBondContact OG-CA 3.38Å; S358-M363 PolarHBondContact OG-N 3.42Å; S358-M363 PolarHBondContact OG-O 2.76Å; G361-M363 VanDerWaalsContact C-N 3.31Å; G361-M363 PolarHBondContact O-N 2.89Å; M363-T365 HydrophobicContact CE-CG2 4.09Å
364	I	64.1	Low	65.3	Low	102 Å²	102	77.8 Å²	77.8	52%	0.523	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.4	173.3	-60.9	175.8	0	0	0	107.1	M355	M355-I364 HydrophobicContact CB-CG2 4.34Å; M355-I364 HydrophobicContact CE-CG2 4.45Å; M355-I364 HydrophobicContact CG-CG2 4.24Å; M355-I364 HydrophobicContact SD-CG2 3.34Å; M355-I364 WeakPolarHBondContact SD-CG2 3.47Å
365	T	64.4	Low	63	Low	47 Å²	47	77.7 Å²	77.7	29%	0.288	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143	173.3	41.6	0	0	0	0	109.7	C356 M363	C356-T365 WeakPolarHBondContact CB-O 3.48Å; C356-T365 PolarHBondContact N-O 2.81Å; C356-T365 PolarHBondContact O-N 3.34Å; C356-T365 VanDerWaalsContact O-N 3.16Å; M363-T365 HydrophobicContact CE-CG2 4.09Å
366	K	75.1	Confident	60.4	Low	130 Å²	130	80.4 Å²	80.4	57%	0.565	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	145.4	176	-82.9	-170.2	159.9	-84.4	0	110.8	E354 Q368	E354-K366 IonicContact OE2-NZ 3.81Å; E354-K366 PolarHBondContact OE2-NZ 2.03Å; K366-Q368 PolarHBondContact O-N 3.41Å; K366-Q368 PolarHBondContact O-NE2 3.4Å
367	L	75.6	Confident	57.8	Low	15 Å²	15	85.7 Å²	85.7	8%	0.079	46%	0.461	C	S	.	.			trans	-45.9	129	169.4	-65.2	-178	0	0	0	110.4	H341 C343 C349 E354	H341-L367 HydrophobicContact CB-CB 3.9Å; H341-L367 HydrophobicContact CB-CD1 3.93Å; H341-L367 HydrophobicContact CB-CD2 4.26Å; H341-L367 HydrophobicContact CB-CG 4.22Å; H341-L367 WeakPolarHBondContact ND1-CD1 3.45Å; C343-L367 WeakPolarHBondContact SG-CD2 3.3Å; C349-L367 WeakPolarHBondContact SG-CD2 3.33Å; E354-L367 VanDerWaalsContact C-CG 3.49Å; E354-L367 HydrophobicContact CB-CD1 4.42Å; E354-L367 PolarHBondContact O-N 2.8Å; E354-L367 VanDerWaalsContact O-N 3.16Å
368	Q	71.1	Confident	55.5	Low	94 Å²	94	90.2 Å²	90.2	44%	0.439	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	132.9	168.7	-61.4	-51.9	-73.3	0	0	108	F330 H341 C342 K366 K370	F330-Q368 HydrophobicContact CE2-CB 4.07Å; F330-Q368 HydrophobicContact CE2-CG 3.58Å; F330-Q368 HydrophobicContact CZ-CB 4.47Å; F330-Q368 HydrophobicContact CZ-CG 3.56Å; H341-Q368 CarbonylContact C-O 3.59Å; H341-Q368 WeakPolarHBondContact CA-O 3.02Å; C342-Q368 HydrophobicContact CB-CB 4.49Å; C342-Q368 WeakPolarHBondContact CB-O 3.03Å; C342-Q368 PolarHBondContact N-O 3.46Å; C342-Q368 PolarHBondContact O-N 2.84Å; C342-Q368 VanDerWaalsContact O-N 3.1Å; K366-Q368 PolarHBondContact O-N 3.41Å; K366-Q368 PolarHBondContact O-NE2 3.4Å; Q368-K370 PolarHBondContact O-N 2.89Å
369	L	69	Low	53.8	Low	118 Å²	118	97 Å²	97	62%	0.618	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	141.9	169.9	-73.9	81.1	0	0	0	108.8	I340 S371	I340-L369 HydrophobicContact CG2-CD2 4.34Å; I340-L369 HydrophobicContact CG2-CG 4.24Å; I340-L369 CarbonylContact O-C 3.52Å; I340-L369 WeakPolarHBondContact O-CA 3.33Å; L369-S371 PolarHBondContact O-N 3.44Å
370	K	65.2	Low	52	Low	23 Å²	23	92.6 Å²	92.6	10%	0.1	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-48.8	118.4	157.3	-69.8	-179.6	-167.5	-178.3	0	106.4	C319 E320 C327 G339 I340 C342 Q368 T372	C319-K370 HydrophobicContact CB-CD 4.13Å; C319-K370 VanDerWaalsContact CB-CE 3.45Å; C319-K370 PolarHBondContact O-NZ 2.03Å; E320-K370 PolarHBondContact O-NZ 2.05Å; C327-K370 CarbonylContact O-C 3.48Å; C327-K370 WeakPolarHBondContact O-CA 3.26Å; G339-K370 WeakPolarHBondContact O-CD 3.08Å; G339-K370 WeakPolarHBondContact O-CE 3.35Å; G339-K370 PolarHBondContact O-NZ 2.96Å; I340-K370 PolarHBondContact O-N 2.85Å; C342-K370 VanDerWaalsContact SG-CA 3.58Å; C342-K370 WeakPolarHBondContact SG-CG 3.03Å; Q368-K370 PolarHBondContact O-N 2.89Å; K370-T372 PolarHBondContact O-N 2.03Å
371	S	57.9	Low	50.6	Low	34 Å²	34	92.2 Å²	92.2	24%	0.238	49%	0.489	C	S	.	.	B	Isolated β-bridge	trans	-54.9	128.3	161.2	50.3	0	0	0	0	107.2	C327 L329 L369	C327-S371 WeakPolarHBondContact CB-OG 3.47Å; C327-S371 PolarHBondContact N-O 3.04Å; C327-S371 WeakPolarHBondContact O-CA 3.06Å; C327-S371 PolarHBondContact O-N 2.61Å; C327-S371 PolarHBondContact O-OG 2.94Å; L329-S371 WeakPolarHBondContact CD2-OG 3.37Å; L369-S371 PolarHBondContact O-N 3.44Å
372	T	49.9	Very low	49.6	Very low	119 Å²	119	92 Å²	92	73%	0.73	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-49.7	141.9	170.5	51.4	0	0	0	0	108	K370	K370-T372 PolarHBondContact O-N 2.03Å
373	P	42.3	Very low	49.2	Very low	28 Å²	28	89 Å²	89	18%	0.182	46%	0.459	C	S	.	.			trans	-40.5	150.7	168.7	-32.6	37.9	0	0	0	111.7	V310 W325 L375	V310-P373 HydrophobicContact CB-CB 4.2Å; V310-P373 HydrophobicContact CB-CG 4.11Å; V310-P373 HydrophobicContact CG1-CB 3.72Å; V310-P373 HydrophobicContact CG1-CG 3.56Å; V310-P373 HydrophobicContact CG2-CB 3.79Å; V310-P373 HydrophobicContact CG2-CG 3.44Å; V310-P373 VanDerWaalsContact CG2-CG 3.44Å; W325-P373 WeakPolarHBondContact O-CG 3.28Å; P373-L375 HydrophobicContact CB-CB 4.25Å; P373-L375 PolarHBondContact O-N 3.23Å
374	K	35	Very low	49.7	Very low	142 Å²	142	88.8 Å²	88.8	62%	0.617	46%	0.459	S	S	*	.			trans	-70.3	66.1	157.3	-77.1	-175.6	178.2	177.5	0	108.7	Y311 H376	Y311-K374 HydrophobicContact CD1-CB 4.49Å; Y311-K374 HydrophobicContact CD1-CD 4.38Å; Y311-K374 PolarHBondContact O-N 3.47Å; K374-H376 PolarHBondContact O-N 3.14Å
375	L	28.9	Very low	49.8	Very low	106 Å²	106	86 Å²	86	56%	0.555	45%	0.445	S	S	*	.			trans	-70.1	69	172.2	-177.3	63.7	0	0	0	108.1	P373 S377 K379	P373-L375 HydrophobicContact CB-CB 4.25Å; P373-L375 PolarHBondContact O-N 3.23Å; L375-S377 PolarHBondContact O-N 3.25Å; L375-K379 VanDerWaalsContact O-CE 3.26Å; L375-K379 WeakPolarHBondContact O-CE 3.05Å
376	H	28.5	Very low	50.3	Low	109 Å²	109	89.2 Å²	89.2	51%	0.505	46%	0.459	S	S	.	.			trans	22.9	82.3	180	-148.3	-73.3	0	0	0	112.3	K374 F378 K379	K374-H376 PolarHBondContact O-N 3.14Å; H376-F378 CarbonylContact C-O 3.38Å; H376-F378 VanDerWaalsContact C-O 3.27Å; H376-F378 PolarHBondContact ND1-O 2.87Å; H376-F378 CarbonylContact O-C 3.44Å; H376-K379 WeakPolarHBondContact O-CA 3.2Å; H376-K379 WeakPolarHBondContact O-CG 3.07Å; H376-K379 PolarHBondContact O-N 2.83Å
377	S	29.2	Very low	50.5	Low	110 Å²	110	83.1 Å²	83.1	77%	0.769	43%	0.433	S	S	*	.	S	Bend	trans	-106.2	20.4	-173.3	-162.3	0	0	0	0	116.1	L375	L375-S377 PolarHBondContact O-N 3.25Å
378	F	36.8	Very low	50.6	Low	149 Å²	149	88.5 Å²	88.5	65%	0.654	47%	0.472	S	S	*	.	S	Bend		-70.2	94.8	111.3	-72.4	-93.7	0	0	0	105.8	H376 S380	H376-F378 CarbonylContact C-O 3.38Å; H376-F378 VanDerWaalsContact C-O 3.27Å; H376-F378 PolarHBondContact ND1-O 2.87Å; H376-F378 CarbonylContact O-C 3.44Å; F378-S380 CarbonylContact O-C 3.55Å; F378-S380 PolarHBondContact O-N 2.9Å
379	K	40.7	Very low	50.7	Low	157 Å²	157	86 Å²	86	68%	0.683	46%	0.461	S	S	*	.	S	Bend	trans	-74.4	35.1	-176.6	-102.1	-162	176.8	-167	0	115	L375 H376	L375-K379 VanDerWaalsContact O-CE 3.26Å; L375-K379 WeakPolarHBondContact O-CE 3.05Å; H376-K379 WeakPolarHBondContact O-CA 3.2Å; H376-K379 WeakPolarHBondContact O-CG 3.07Å; H376-K379 PolarHBondContact O-N 2.83Å
380	S	31	Very low	50.5	Low	82 Å²	82	87.7 Å²	87.7	57%	0.573	47%	0.468	S	S	*	.	S	Bend	trans	-156.5	109.7	161.4	39.4	0	0	0	0	105.6	F378 S382	F378-S380 CarbonylContact O-C 3.55Å; F378-S380 PolarHBondContact O-N 2.9Å; S380-S382 PolarHBondContact O-N 2.97Å; S380-S382 VanDerWaalsContact O-N 3.15Å
381	N	30.7	Very low	50.8	Low	73 Å²	73	92 Å²	92	39%	0.39	49%	0.487	S	S	.	.				45.5	65.5	111.3	-148.9	42.8	0	0	0	115.6	R383 E415	N381-R383 PolarHBondContact ND2-NE 3.23Å; N381-R383 PolarHBondContact ND2-NH2 2.9Å; N381-R383 PolarHBondContact O-N 3.16Å; N381-E415 PolarHBondContact ND2-OE1 3.41Å; N381-E415 PolarHBondContact ND2-OE2 2.82Å
382	S	38.5	Very low	51.7	Low	40 Å²	40	90.8 Å²	90.8	28%	0.28	48%	0.479	S	S	.	.			trans	-72.7	74.6	154.7	-71.5	0	0	0	0	109.1	S380 I384 N396	S380-S382 PolarHBondContact O-N 2.97Å; S380-S382 VanDerWaalsContact O-N 3.15Å; S382-I384 VanDerWaalsContact C-N 3.27Å; S382-I384 PolarHBondContact O-N 3.04Å; S382-N396 WeakPolarHBondContact CA-OD1 3.36Å; S382-N396 WeakPolarHBondContact CB-OD1 2.99Å; S382-N396 PolarHBondContact OG-OD1 2.73Å
383	R	49.7	Very low	53.1	Low	81 Å²	81	85.9 Å²	85.9	31%	0.306	45%	0.448	S	S	.	.			trans	-56.8	99.4	159.2	-91.8	-169.7	-77.7	-162	-11.6	107.3	N381 N385 N396 E415 N416	N381-R383 PolarHBondContact ND2-NE 3.23Å; N381-R383 PolarHBondContact ND2-NH2 2.9Å; N381-R383 PolarHBondContact O-N 3.16Å; R383-N385 PolarHBondContact O-N 3.33Å; R383-N385 VanDerWaalsContact O-N 3.11Å; R383-N396 PolarHBondContact O-N 3.48Å; R383-N396 VanDerWaalsContact O-N 3.15Å; R383-E415 IonicContact CZ-OE1 3.62Å; R383-E415 IonicContact CZ-OE2 3.5Å; R383-E415 IonicContact NE-OE1 3.74Å; R383-E415 PolarHBondContact NE-OE1 2.04Å; R383-E415 IonicContact NE-OE2 3.84Å; R383-E415 IonicContact NH2-OE1 2.89Å; R383-E415 PolarHBondContact NH2-OE1 2.04Å; R383-E415 IonicContact NH2-OE2 2.73Å; R383-E415 PolarHBondContact NH2-OE2 2.97Å; R383-N416 PolarHBondContact NH1-OD1 2.72Å; R383-N416 PolarHBondContact NH2-ND2 2.92Å; R383-N416 VanDerWaalsContact NH2-ND2 3.18Å; R383-N416 PolarHBondContact NH2-OD1 2.03Å
384	I	59.9	Low	54.9	Low	106 Å²	106	84.6 Å²	84.6	54%	0.544	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	85.6	157.6	-65.8	177.9	0	0	0	104.3	S382 I386 V393	S382-I384 VanDerWaalsContact C-N 3.27Å; S382-I384 PolarHBondContact O-N 3.04Å; I384-I386 HydrophobicContact CG2-CG1 4.38Å; I384-I386 PolarHBondContact O-N 2.98Å; I384-I386 VanDerWaalsContact O-N 3.13Å; I384-V393 HydrophobicContact CG2-CG1 3.71Å; I384-V393 HydrophobicContact CG2-CG2 4.16Å
385	N	67.2	Low	56.9	Low	44 Å²	44	82.4 Å²	82.4	24%	0.235	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	101.8	171.9	-70.5	-34.4	0	0	0	106.4	R383 C387 C394 G397 C399	R383-N385 PolarHBondContact O-N 3.33Å; R383-N385 VanDerWaalsContact O-N 3.11Å; N385-C387 PolarHBondContact O-N 3.15Å; N385-C394 HydrophobicContact CB-CB 4.35Å; N385-C394 PolarHBondContact N-O 3.26Å; N385-C394 PolarHBondContact O-N 3.39Å; N385-G397 PolarHBondContact ND2-O 2.88Å; N385-C399 PolarHBondContact O-SG 3.2Å; N385-C399 VanDerWaalsContact O-SG 3.39Å
386	I	75	Confident	58.9	Low	113 Å²	113	80.7 Å²	80.7	58%	0.579	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	126	165.8	-57.4	172.9	0	0	0	106.2	I384 M390 V393	I384-I386 HydrophobicContact CG2-CG1 4.38Å; I384-I386 PolarHBondContact O-N 2.98Å; I384-I386 VanDerWaalsContact O-N 3.13Å; I386-M390 HydrophobicContact CG2-SD 4.07Å; I386-V393 HydrophobicContact CG1-CG2 4.31Å
387	C	79.5	Confident	61.4	Low	3 Å²	3	75.6 Å²	75.6	2%	0.02	40%	0.402	C	S	.	.			trans	-84.9	164.5	-175.4	-56.2	0	0	0	0	111.8	N385 D389 M390 S392 C399 T409	N385-C387 PolarHBondContact O-N 3.15Å; C387-D389 PolarHBondContact O-N 2.87Å; C387-M390 PolarHBondContact O-N 2.03Å; C387-S392 WeakPolarHBondContact CB-O 3.31Å; C387-S392 PolarHBondContact N-O 2.82Å; C387-S392 PolarHBondContact SG-O 3.27Å; C387-C399 WeakPolarHBondContact CA-SG 3.01Å; C387-C399 HydrophobicContact CB-CB 3.71Å; C387-C399 WeakPolarHBondContact CB-SG 3.41Å; C387-C399 WeakPolarHBondContact SG-CB 3.39Å; C387-C399 CovalentContact SG-SG 2.05Å; C387-C399 PolarHBondContact SG-SG 2.01Å; C387-T409 HydrophobicContact CB-CG2 3.77Å; C387-T409 WeakPolarHBondContact SG-CG2 3.37Å
388	S	76.6	Confident	64.3	Low	128 Å²	128	71.4 Å²	71.4	90%	0.895	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.2	-174.6	-51.2	0	0	0	0	114.8	M390	S388-M390 VanDerWaalsContact C-N 3.3Å
389	D	72.5	Confident	66.7	Low	40 Å²	40	65.9 Å²	65.9	21%	0.214	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.3	172.7	60.2	20.5	0	0	0	113.7	C387 K391 S392 T409	C387-D389 PolarHBondContact O-N 2.87Å; D389-K391 PolarHBondContact O-N 3.39Å; D389-K391 PolarHBondContact OD1-N 2.61Å; D389-S392 VanDerWaalsContact OD1-CB 3.26Å; D389-S392 WeakPolarHBondContact OD1-CB 3.34Å; D389-S392 PolarHBondContact OD1-N 3.18Å; D389-S392 PolarHBondContact OD1-OG 3.47Å; D389-S392 WeakPolarHBondContact OD2-CB 3.22Å; D389-S392 PolarHBondContact OD2-OG 2.78Å; D389-T409 WeakPolarHBondContact OD2-CB 3.31Å; D389-T409 PolarHBondContact OD2-OG1 2.85Å
390	M	66.2	Low	69.1	Low	155 Å²	155	58.5 Å²	58.5	76%	0.764	32%	0.319	S	S	*	.	S	Bend	trans	55.3	11.1	-174.6	-60.8	-73.4	-93.1	0	0	114.8	I386 C387 S388	I386-M390 HydrophobicContact CG2-SD 4.07Å; C387-M390 PolarHBondContact O-N 2.03Å; S388-M390 VanDerWaalsContact C-N 3.3Å
391	K	70.7	Confident	71.5	Confident	112 Å²	112	59 Å²	59	49%	0.487	32%	0.323	S	S	.	.	S	Bend	trans	-118.5	-21.1	-178.8	-68.3	172.2	-174.7	174.2	0	111.9	D389 H463 V464	D389-K391 PolarHBondContact O-N 3.39Å; D389-K391 PolarHBondContact OD1-N 2.61Å; K391-H463 CarbonylContact O-C 3.49Å; K391-H463 WeakPolarHBondContact O-CA 2.88Å; K391-V464 PolarHBondContact O-N 3.42Å
392	S	76.1	Confident	73.6	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.07	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.3	-177.3	-64.7	0	0	0	0	111.4	C387 D389	C387-S392 WeakPolarHBondContact CB-O 3.31Å; C387-S392 PolarHBondContact N-O 2.82Å; C387-S392 PolarHBondContact SG-O 3.27Å; D389-S392 VanDerWaalsContact OD1-CB 3.26Å; D389-S392 WeakPolarHBondContact OD1-CB 3.34Å; D389-S392 PolarHBondContact OD1-N 3.18Å; D389-S392 PolarHBondContact OD1-OG 3.47Å; D389-S392 WeakPolarHBondContact OD2-CB 3.22Å; D389-S392 PolarHBondContact OD2-OG 2.78Å
393	V	80.3	Confident	75.1	Confident	16 Å²	16	59.5 Å²	59.5	10%	0.097	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.9	175	158	0	0	0	0	110.4	I384 I386 I395 L462 V464	I384-V393 HydrophobicContact CG2-CG1 3.71Å; I384-V393 HydrophobicContact CG2-CG2 4.16Å; I386-V393 HydrophobicContact CG1-CG2 4.31Å; V393-I395 HydrophobicContact CG1-CG1 3.96Å; V393-L462 HydrophobicContact CB-CB 4.34Å; V393-L462 PolarHBondContact N-O 3.3Å; V393-L462 PolarHBondContact O-N 3.44Å; V393-V464 HydrophobicContact CB-CG2 4.34Å; V393-V464 HydrophobicContact CG2-CG2 3.71Å
394	C	80.4	Confident	76	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.4	168	-62.8	0	0	0	0	110.6	N385 G397 C399 C411	N385-C394 HydrophobicContact CB-CB 4.35Å; N385-C394 PolarHBondContact N-O 3.26Å; N385-C394 PolarHBondContact O-N 3.39Å; C394-G397 WeakPolarHBondContact CB-O 2.98Å; C394-C399 VanDerWaalsContact SG-SG 3.66Å; C394-C411 WeakPolarHBondContact CA-SG 3.5Å; C394-C411 HydrophobicContact CB-CB 3.78Å; C394-C411 WeakPolarHBondContact CB-SG 3.21Å; C394-C411 WeakPolarHBondContact SG-CA 3.41Å; C394-C411 WeakPolarHBondContact SG-CB 3.16Å; C394-C411 CovalentContact SG-SG 2.03Å; C394-C411 PolarHBondContact SG-SG 2.03Å
395	I	76.1	Confident	76.4	Confident	96 Å²	96	59.2 Å²	59.2	49%	0.492	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.4	175.7	-52.8	176.3	0	0	0	108.4	V393 G397 L462	V393-I395 HydrophobicContact CG1-CG1 3.96Å; I395-G397 PolarHBondContact O-N 2.79Å; I395-G397 VanDerWaalsContact O-N 3.13Å; I395-L462 HydrophobicContact CD1-CD2 4.37Å
396	N	71.9	Confident	76.3	Confident	70 Å²	70	63 Å²	63	37%	0.374	36%	0.359	S	S	.	.	S	Bend	trans	58.5	14.8	-174.5	-54.5	-21.8	0	0	0	114.3	S382 R383	S382-N396 WeakPolarHBondContact CA-OD1 3.36Å; S382-N396 WeakPolarHBondContact CB-OD1 2.99Å; S382-N396 PolarHBondContact OG-OD1 2.73Å; R383-N396 PolarHBondContact O-N 3.48Å; R383-N396 VanDerWaalsContact O-N 3.15Å
397	G	81.5	Confident	75.6	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.01	37%	0.368	C	S	.	.	S	Bend	trans	-142.1	161.9	-164.4	0	0	0	0	0	114.1	N385 C394 I395 C412	N385-G397 PolarHBondContact ND2-O 2.88Å; C394-G397 WeakPolarHBondContact CB-O 2.98Å; I395-G397 PolarHBondContact O-N 2.79Å; I395-G397 VanDerWaalsContact O-N 3.13Å; G397-C412 CarbonylContact C-O 3.56Å; G397-C412 WeakPolarHBondContact CA-O 3.07Å
398	T	88.2	Confident	75.1	Confident	22 Å²	22	66 Å²	66	14%	0.135	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.3	-174.7	-50.8	0	0	0	0	111.2	C400 C411 C412 Y414 N416 A417	T398-C400 PolarHBondContact O-N 3.09Å; T398-C411 CarbonylContact O-C 3.6Å; T398-C411 WeakPolarHBondContact O-CA 3.3Å; T398-C412 PolarHBondContact N-O 2.89Å; T398-C412 PolarHBondContact O-N 3.39Å; T398-Y414 PolarHBondContact N-O 2.03Å; T398-Y414 PolarHBondContact OG1-O 3.07Å; T398-N416 WeakPolarHBondContact OG1-CA 3.37Å; T398-N416 PolarHBondContact OG1-N 2.94Å; T398-A417 HydrophobicContact CG2-CB 4.34Å; T398-A417 PolarHBondContact OG1-N 2.85Å
399	C	89	Confident	75.2	Confident	34 Å²	34	60.8 Å²	60.8	23%	0.23	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	122.3	171.9	-62.4	0	0	0	0	110.5	N385 C387 C394 T409	N385-C399 PolarHBondContact O-SG 3.2Å; N385-C399 VanDerWaalsContact O-SG 3.39Å; C387-C399 WeakPolarHBondContact CA-SG 3.01Å; C387-C399 HydrophobicContact CB-CB 3.71Å; C387-C399 WeakPolarHBondContact CB-SG 3.41Å; C387-C399 WeakPolarHBondContact SG-CB 3.39Å; C387-C399 CovalentContact SG-SG 2.05Å; C387-C399 PolarHBondContact SG-SG 2.01Å; C394-C399 VanDerWaalsContact SG-SG 3.66Å; C399-T409 HydrophobicContact CB-CG2 3.82Å
400	C	89.8	Confident	75.8	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.4	176.6	-71.2	0	0	0	0	109.9	T398 L410 C412 C419 K458	T398-C400 PolarHBondContact O-N 3.09Å; C400-L410 PolarHBondContact N-O 3.32Å; C400-L410 PolarHBondContact O-N 2.9Å; C400-C412 PolarHBondContact SG-SG 3.1Å; C400-C419 VanDerWaalsContact CA-SG 3.52Å; C400-C419 HydrophobicContact CB-CB 3.77Å; C400-C419 WeakPolarHBondContact CB-SG 3.44Å; C400-C419 WeakPolarHBondContact SG-CB 3.02Å; C400-C419 CovalentContact SG-SG 2.03Å; C400-C419 PolarHBondContact SG-SG 3.48Å; C400-K458 HydrophobicContact CB-CD 3.88Å
401	S	82	Confident	76.9	Confident	94 Å²	94	53.2 Å²	53.2	66%	0.657	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.3	143.2	177.6	-42.5	0	0	0	0	112	K458	S401-K458 PolarHBondContact O-NZ 2.88Å
402	N	73.8	Confident	77.8	Confident	26 Å²	26	47.9 Å²	47.9	14%	0.139	28%	0.28	C	S	.	.			trans	-83.4	130.2	165.4	-177.1	6.2	0	0	0	109.1	N404 D405 S408 L410	N402-N404 VanDerWaalsContact C-N 3.31Å; N402-N404 PolarHBondContact OD1-N 2.82Å; N402-N404 PolarHBondContact OD1-ND2 3.35Å; N402-D405 WeakPolarHBondContact CB-O 3.45Å; N402-S408 VanDerWaalsContact CB-O 3.25Å; N402-S408 WeakPolarHBondContact CB-O 2.98Å; N402-S408 PolarHBondContact N-O 3.04Å; N402-S408 PolarHBondContact ND2-OG 3.05Å; N402-L410 HydrophobicContact CB-CD1 3.91Å; N402-L410 HydrophobicContact CB-CG 4.08Å
403	V	71.4	Confident	78.1	Confident	97 Å²	97	50.4 Å²	50.4	59%	0.588	30%	0.296	S	S	*	.	S	Bend	trans	-78.8	-19.5	178.9	173.9	0	0	0	0	111.6	G423	V403-G423 VanDerWaalsContact CG2-CA 3.45Å
404	N	68.3	Low	78.3	Confident	119 Å²	119	53.6 Å²	53.6	64%	0.636	31%	0.307	S	S	*	.	S	Bend	trans	-91.2	-16	-177.9	-46.1	-84.9	0	0	0	113.3	N402	N402-N404 VanDerWaalsContact C-N 3.31Å; N402-N404 PolarHBondContact OD1-N 2.82Å; N402-N404 PolarHBondContact OD1-ND2 3.35Å
405	D	67.9	Low	78.1	Confident	61 Å²	61	56.3 Å²	56.3	33%	0.326	32%	0.32	S	S	.	.			trans	-155.4	101.8	179.5	165.3	26.6	0	0	0	109.3	N402 L407 S408	N402-D405 WeakPolarHBondContact CB-O 3.45Å; D405-L407 PolarHBondContact O-N 3.03Å; D405-L407 VanDerWaalsContact O-N 3.11Å; D405-L407 WeakPolarHBondContact OD1-CB 3.4Å; D405-L407 PolarHBondContact OD1-N 2.94Å; D405-S408 WeakPolarHBondContact CB-OG 3.17Å; D405-S408 VanDerWaalsContact CG-OG 3.24Å; D405-S408 PolarHBondContact O-N 3.17Å; D405-S408 VanDerWaalsContact O-N 3.14Å; D405-S408 PolarHBondContact O-OG 2.75Å; D405-S408 WeakPolarHBondContact OD2-CB 3.48Å; D405-S408 PolarHBondContact OD2-N 2.88Å; D405-S408 PolarHBondContact OD2-OG 3.49Å
406	P	65.6	Low	78.2	Confident	125 Å²	125	55 Å²	55	81%	0.812	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.8	-179.2	-24.7	35.2	0	0	0	115.3
407	L	60.3	Low	79	Confident	145 Å²	145	52.3 Å²	52.3	76%	0.759	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.1	178.8	-70.1	150.4	0	0	0	112.8	D405	D405-L407 PolarHBondContact O-N 3.03Å; D405-L407 VanDerWaalsContact O-N 3.11Å; D405-L407 WeakPolarHBondContact OD1-CB 3.4Å; D405-L407 PolarHBondContact OD1-N 2.94Å
408	S	68.6	Low	79.4	Confident	34 Å²	34	55 Å²	55	24%	0.238	32%	0.317	C	S	.	.			trans	-115.4	132.9	175.7	55.3	0	0	0	0	113.4	N402 D405	N402-S408 VanDerWaalsContact CB-O 3.25Å; N402-S408 WeakPolarHBondContact CB-O 2.98Å; N402-S408 PolarHBondContact N-O 3.04Å; N402-S408 PolarHBondContact ND2-OG 3.05Å; D405-S408 WeakPolarHBondContact CB-OG 3.17Å; D405-S408 VanDerWaalsContact CG-OG 3.24Å; D405-S408 PolarHBondContact O-N 3.17Å; D405-S408 VanDerWaalsContact O-N 3.14Å; D405-S408 PolarHBondContact O-OG 2.75Å; D405-S408 WeakPolarHBondContact OD2-CB 3.48Å; D405-S408 PolarHBondContact OD2-N 2.88Å; D405-S408 PolarHBondContact OD2-OG 3.49Å
409	T	79.3	Confident	79.6	Confident	18 Å²	18	56.6 Å²	56.6	11%	0.11	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	140.5	168.2	-52.6	0	0	0	0	111.4	C387 D389 C399 A461	C387-T409 HydrophobicContact CB-CG2 3.77Å; C387-T409 WeakPolarHBondContact SG-CG2 3.37Å; D389-T409 WeakPolarHBondContact OD2-CB 3.31Å; D389-T409 PolarHBondContact OD2-OG1 2.85Å; C399-T409 HydrophobicContact CB-CG2 3.82Å; T409-A461 VanDerWaalsContact O-CB 3.28Å; T409-A461 WeakPolarHBondContact O-CB 3.32Å; T409-A461 PolarHBondContact O-N 3.38Å
410	L	84.6	Confident	79.6	Confident	29 Å²	29	55.2 Å²	55.2	15%	0.152	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.1	169.6	-60.9	169.7	0	0	0	109.4	C400 N402 K458 I459 R460	C400-L410 PolarHBondContact N-O 3.32Å; C400-L410 PolarHBondContact O-N 2.9Å; N402-L410 HydrophobicContact CB-CD1 3.91Å; N402-L410 HydrophobicContact CB-CG 4.08Å; L410-K458 HydrophobicContact CB-CB 3.69Å; L410-K458 HydrophobicContact CB-CD 3.79Å; L410-K458 HydrophobicContact CB-CG 4.37Å; L410-K458 HydrophobicContact CD1-CB 4.26Å; L410-K458 HydrophobicContact CD1-CD 4Å; L410-I459 CarbonylContact C-O 3.39Å; L410-I459 WeakPolarHBondContact CA-O 3.22Å; L410-R460 HydrophobicContact CD2-CG 4.36Å
411	C	88.8	Confident	79.4	Confident	6 Å²	6	60 Å²	60	4%	0.041	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.5	179.5	-58.7	0	0	0	0	111.9	C394 T398 K458 I459 A461	C394-C411 WeakPolarHBondContact CA-SG 3.5Å; C394-C411 HydrophobicContact CB-CB 3.78Å; C394-C411 WeakPolarHBondContact CB-SG 3.21Å; C394-C411 WeakPolarHBondContact SG-CA 3.41Å; C394-C411 WeakPolarHBondContact SG-CB 3.16Å; C394-C411 CovalentContact SG-SG 2.03Å; C394-C411 PolarHBondContact SG-SG 2.03Å; T398-C411 CarbonylContact O-C 3.6Å; T398-C411 WeakPolarHBondContact O-CA 3.3Å; C411-K458 CarbonylContact O-C 3.47Å; C411-K458 WeakPolarHBondContact O-CA 3.39Å; C411-I459 HydrophobicContact CB-CD1 4.48Å; C411-I459 HydrophobicContact CB-CG1 3.85Å; C411-I459 PolarHBondContact N-O 3.07Å; C411-I459 WeakPolarHBondContact O-CG1 3.27Å; C411-I459 PolarHBondContact O-N 3.47Å; C411-A461 WeakPolarHBondContact SG-CA 3.12Å; C411-A461 WeakPolarHBondContact SG-CB 3.37Å
412	C	89	Confident	79.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.3	164.1	-72	0	0	0	0	110.6	G397 T398 C400 Y414 A417 C426	G397-C412 CarbonylContact C-O 3.56Å; G397-C412 WeakPolarHBondContact CA-O 3.07Å; T398-C412 PolarHBondContact N-O 2.89Å; T398-C412 PolarHBondContact O-N 3.39Å; C400-C412 PolarHBondContact SG-SG 3.1Å; C412-Y414 PolarHBondContact O-N 3.3Å; C412-A417 HydrophobicContact CB-CB 3.5Å; C412-C426 HydrophobicContact CB-CB 4.06Å; C412-C426 WeakPolarHBondContact CB-SG 3.44Å; C412-C426 WeakPolarHBondContact SG-CB 3.48Å; C412-C426 CovalentContact SG-SG 2.01Å; C412-C426 PolarHBondContact SG-SG 3.48Å
413	P	83.2	Confident	79.7	Confident	64 Å²	64	56.6 Å²	56.6	42%	0.416	33%	0.328	S	S	.	.	S	Bend	trans	-64.3	-5.5	176.6	-24	34.5	0	0	0	115.8	L456	P413-L456 HydrophobicContact CB-CD2 4.01Å; P413-L456 HydrophobicContact CG-CD2 3.94Å
414	Y	84.1	Confident	80.3	Confident	82 Å²	82	57.9 Å²	57.9	32%	0.322	33%	0.325	S	S	.	.	S	Bend	trans	-90.9	139.3	169.3	-61.2	-58.1	0	0	0	111.2	T398 C412 P428 L456	T398-Y414 PolarHBondContact N-O 2.03Å; T398-Y414 PolarHBondContact OG1-O 3.07Å; C412-Y414 PolarHBondContact O-N 3.3Å; Y414-P428 HydrophobicContact CD1-CB 4.3Å; Y414-P428 HydrophobicContact CD2-CB 4.04Å; Y414-P428 HydrophobicContact CE1-CB 4.37Å; Y414-P428 HydrophobicContact CE2-CB 4.11Å; Y414-P428 HydrophobicContact CE2-CG 4.33Å; Y414-P428 HydrophobicContact CG-CB 4.14Å; Y414-L456 HydrophobicContact CD2-CD2 3.84Å; Y414-L456 HydrophobicContact CE1-CD2 4.43Å; Y414-L456 HydrophobicContact CE2-CB 3.92Å; Y414-L456 HydrophobicContact CE2-CD2 3.45Å; Y414-L456 VanDerWaalsContact CE2-CD2 3.45Å; Y414-L456 HydrophobicContact CE2-CG 4.34Å; Y414-L456 HydrophobicContact CG-CD2 4.48Å
415	E	75.6	Confident	81.4	Confident	59 Å²	59	54.4 Å²	54.4	28%	0.276	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	132.1	166.1	-68.5	-154.3	124.4	0	0	111.3	N381 R383 A417	N381-E415 PolarHBondContact ND2-OE1 3.41Å; N381-E415 PolarHBondContact ND2-OE2 2.82Å; R383-E415 IonicContact CZ-OE1 3.62Å; R383-E415 IonicContact CZ-OE2 3.5Å; R383-E415 IonicContact NE-OE1 3.74Å; R383-E415 PolarHBondContact NE-OE1 2.04Å; R383-E415 IonicContact NE-OE2 3.84Å; R383-E415 IonicContact NH2-OE1 2.89Å; R383-E415 PolarHBondContact NH2-OE1 2.04Å; R383-E415 IonicContact NH2-OE2 2.73Å; R383-E415 PolarHBondContact NH2-OE2 2.97Å; E415-A417 VanDerWaalsContact C-N 3.32Å
416	N	80.2	Confident	82.5	Confident	69 Å²	69	51.5 Å²	51.5	37%	0.369	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	42.5	-179.7	-24.6	-97	0	0	0	112.4	R383 T398 K429	R383-N416 PolarHBondContact NH1-OD1 2.72Å; R383-N416 PolarHBondContact NH2-ND2 2.92Å; R383-N416 VanDerWaalsContact NH2-ND2 3.18Å; R383-N416 PolarHBondContact NH2-OD1 2.03Å; T398-N416 WeakPolarHBondContact OG1-CA 3.37Å; T398-N416 PolarHBondContact OG1-N 2.94Å; N416-K429 HydrophobicContact CB-CD 4.25Å; N416-K429 WeakPolarHBondContact O-CB 3.38Å
417	A	87.7	Confident	83.8	Confident	13 Å²	13	45.6 Å²	45.6	11%	0.107	25%	0.251	C	S	.	.			trans	-65.8	153.6	179.8	0	0	0	0	0	112.8	T398 C412 E415 C426 C427	T398-A417 HydrophobicContact CG2-CB 4.34Å; T398-A417 PolarHBondContact OG1-N 2.85Å; C412-A417 HydrophobicContact CB-CB 3.5Å; E415-A417 VanDerWaalsContact C-N 3.32Å; A417-C426 HydrophobicContact CB-CB 4.4Å; A417-C427 CarbonylContact C-O 3.47Å; A417-C427 WeakPolarHBondContact CA-O 3.19Å; A417-C427 WeakPolarHBondContact CB-O 3.4Å
418	V	90.5	Very high	85.1	Confident	56 Å²	56	39.7 Å²	39.7	34%	0.339	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	109.2	166.1	175.4	0	0	0	0	108.2	C420 C426 C427 T431	V418-C420 PolarHBondContact O-N 3.01Å; V418-C426 CarbonylContact O-C 3.59Å; V418-C426 VanDerWaalsContact O-CA 3.25Å; V418-C426 WeakPolarHBondContact O-CA 2.98Å; V418-C426 WeakPolarHBondContact O-CB 3.04Å; V418-C427 HydrophobicContact CB-CB 4.31Å; V418-C427 PolarHBondContact N-O 3.36Å; V418-C427 PolarHBondContact O-N 2.91Å; V418-T431 WeakPolarHBondContact CG2-O 3.07Å
419	C	91.3	Very high	85.9	Confident	56 Å²	56	45.7 Å²	45.7	38%	0.378	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	124.6	175.7	-51.2	0	0	0	0	110.2	C400	C400-C419 VanDerWaalsContact CA-SG 3.52Å; C400-C419 HydrophobicContact CB-CB 3.77Å; C400-C419 WeakPolarHBondContact CB-SG 3.44Å; C400-C419 WeakPolarHBondContact SG-CB 3.02Å; C400-C419 CovalentContact SG-SG 2.03Å; C400-C419 PolarHBondContact SG-SG 3.48Å
420	C	90.5	Very high	86	Confident	6 Å²	6	47 Å²	47	4%	0.041	26%	0.26	C	S	.	.			trans	-80.7	152.3	176.2	-54.4	0	0	0	0	111.9	V418 D422 G423 H425 C426 C433 M435 L455	V418-C420 PolarHBondContact O-N 3.01Å; C420-D422 VanDerWaalsContact C-N 3.26Å; C420-D422 PolarHBondContact O-N 2.84Å; C420-G423 PolarHBondContact O-N 2.82Å; C420-H425 HydrophobicContact CB-CB 4.34Å; C420-H425 VanDerWaalsContact CB-O 3.31Å; C420-H425 WeakPolarHBondContact CB-O 2.88Å; C420-H425 PolarHBondContact N-O 2.78Å; C420-C426 VanDerWaalsContact SG-CA 3.52Å; C420-C433 WeakPolarHBondContact CA-SG 3.19Å; C420-C433 HydrophobicContact CB-CB 3.82Å; C420-C433 WeakPolarHBondContact CB-SG 2.95Å; C420-C433 WeakPolarHBondContact SG-CB 3.22Å; C420-C433 CovalentContact SG-SG 2.04Å; C420-C433 PolarHBondContact SG-SG 2.88Å; C420-M435 HydrophobicContact CB-SD 3.86Å; C420-L455 WeakPolarHBondContact SG-CD2 3.4Å
421	S	85	Confident	86.2	Confident	101 Å²	101	46 Å²	46	71%	0.706	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-14.7	-174	47.9	0	0	0	0	114.6	G423	S421-G423 PolarHBondContact O-N 2.99Å
422	D	84	Confident	86.2	Confident	49 Å²	49	49.2 Å²	49.2	26%	0.262	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-3.6	176.8	77.8	-20.6	0	0	0	114.2	C420 K424 H425 M435	C420-D422 VanDerWaalsContact C-N 3.26Å; C420-D422 PolarHBondContact O-N 2.84Å; D422-K424 PolarHBondContact O-N 2.9Å; D422-K424 VanDerWaalsContact O-N 3.1Å; D422-K424 PolarHBondContact OD1-N 2.89Å; D422-H425 PolarHBondContact OD1-N 3.1Å; D422-H425 IonicContact OD2-CE1 3.75Å; D422-H425 IonicContact OD2-CG 3.45Å; D422-H425 IonicContact OD2-ND1 2.61Å; D422-H425 PolarHBondContact OD2-ND1 3.07Å; D422-M435 HydrophobicContact CB-CE 3.7Å
423	G	78.5	Confident	86.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	75	-14.5	-177.1	0	0	0	0	0	115.1	V403 C420 S421 K458	V403-G423 VanDerWaalsContact CG2-CA 3.45Å; C420-G423 PolarHBondContact O-N 2.82Å; S421-G423 PolarHBondContact O-N 2.99Å; G423-K458 WeakPolarHBondContact O-CD 3.48Å; G423-K458 WeakPolarHBondContact O-CE 3.42Å; G423-K458 PolarHBondContact O-NZ 2.65Å
424	K	84.2	Confident	86.4	Confident	124 Å²	124	48.8 Å²	48.8	54%	0.539	27%	0.271	S	S	.	.	S	Bend	trans	-108.2	-27.2	-169.3	-63.9	173.8	-175.3	174.6	0	114	D422 T457 K458	D422-K424 PolarHBondContact O-N 2.9Å; D422-K424 VanDerWaalsContact O-N 3.1Å; D422-K424 PolarHBondContact OD1-N 2.89Å; K424-T457 WeakPolarHBondContact O-CA 3.23Å; K424-K458 WeakPolarHBondContact O-CG 3.5Å; K424-K458 PolarHBondContact O-N 2.95Å
425	H	89.6	Confident	86.3	Confident	46 Å²	46	48.4 Å²	48.4	21%	0.213	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	169.2	-173.2	-63.4	101.7	0	0	0	114.3	C420 D422 L455 L456 K458	C420-H425 HydrophobicContact CB-CB 4.34Å; C420-H425 VanDerWaalsContact CB-O 3.31Å; C420-H425 WeakPolarHBondContact CB-O 2.88Å; C420-H425 PolarHBondContact N-O 2.78Å; D422-H425 PolarHBondContact OD1-N 3.1Å; D422-H425 IonicContact OD2-CE1 3.75Å; D422-H425 IonicContact OD2-CG 3.45Å; D422-H425 IonicContact OD2-ND1 2.61Å; D422-H425 PolarHBondContact OD2-ND1 3.07Å; H425-L455 HydrophobicContact CB-CB 3.9Å; H425-L455 HydrophobicContact CB-CD1 4.4Å; H425-L455 HydrophobicContact CB-CD2 3.96Å; H425-L455 HydrophobicContact CB-CG 4.31Å; H425-L456 CarbonylContact C-O 3.49Å; H425-L456 VanDerWaalsContact CA-O 3.26Å; H425-L456 WeakPolarHBondContact CA-O 3.44Å; H425-K458 WeakPolarHBondContact O-CE 3.13Å
426	C	92.5	Very high	86.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.8	169.9	43	0	0	0	0	113.2	C412 A417 V418 C420 L456	C412-C426 HydrophobicContact CB-CB 4.06Å; C412-C426 WeakPolarHBondContact CB-SG 3.44Å; C412-C426 WeakPolarHBondContact SG-CB 3.48Å; C412-C426 CovalentContact SG-SG 2.01Å; C412-C426 PolarHBondContact SG-SG 3.48Å; A417-C426 HydrophobicContact CB-CB 4.4Å; V418-C426 CarbonylContact O-C 3.59Å; V418-C426 VanDerWaalsContact O-CA 3.25Å; V418-C426 WeakPolarHBondContact O-CA 2.98Å; V418-C426 WeakPolarHBondContact O-CB 3.04Å; C420-C426 VanDerWaalsContact SG-CA 3.52Å; C426-L456 PolarHBondContact N-O 2.89Å; C426-L456 PolarHBondContact O-N 2.02Å
427	C	92.4	Very high	86.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	154.6	-177.6	-72.8	0	0	0	0	111.4	A417 V418 T431 C433 C440	A417-C427 CarbonylContact C-O 3.47Å; A417-C427 WeakPolarHBondContact CA-O 3.19Å; A417-C427 WeakPolarHBondContact CB-O 3.4Å; V418-C427 HydrophobicContact CB-CB 4.31Å; V418-C427 PolarHBondContact N-O 3.36Å; V418-C427 PolarHBondContact O-N 2.91Å; C427-T431 WeakPolarHBondContact CB-OG1 3.49Å; C427-C433 VanDerWaalsContact SG-SG 3.64Å; C427-C440 WeakPolarHBondContact CA-SG 3.44Å; C427-C440 HydrophobicContact CB-CB 3.67Å; C427-C440 WeakPolarHBondContact CB-SG 3.33Å; C427-C440 VanDerWaalsContact SG-CA 3.58Å; C427-C440 WeakPolarHBondContact SG-CB 3.04Å; C427-C440 CovalentContact SG-SG 2.03Å; C427-C440 PolarHBondContact SG-SG 2.95Å
428	P	87.3	Confident	86.1	Confident	21 Å²	21	57.4 Å²	57.4	14%	0.136	33%	0.329	C	S	.	.			trans	-67.2	158.8	175.2	27.9	-33.9	0	0	0	112.2	Y414 G430 T431 I453	Y414-P428 HydrophobicContact CD1-CB 4.3Å; Y414-P428 HydrophobicContact CD2-CB 4.04Å; Y414-P428 HydrophobicContact CE1-CB 4.37Å; Y414-P428 HydrophobicContact CE2-CB 4.11Å; Y414-P428 HydrophobicContact CE2-CG 4.33Å; Y414-P428 HydrophobicContact CG-CB 4.14Å; P428-G430 PolarHBondContact O-N 2.66Å; P428-T431 WeakPolarHBondContact CD-OG1 3.47Å; P428-T431 HydrophobicContact CG-CG2 4.38Å; P428-T431 PolarHBondContact O-N 2.95Å; P428-T431 PolarHBondContact O-OG1 2.77Å; P428-I453 HydrophobicContact CG-CD1 3.85Å
429	K	85.5	Confident	85.7	Confident	160 Å²	160	55 Å²	55	70%	0.696	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	130.4	177.2	-172.8	-173.5	176.6	-177.7	0	111.1	N416	N416-K429 HydrophobicContact CB-CD 4.25Å; N416-K429 WeakPolarHBondContact O-CB 3.38Å
430	G	82.5	Confident	85.6	Confident	46 Å²	46	52.3 Å²	52.3	47%	0.474	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	13.3	179.7	0	0	0	0	0	114.8	P428	P428-G430 PolarHBondContact O-N 2.66Å
431	T	88.6	Confident	85.3	Confident	9 Å²	9	55.8 Å²	55.8	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.2	171.9	57.4	0	0	0	0	112.1	V418 C427 P428 I441 I442	V418-T431 WeakPolarHBondContact CG2-O 3.07Å; C427-T431 WeakPolarHBondContact CB-OG1 3.49Å; P428-T431 WeakPolarHBondContact CD-OG1 3.47Å; P428-T431 HydrophobicContact CG-CG2 4.38Å; P428-T431 PolarHBondContact O-N 2.95Å; P428-T431 PolarHBondContact O-OG1 2.77Å; T431-I441 CarbonylContact C-O 3.53Å; T431-I441 WeakPolarHBondContact CA-O 3.26Å; T431-I441 VanDerWaalsContact CB-O 3.31Å; T431-I441 WeakPolarHBondContact CB-O 2.99Å; T431-I442 HydrophobicContact CG2-CG1 3.76Å
432	T	87.1	Confident	84.9	Confident	72 Å²	72	55.6 Å²	55.6	44%	0.442	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.9	176.5	-53.3	0	0	0	0	109.7	D434 C440 I441	T432-D434 PolarHBondContact O-N 3.41Å; T432-C440 WeakPolarHBondContact O-CA 3.05Å; T432-I441 PolarHBondContact N-O 3.08Å; T432-I441 WeakPolarHBondContact O-CG1 3.49Å; T432-I441 PolarHBondContact O-N 3.17Å
433	C	89.2	Confident	83.7	Confident	26 Å²	26	57.5 Å²	57.5	18%	0.176	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	113.7	176.1	-53	0	0	0	0	111.3	C420 C427 M435 L455	C420-C433 WeakPolarHBondContact CA-SG 3.19Å; C420-C433 HydrophobicContact CB-CB 3.82Å; C420-C433 WeakPolarHBondContact CB-SG 2.95Å; C420-C433 WeakPolarHBondContact SG-CB 3.22Å; C420-C433 CovalentContact SG-SG 2.04Å; C420-C433 PolarHBondContact SG-SG 2.88Å; C427-C433 VanDerWaalsContact SG-SG 3.64Å; C433-M435 HydrophobicContact CB-CG 4.43Å; C433-M435 HydrophobicContact CB-SD 3.88Å; C433-M435 PolarHBondContact O-N 3.32Å; C433-L455 HydrophobicContact CB-CD2 4.37Å
434	D	88.1	Confident	82.7	Confident	30 Å²	30	65.1 Å²	65.1	16%	0.16	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	92.5	165.4	-176.6	-17.8	0	0	0	108.7	T432 I436 N437 G438 G439 I441	T432-D434 PolarHBondContact O-N 3.41Å; D434-I436 PolarHBondContact O-N 2.94Å; D434-I436 PolarHBondContact OD1-N 2.71Å; D434-N437 PolarHBondContact OD1-N 3.04Å; D434-N437 PolarHBondContact OD1-ND2 2.98Å; D434-N437 WeakPolarHBondContact OD2-CB 3.04Å; D434-N437 PolarHBondContact OD2-ND2 2.89Å; D434-G438 PolarHBondContact O-N 2.96Å; D434-G439 WeakPolarHBondContact CA-O 3.29Å; D434-G439 PolarHBondContact N-O 2.98Å; D434-G439 PolarHBondContact O-N 3.27Å; D434-I441 HydrophobicContact CB-CG1 4.48Å; D434-I441 HydrophobicContact CB-CG2 4.03Å
435	M	82	Confident	80.8	Confident	74 Å²	74	69 Å²	69	37%	0.365	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-9.2	-179.8	-60.4	-52.4	-45.7	0	0	113.8	C420 D422 C433 L455	C420-M435 HydrophobicContact CB-SD 3.86Å; D422-M435 HydrophobicContact CB-CE 3.7Å; C433-M435 HydrophobicContact CB-CG 4.43Å; C433-M435 HydrophobicContact CB-SD 3.88Å; C433-M435 PolarHBondContact O-N 3.32Å; M435-L455 HydrophobicContact CE-CD1 4.02Å; M435-L455 HydrophobicContact SD-CD1 4.23Å; M435-L455 HydrophobicContact SD-CD2 4.49Å
436	I	81.6	Confident	78.3	Confident	160 Å²	160	70.5 Å²	70.5	82%	0.821	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-46.9	-179.6	-60.2	171.9	0	0	0	109.5	D434	D434-I436 PolarHBondContact O-N 2.94Å; D434-I436 PolarHBondContact OD1-N 2.71Å
437	N	77.8	Confident	75.9	Confident	131 Å²	131	78.9 Å²	78.9	70%	0.701	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	0.6	179.6	-60	-68	0	0	0	113.6	D434	D434-N437 PolarHBondContact OD1-N 3.04Å; D434-N437 PolarHBondContact OD1-ND2 2.98Å; D434-N437 WeakPolarHBondContact OD2-CB 3.04Å; D434-N437 PolarHBondContact OD2-ND2 2.89Å
438	G	79	Confident	73.2	Confident	39 Å²	39	84 Å²	84	40%	0.402	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	29	175.8	0	0	0	0	0	114.4	D434 L455	D434-G438 PolarHBondContact O-N 2.96Å; G438-L455 WeakPolarHBondContact O-CG 3.45Å; G438-L455 PolarHBondContact O-N 3.45Å
439	G	83.8	Confident	70.9	Confident	4 Å²	4	92 Å²	92	4%	0.041	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	-172	-170.8	0	0	0	0	0	115.2	D434 I453	D434-G439 WeakPolarHBondContact CA-O 3.29Å; D434-G439 PolarHBondContact N-O 2.98Å; D434-G439 PolarHBondContact O-N 3.27Å; G439-I453 CarbonylContact C-O 3.56Å; G439-I453 VanDerWaalsContact CA-O 3.24Å; G439-I453 WeakPolarHBondContact CA-O 2.97Å
440	C	87.6	Confident	68.9	Low	0 Å²	0	89.5 Å²	89.5	0%	0	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.6	-179.5	-56.3	0	0	0	0	108.9	C427 T432 I453	C427-C440 WeakPolarHBondContact CA-SG 3.44Å; C427-C440 HydrophobicContact CB-CB 3.67Å; C427-C440 WeakPolarHBondContact CB-SG 3.33Å; C427-C440 VanDerWaalsContact SG-CA 3.58Å; C427-C440 WeakPolarHBondContact SG-CB 3.04Å; C427-C440 CovalentContact SG-SG 2.03Å; C427-C440 PolarHBondContact SG-SG 2.95Å; T432-C440 WeakPolarHBondContact O-CA 3.05Å; C440-I453 HydrophobicContact CB-CB 4.21Å; C440-I453 WeakPolarHBondContact CB-O 3.31Å; C440-I453 PolarHBondContact N-O 2.03Å; C440-I453 PolarHBondContact O-N 3.09Å
441	I	85.8	Confident	67.4	Low	79 Å²	79	92.9 Å²	92.9	41%	0.405	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139	-175.8	56.4	170.4	0	0	0	111.3	T431 T432 D434	T431-I441 CarbonylContact C-O 3.53Å; T431-I441 WeakPolarHBondContact CA-O 3.26Å; T431-I441 VanDerWaalsContact CB-O 3.31Å; T431-I441 WeakPolarHBondContact CB-O 2.99Å; T432-I441 PolarHBondContact N-O 3.08Å; T432-I441 WeakPolarHBondContact O-CG1 3.49Å; T432-I441 PolarHBondContact O-N 3.17Å; D434-I441 HydrophobicContact CB-CG1 4.48Å; D434-I441 HydrophobicContact CB-CG2 4.03Å
442	I	75.6	Confident	66.2	Low	98 Å²	98	96.6 Å²	96.6	50%	0.503	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.9	126.2	180	-60.3	166.4	0	0	0	109.4	T431 Q444	T431-I442 HydrophobicContact CG2-CG1 3.76Å; I442-Q444 HydrophobicContact CG2-CB 4.19Å; I442-Q444 HydrophobicContact CG2-CG 4.24Å; I442-Q444 PolarHBondContact O-N 3.24Å
443	S	59.8	Low	65.5	Low	88 Å²	88	96.3 Å²	96.3	62%	0.615	55%	0.548	S	S	*	.			trans	-85	49.6	-176.2	67.5	0	0	0	0	113.1
444	Q	56.3	Low	64.9	Low	160 Å²	160	99.8 Å²	99.8	75%	0.748	57%	0.57	S	S	*	*			trans	-124.6	121.9	177.6	-72.2	-167.1	-39.5	0	0	111.8	I442 G446	I442-Q444 HydrophobicContact CG2-CB 4.19Å; I442-Q444 HydrophobicContact CG2-CG 4.24Å; I442-Q444 PolarHBondContact O-N 3.24Å; Q444-G446 PolarHBondContact O-N 2.94Å
445	E	43.9	Very low	64.7	Low	207 Å²	207	99.7 Å²	99.7	97%	0.967	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	117.6	167.9	-57.8	176.1	139.6	0	0	108.7
446	G	38.4	Very low	64.7	Low	76 Å²	76	98.8 Å²	98.8	78%	0.784	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.5	-27.6	172.4	0	0	0	0	0	117.8	Q444	Q444-G446 PolarHBondContact O-N 2.94Å
447	L	41.8	Very low	64.8	Low	177 Å²	177	95.1 Å²	95.1	93%	0.927	55%	0.551	S	S	*	*			trans	-143	127.8	-179.5	-151.1	70.8	0	0	0	113.2
448	S	34.5	Very low	65.1	Low	106 Å²	106	89.8 Å²	89.8	74%	0.741	52%	0.522	S	S	*	.			trans	-99.9	146.8	-172.1	53.9	0	0	0	0	113.4
449	K	40.3	Very low	65.3	Low	189 Å²	189	92.6 Å²	92.6	82%	0.822	53%	0.527	S	S	*	.	S	Bend	trans	80.8	124.9	171.7	-58.7	177.6	177.5	176.8	0	117.9
450	S	42.6	Very low	65	Low	109 Å²	109	103.3 Å²	103.3	76%	0.762	57%	0.566	S	S	*	*			trans	53.4	81.2	158.6	61.1	0	0	0	0	118.8
451	N	50.6	Low	64.4	Low	116 Å²	116	104.2 Å²	104.2	62%	0.62	57%	0.573	S	S	*	*			trans	-146.3	55.9	150.3	-81.1	-48.1	0	0	0	109.9	I453	N451-I453 PolarHBondContact O-N 3.35Å
452	S	64.7	Low	63.5	Low	87 Å²	87	105.5 Å²	105.5	61%	0.608	58%	0.581	S	S	*	*			trans	-75.3	106.5	172.4	51.1	0	0	0	0	109.9
453	I	71.2	Confident	62.5	Low	66 Å²	66	106.2 Å²	106.2	34%	0.338	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.5	133.1	170.1	-57	172.8	0	0	0	107	P428 G439 C440 N451	P428-I453 HydrophobicContact CG-CD1 3.85Å; G439-I453 CarbonylContact C-O 3.56Å; G439-I453 VanDerWaalsContact CA-O 3.24Å; G439-I453 WeakPolarHBondContact CA-O 2.97Å; C440-I453 HydrophobicContact CB-CB 4.21Å; C440-I453 WeakPolarHBondContact CB-O 3.31Å; C440-I453 PolarHBondContact N-O 2.03Å; C440-I453 PolarHBondContact O-N 3.09Å; N451-I453 PolarHBondContact O-N 3.35Å
454	P	78.2	Confident	62	Low	99 Å²	99	105.7 Å²	105.7	64%	0.643	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-64.2	147.8	178.3	26.7	-34.9	0	0	0	111.6	L456	P454-L456 PolarHBondContact O-N 3Å
455	L	83.1	Confident	61.4	Low	28 Å²	28	103.3 Å²	103.3	15%	0.147	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-56.6	126.6	173.4	-76.8	170.2	0	0	0	111.3	C420 H425 C433 M435 G438	C420-L455 WeakPolarHBondContact SG-CD2 3.4Å; H425-L455 HydrophobicContact CB-CB 3.9Å; H425-L455 HydrophobicContact CB-CD1 4.4Å; H425-L455 HydrophobicContact CB-CD2 3.96Å; H425-L455 HydrophobicContact CB-CG 4.31Å; C433-L455 HydrophobicContact CB-CD2 4.37Å; M435-L455 HydrophobicContact CE-CD1 4.02Å; M435-L455 HydrophobicContact SD-CD1 4.23Å; M435-L455 HydrophobicContact SD-CD2 4.49Å; G438-L455 WeakPolarHBondContact O-CG 3.45Å; G438-L455 PolarHBondContact O-N 3.45Å
456	L	81.8	Confident	61.1	Low	56 Å²	56	98.8 Å²	98.8	29%	0.293	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94	128.4	178.7	-176.2	61	0	0	0	110.6	P413 Y414 H425 C426 P454	P413-L456 HydrophobicContact CB-CD2 4.01Å; P413-L456 HydrophobicContact CG-CD2 3.94Å; Y414-L456 HydrophobicContact CD2-CD2 3.84Å; Y414-L456 HydrophobicContact CE1-CD2 4.43Å; Y414-L456 HydrophobicContact CE2-CB 3.92Å; Y414-L456 HydrophobicContact CE2-CD2 3.45Å; Y414-L456 VanDerWaalsContact CE2-CD2 3.45Å; Y414-L456 HydrophobicContact CE2-CG 4.34Å; Y414-L456 HydrophobicContact CG-CD2 4.48Å; H425-L456 CarbonylContact C-O 3.49Å; H425-L456 VanDerWaalsContact CA-O 3.26Å; H425-L456 WeakPolarHBondContact CA-O 3.44Å; C426-L456 PolarHBondContact N-O 2.89Å; C426-L456 PolarHBondContact O-N 2.02Å; P454-L456 PolarHBondContact O-N 3Å
457	T	83.9	Confident	61.1	Low	83 Å²	83	102.2 Å²	102.2	51%	0.509	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.1	135.8	179.1	-40.9	0	0	0	0	111.2	K424	K424-T457 WeakPolarHBondContact O-CA 3.23Å
458	K	84.8	Confident	60.8	Low	18 Å²	18	100.7 Å²	100.7	8%	0.078	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-70.4	142.1	174	-52.1	175	-170.9	168.9	0	110.3	C400 S401 L410 C411 G423 K424 H425	C400-K458 HydrophobicContact CB-CD 3.88Å; S401-K458 PolarHBondContact O-NZ 2.88Å; L410-K458 HydrophobicContact CB-CB 3.69Å; L410-K458 HydrophobicContact CB-CD 3.79Å; L410-K458 HydrophobicContact CB-CG 4.37Å; L410-K458 HydrophobicContact CD1-CB 4.26Å; L410-K458 HydrophobicContact CD1-CD 4Å; C411-K458 CarbonylContact O-C 3.47Å; C411-K458 WeakPolarHBondContact O-CA 3.39Å; G423-K458 WeakPolarHBondContact O-CD 3.48Å; G423-K458 WeakPolarHBondContact O-CE 3.42Å; G423-K458 PolarHBondContact O-NZ 2.65Å; K424-K458 WeakPolarHBondContact O-CG 3.5Å; K424-K458 PolarHBondContact O-N 2.95Å; H425-K458 WeakPolarHBondContact O-CE 3.13Å
459	I	82	Confident	60.5	Low	99 Å²	99	103.2 Å²	103.2	51%	0.508	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	164.4	172.9	63.6	175	0	0	0	110.7	L410 C411	L410-I459 CarbonylContact C-O 3.39Å; L410-I459 WeakPolarHBondContact CA-O 3.22Å; C411-I459 HydrophobicContact CB-CD1 4.48Å; C411-I459 HydrophobicContact CB-CG1 3.85Å; C411-I459 PolarHBondContact N-O 3.07Å; C411-I459 WeakPolarHBondContact O-CG1 3.27Å; C411-I459 PolarHBondContact O-N 3.47Å
460	R	78.8	Confident	60.1	Low	228 Å²	228	99.9 Å²	99.9	86%	0.86	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	141.3	172.4	-66.7	-173.1	-177.5	-169.6	0.8	110.6	L410	L410-R460 HydrophobicContact CD2-CG 4.36Å
461	A	74.1	Confident	59.6	Low	19 Å²	19	101.5 Å²	101.5	16%	0.157	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-74.5	158.5	171.6	0	0	0	0	0	112.2	T409 C411 H463	T409-A461 VanDerWaalsContact O-CB 3.28Å; T409-A461 WeakPolarHBondContact O-CB 3.32Å; T409-A461 PolarHBondContact O-N 3.38Å; C411-A461 WeakPolarHBondContact SG-CA 3.12Å; C411-A461 WeakPolarHBondContact SG-CB 3.37Å; A461-H463 PolarHBondContact O-N 2.84Å
462	L	67.3	Low	59	Low	107 Å²	107	102 Å²	102	56%	0.56	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.1	116.7	176.9	-171.1	72.6	0	0	0	109.4	V393 I395 V464	V393-L462 HydrophobicContact CB-CB 4.34Å; V393-L462 PolarHBondContact N-O 3.3Å; V393-L462 PolarHBondContact O-N 3.44Å; I395-L462 HydrophobicContact CD1-CD2 4.37Å; L462-V464 PolarHBondContact O-N 2.79Å
463	H	54.5	Low	57.6	Low	113 Å²	113	102.6 Å²	102.6	52%	0.523	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.6	117.1	-177.6	-172.6	-85.3	0	0	0	111.9	K391 A461 T465	K391-H463 CarbonylContact O-C 3.49Å; K391-H463 WeakPolarHBondContact O-CA 2.88Å; A461-H463 PolarHBondContact O-N 2.84Å; H463-T465 PolarHBondContact O-N 3.11Å
464	V	50	Low	56.1	Low	77 Å²	77	103.8 Å²	103.8	47%	0.467	56%	0.562	S	S	.	*			trans	-86.5	97	175	-176.4	0	0	0	0	109	K391 V393 L462 S466	K391-V464 PolarHBondContact O-N 3.42Å; V393-V464 HydrophobicContact CB-CG2 4.34Å; V393-V464 HydrophobicContact CG2-CG2 3.71Å; L462-V464 PolarHBondContact O-N 2.79Å; V464-S466 PolarHBondContact O-N 2.83Å
465	T	43.7	Very low	54.3	Low	109 Å²	109	105.4 Å²	105.4	67%	0.669	56%	0.56	S	S	*	*			trans	-72.7	111.3	165.9	46.4	0	0	0	0	109.6	H463 K467	H463-T465 PolarHBondContact O-N 3.11Å; T465-K467 PolarHBondContact O-N 3.22Å; T465-K467 VanDerWaalsContact O-N 3.08Å
466	S	36.4	Very low	53.1	Low	112 Å²	112	107 Å²	107	78%	0.783	57%	0.571	S	S	*	*			trans	-65.7	106.9	173.3	-171.3	0	0	0	0	110.5	V464	V464-S466 PolarHBondContact O-N 2.83Å
467	K	39.1	Very low	52.7	Low	149 Å²	149	107.4 Å²	107.4	65%	0.648	57%	0.571	S	S	*	*			trans	-103.3	149.3	154.8	-85.2	-160.4	171.4	-166.9	0	108.8	L179 T465	L179-K467 VanDerWaalsContact CD2-NZ 3.34Å; T465-K467 PolarHBondContact O-N 3.22Å; T465-K467 VanDerWaalsContact O-N 3.08Å
468	N	35.3	Very low	52.5	Low	145 Å²	145	108.7 Å²	108.7	78%	0.775	57%	0.574	S	S	*	*			trans	-58.7	147.2	-157.2	-75.2	-17.8	0	0	0	116.1	T470	N468-T470 PolarHBondContact O-N 3.49Å
469	N	29	Very low	52.4	Low	158 Å²	158	107.9 Å²	107.9	85%	0.845	57%	0.57	S	S	*	*			trans	-69.1	87.8	174.4	174.1	25.3	0	0	0	111.6
470	T	31.6	Very low	52.3	Low	120 Å²	120	107 Å²	107	74%	0.736	57%	0.571	S	S	*	*			trans	-130.5	113.7	163.8	51.2	0	0	0	0	111.3	N468 S472	N468-T470 PolarHBondContact O-N 3.49Å; T470-S472 PolarHBondContact O-N 2.88Å
471	Q	32	Very low	51.7	Low	142 Å²	142	99.6 Å²	99.6	66%	0.664	57%	0.566	S	S	*	*			trans	-26.7	111.2	170.2	-65	164.9	1.4	0	0	115.3	I473	Q471-I473 HydrophobicContact CB-CB 4.3Å; Q471-I473 HydrophobicContact CB-CD1 4.11Å; Q471-I473 HydrophobicContact CB-CG1 3.99Å; Q471-I473 HydrophobicContact CG-CD1 4.03Å; Q471-I473 HydrophobicContact CG-CG1 4.38Å; Q471-I473 PolarHBondContact O-N 3.48Å
472	S	37.5	Very low	51.3	Low	126 Å²	126	101 Å²	101	88%	0.881	58%	0.582	S	S	*	*			trans	-78.8	47.6	152.1	-66	0	0	0	0	111.4	T470 V474	T470-S472 PolarHBondContact O-N 2.88Å; S472-V474 VanDerWaalsContact C-N 3.33Å; S472-V474 PolarHBondContact O-N 3.23Å; S472-V474 VanDerWaalsContact O-N 3.15Å
473	I	34.7	Very low	51.3	Low	100 Å²	100	105.3 Å²	105.3	51%	0.513	60%	0.596	S	S	.	*			trans	-71.2	101.6	153.6	-62.9	171.1	0	0	0	104.1	Q471 F475	Q471-I473 HydrophobicContact CB-CB 4.3Å; Q471-I473 HydrophobicContact CB-CD1 4.11Å; Q471-I473 HydrophobicContact CB-CG1 3.99Å; Q471-I473 HydrophobicContact CG-CD1 4.03Å; Q471-I473 HydrophobicContact CG-CG1 4.38Å; Q471-I473 PolarHBondContact O-N 3.48Å; I473-F475 HydrophobicContact CG2-CD2 4.42Å; I473-F475 WeakPolarHBondContact O-CD2 3.21Å; I473-F475 PolarHBondContact O-N 2.89Å
474	V	41	Very low	52.1	Low	91 Å²	91	100.7 Å²	100.7	55%	0.552	58%	0.578	S	S	*	*			trans	-61	106.6	164.4	177.6	0	0	0	0	105.4	S472 T476 P487	S472-V474 VanDerWaalsContact C-N 3.33Å; S472-V474 PolarHBondContact O-N 3.23Å; S472-V474 VanDerWaalsContact O-N 3.15Å; V474-T476 HydrophobicContact CG1-CG2 4.39Å; V474-T476 PolarHBondContact O-N 2.87Å; V474-P487 HydrophobicContact CG1-CB 4.35Å
475	F	40.6	Very low	53.5	Low	133 Å²	133	103.9 Å²	103.9	58%	0.583	59%	0.586	S	S	*	*			trans	-61.3	132.7	170.1	-79.1	-108.6	0	0	0	105.8	I473 D488	I473-F475 HydrophobicContact CG2-CD2 4.42Å; I473-F475 WeakPolarHBondContact O-CD2 3.21Å; I473-F475 PolarHBondContact O-N 2.89Å; F475-D488 VanDerWaalsContact C-OD1 3.31Å; F475-D488 WeakPolarHBondContact CB-OD1 3.29Å; F475-D488 VanDerWaalsContact CB-OD2 3.31Å; F475-D488 WeakPolarHBondContact CB-OD2 3.02Å; F475-D488 PolarHBondContact N-OD2 3.01Å; F475-D488 VanDerWaalsContact O-CG 3.23Å; F475-D488 VanDerWaalsContact O-OD1 3.12Å
476	T	57.6	Low	55.2	Low	63 Å²	63	98.7 Å²	98.7	39%	0.387	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	101.8	-177.3	38.2	0	0	0	0	107.5	V474 I478 K485 C486	V474-T476 HydrophobicContact CG1-CG2 4.39Å; V474-T476 PolarHBondContact O-N 2.87Å; T476-I478 PolarHBondContact O-N 3.13Å; T476-I478 VanDerWaalsContact O-N 3.14Å; T476-K485 HydrophobicContact CG2-CB 4.17Å; T476-C486 CarbonylContact C-O 3.49Å; T476-C486 VanDerWaalsContact CA-O 3.3Å; T476-C486 WeakPolarHBondContact CA-O 3.43Å
477	Q	73.3	Confident	57.2	Low	63 Å²	63	96 Å²	96	29%	0.294	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	122.2	166.1	55.6	173.9	-40.9	0	0	108	C486 P487 D488 S490	Q477-C486 HydrophobicContact CG-CB 4.04Å; Q477-C486 WeakPolarHBondContact CG-O 3.49Å; Q477-C486 PolarHBondContact N-O 2.78Å; Q477-C486 PolarHBondContact O-N 3.19Å; Q477-P487 PolarHBondContact NE2-O 3.23Å; Q477-D488 PolarHBondContact NE2-O 2.75Å; Q477-S490 PolarHBondContact NE2-O 2.93Å
478	I	79.7	Confident	58.8	Low	110 Å²	110	93.5 Å²	93.5	56%	0.564	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	113.7	178.3	-61.8	176.9	0	0	0	106	T476	T476-I478 PolarHBondContact O-N 3.13Å; T476-I478 VanDerWaalsContact O-N 3.14Å
479	C	82.7	Confident	60.6	Low	1 Å²	1	90.2 Å²	90.2	1%	0.007	52%	0.516	C	S	.	.			trans	-62.7	151.6	178.7	-57.6	0	0	0	0	110.7	G481 G482 A484 C486 C492 Y500	C479-G481 PolarHBondContact O-N 2.86Å; C479-G482 PolarHBondContact O-N 2.97Å; C479-A484 HydrophobicContact CB-CB 4.08Å; C479-A484 PolarHBondContact N-O 3.18Å; C479-C486 PolarHBondContact SG-SG 3.12Å; C479-C492 WeakPolarHBondContact CA-SG 3.02Å; C479-C492 HydrophobicContact CB-CB 3.62Å; C479-C492 WeakPolarHBondContact CB-SG 2.99Å; C479-C492 WeakPolarHBondContact SG-CB 3.32Å; C479-C492 CovalentContact SG-SG 2.04Å; C479-C492 PolarHBondContact SG-SG 3.36Å; C479-Y500 HydrophobicContact CB-CD1 3.96Å; C479-Y500 HydrophobicContact CB-CG 3.77Å
480	P	78.4	Confident	63.2	Low	80 Å²	80	83.3 Å²	83.3	52%	0.519	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	136.3	178.5	-25.9	33.6	0	0	0	111.7	G482 Y500	P480-G482 VanDerWaalsContact C-N 3.35Å; P480-Y500 HydrophobicContact CB-CE1 4.29Å; P480-Y500 HydrophobicContact CB-CE2 4.28Å; P480-Y500 HydrophobicContact CG-CE1 4.15Å; P480-Y500 WeakPolarHBondContact O-CD2 3.49Å; P480-Y500 WeakPolarHBondContact O-CE2 3.48Å
481	G	67.6	Low	65.9	Low	73 Å²	73	78.7 Å²	78.7	75%	0.753	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	4.9	-172.2	0	0	0	0	0	115.5	C479 K483	C479-G481 PolarHBondContact O-N 2.86Å; G481-K483 VanDerWaalsContact C-N 3.25Å; G481-K483 PolarHBondContact O-N 3.14Å
482	G	65.4	Low	68.6	Low	49 Å²	49	73.1 Å²	73.1	51%	0.505	43%	0.428	S	S	.	.	S	Bend	trans	76.5	-11.1	155.5	0	0	0	0	0	117.8	C479 P480	C479-G482 PolarHBondContact O-N 2.97Å; P480-G482 VanDerWaalsContact C-N 3.35Å
483	K	67.2	Low	71.1	Confident	197 Å²	197	67.4 Å²	67.4	86%	0.857	39%	0.388	S	S	*	.	S	Bend	trans	-93.6	-9.6	-170.6	-68.9	175.8	-175.5	175.7	0	115.2	G481	G481-K483 VanDerWaalsContact C-N 3.25Å; G481-K483 PolarHBondContact O-N 3.14Å
484	A	70.6	Confident	73.5	Confident	16 Å²	16	68.7 Å²	68.7	13%	0.132	39%	0.389	C	S	.	.			trans	-121.4	139.6	174.9	0	0	0	0	0	110.2	C479	C479-A484 HydrophobicContact CB-CB 4.08Å; C479-A484 PolarHBondContact N-O 3.18Å
485	K	80.1	Confident	75.3	Confident	145 Å²	145	65.7 Å²	65.7	63%	0.63	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	125.9	175.2	-70.9	-176.2	179.1	-175.3	0	107.6	T476 C502	T476-K485 HydrophobicContact CG2-CB 4.17Å; K485-C502 PolarHBondContact O-SG 2.98Å
486	C	78.9	Confident	77	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	152.3	175.8	-55.4	0	0	0	0	110.5	T476 Q477 C479 C502	T476-C486 CarbonylContact C-O 3.49Å; T476-C486 VanDerWaalsContact CA-O 3.3Å; T476-C486 WeakPolarHBondContact CA-O 3.43Å; Q477-C486 HydrophobicContact CG-CB 4.04Å; Q477-C486 WeakPolarHBondContact CG-O 3.49Å; Q477-C486 PolarHBondContact N-O 2.78Å; Q477-C486 PolarHBondContact O-N 3.19Å; C479-C486 PolarHBondContact SG-SG 3.12Å; C486-C502 WeakPolarHBondContact CA-SG 3.37Å; C486-C502 HydrophobicContact CB-CB 3.78Å; C486-C502 WeakPolarHBondContact CB-SG 3.35Å; C486-C502 WeakPolarHBondContact SG-CA 3.45Å; C486-C502 WeakPolarHBondContact SG-CB 3.23Å; C486-C502 CovalentContact SG-SG 2.03Å; C486-C502 PolarHBondContact SG-SG 2.91Å
487	P	79.5	Confident	77.6	Confident	56 Å²	56	64.9 Å²	64.9	36%	0.364	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	153.1	165.3	-23.2	32.6	0	0	0	111.9	V474 Q477 S489 S490	V474-P487 HydrophobicContact CG1-CB 4.35Å; Q477-P487 PolarHBondContact NE2-O 3.23Å; P487-S489 PolarHBondContact O-N 3.11Å; P487-S489 VanDerWaalsContact O-N 3.15Å; P487-S490 WeakPolarHBondContact CD-OG 3.45Å; P487-S490 VanDerWaalsContact O-CB 3.26Å; P487-S490 WeakPolarHBondContact O-CB 3.16Å; P487-S490 PolarHBondContact O-N 2.97Å; P487-S490 PolarHBondContact O-OG 3.02Å
488	D	71.6	Confident	77.6	Confident	96 Å²	96	64.2 Å²	64.2	51%	0.513	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.6	-179.2	-49.9	-68	0	0	0	114	F475 Q477 S490	F475-D488 VanDerWaalsContact C-OD1 3.31Å; F475-D488 WeakPolarHBondContact CB-OD1 3.29Å; F475-D488 VanDerWaalsContact CB-OD2 3.31Å; F475-D488 WeakPolarHBondContact CB-OD2 3.02Å; F475-D488 PolarHBondContact N-OD2 3.01Å; F475-D488 VanDerWaalsContact O-CG 3.23Å; F475-D488 VanDerWaalsContact O-OD1 3.12Å; Q477-D488 PolarHBondContact NE2-O 2.75Å; D488-S490 VanDerWaalsContact C-N 3.25Å; D488-S490 PolarHBondContact O-N 2.87Å
489	S	73.4	Confident	77.5	Confident	76 Å²	76	65.5 Å²	65.5	53%	0.531	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	1.3	178.6	56	0	0	0	0	114.6	P487 I505 P506	P487-S489 PolarHBondContact O-N 3.11Å; P487-S489 VanDerWaalsContact O-N 3.15Å; S489-I505 CarbonylContact O-C 3.59Å; S489-P506 WeakPolarHBondContact O-CA 3.09Å; S489-P506 WeakPolarHBondContact O-CB 3.23Å; S489-P506 VanDerWaalsContact O-CD 3.29Å; S489-P506 WeakPolarHBondContact O-CD 3.44Å; S489-P506 VanDerWaalsContact O-N 3.11Å
490	S	84.5	Confident	77.7	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.084	41%	0.406	C	S	.	.	S	Bend	trans	-95	178	-179.9	-60.5	0	0	0	0	112.6	Q477 P487 D488 C503 I505	Q477-S490 PolarHBondContact NE2-O 2.93Å; P487-S490 WeakPolarHBondContact CD-OG 3.45Å; P487-S490 VanDerWaalsContact O-CB 3.26Å; P487-S490 WeakPolarHBondContact O-CB 3.16Å; P487-S490 PolarHBondContact O-N 2.97Å; P487-S490 PolarHBondContact O-OG 3.02Å; D488-S490 VanDerWaalsContact C-N 3.25Å; D488-S490 PolarHBondContact O-N 2.87Å; S490-C503 CarbonylContact C-O 3.35Å; S490-C503 WeakPolarHBondContact CA-O 3.39Å; S490-C503 WeakPolarHBondContact CB-O 3.28Å; S490-I505 CarbonylContact C-O 3.6Å
491	T	87.1	Confident	77.9	Confident	23 Å²	23	64.6 Å²	64.6	14%	0.141	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.2	167	-53	0	0	0	0	111.1	C493 C503 I505 N507 A508	T491-C493 PolarHBondContact O-N 2.75Å; T491-C503 PolarHBondContact N-O 2.89Å; T491-C503 PolarHBondContact O-N 2.03Å; T491-I505 PolarHBondContact N-O 2.85Å; T491-I505 PolarHBondContact OG1-O 2.82Å; T491-N507 PolarHBondContact OG1-N 2.97Å; T491-A508 HydrophobicContact CG2-CB 4.18Å; T491-A508 PolarHBondContact OG1-N 2.86Å
492	C	89.2	Confident	78.8	Confident	26 Å²	26	63 Å²	63	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	90.1	177.2	-77.4	0	0	0	0	112	C479 Y500 A501	C479-C492 WeakPolarHBondContact CA-SG 3.02Å; C479-C492 HydrophobicContact CB-CB 3.62Å; C479-C492 WeakPolarHBondContact CB-SG 2.99Å; C479-C492 WeakPolarHBondContact SG-CB 3.32Å; C479-C492 CovalentContact SG-SG 2.04Å; C479-C492 PolarHBondContact SG-SG 3.36Å; C492-Y500 HydrophobicContact CB-CD1 4.26Å; C492-A501 CarbonylContact C-O 3.35Å; C492-A501 WeakPolarHBondContact CA-O 3.32Å
493	C	89.4	Confident	79.9	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.034	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.5	174.7	-65.6	0	0	0	0	111.6	T491 Y500 A501 C510	T491-C493 PolarHBondContact O-N 2.75Å; C493-Y500 CarbonylContact O-C 3.48Å; C493-Y500 VanDerWaalsContact O-CA 3.25Å; C493-Y500 WeakPolarHBondContact O-CA 3.32Å; C493-Y500 WeakPolarHBondContact O-CD1 3.46Å; C493-A501 HydrophobicContact CB-CB 4.38Å; C493-A501 PolarHBondContact N-O 3.39Å; C493-A501 PolarHBondContact O-N 2.77Å; C493-C510 WeakPolarHBondContact CA-SG 3.23Å; C493-C510 HydrophobicContact CB-CB 3.65Å; C493-C510 WeakPolarHBondContact CB-SG 3.49Å; C493-C510 WeakPolarHBondContact SG-CB 3.27Å; C493-C510 CovalentContact SG-SG 2.04Å; C493-C510 PolarHBondContact SG-SG 3.11Å
494	K	85.1	Confident	80.7	Confident	127 Å²	127	54.8 Å²	54.8	55%	0.552	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	147.3	173.3	-171.1	179.3	175	-171.9	0	109.7	Y500	K494-Y500 HydrophobicContact CB-CD1 4.15Å; K494-Y500 HydrophobicContact CB-CE1 3.68Å; K494-Y500 HydrophobicContact CB-CE2 4.48Å; K494-Y500 HydrophobicContact CG-CE1 4.21Å; K494-Y500 HydrophobicContact CG-CE2 4.14Å
495	L	80.2	Confident	81.3	Confident	29 Å²	29	55.5 Å²	55.5	15%	0.152	32%	0.318	C	S	.	.			trans	-107.5	153.1	170.4	-55.7	174.1	0	0	0	110.3	S497 G498 K499 A501 D514 F556	L495-S497 PolarHBondContact O-N 2.84Å; L495-S497 VanDerWaalsContact O-N 3.1Å; L495-G498 WeakPolarHBondContact O-CA 3.18Å; L495-G498 PolarHBondContact O-N 2.78Å; L495-K499 HydrophobicContact CD1-CB 4.28Å; L495-K499 PolarHBondContact N-O 2.8Å; L495-A501 HydrophobicContact CD2-CB 3.97Å; L495-A501 HydrophobicContact CG-CB 4.24Å; L495-D514 VanDerWaalsContact C-OD1 3.32Å; L495-D514 VanDerWaalsContact CA-OD1 3.26Å; L495-D514 WeakPolarHBondContact CA-OD1 3.38Å; L495-D514 HydrophobicContact CB-CB 4.5Å; L495-D514 HydrophobicContact CD2-CB 3.87Å; L495-D514 VanDerWaalsContact CD2-O 3.25Å; L495-D514 WeakPolarHBondContact CD2-O 3.42Å; L495-F556 HydrophobicContact CD1-CZ 4.17Å; L495-F556 HydrophobicContact CD2-CE2 4.33Å; L495-F556 HydrophobicContact CD2-CZ 4.3Å
496	S	76	Confident	81.4	Confident	107 Å²	107	51.8 Å²	51.8	75%	0.748	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-25.8	167.6	46.9	0	0	0	0	113.9	G498 D514	S496-G498 PolarHBondContact O-N 3.14Å; S496-G498 VanDerWaalsContact O-N 3.1Å; S496-D514 WeakPolarHBondContact CB-OD2 3.11Å; S496-D514 PolarHBondContact N-OD1 3.1Å; S496-D514 PolarHBondContact N-OD2 3.33Å; S496-D514 PolarHBondContact OG-OD2 3.25Å
497	S	68.7	Low	81.6	Confident	72 Å²	72	58.2 Å²	58.2	50%	0.503	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	2.4	169.9	68.8	0	0	0	0	115	L495 K499	L495-S497 PolarHBondContact O-N 2.84Å; L495-S497 VanDerWaalsContact O-N 3.1Å; S497-K499 PolarHBondContact O-N 3.19Å; S497-K499 VanDerWaalsContact O-N 3.15Å
498	G	73.6	Confident	81.9	Confident	48 Å²	48	56 Å²	56	50%	0.495	33%	0.33	S	S	.	.	S	Bend	trans	73.1	-4.5	-176.7	0	0	0	0	0	114.8	L495 S496	L495-G498 WeakPolarHBondContact O-CA 3.18Å; L495-G498 PolarHBondContact O-N 2.78Å; S496-G498 PolarHBondContact O-N 3.14Å; S496-G498 VanDerWaalsContact O-N 3.1Å
499	K	79.3	Confident	82.7	Confident	137 Å²	137	54.9 Å²	54.9	60%	0.596	32%	0.323	S	S	*	.			trans	-84.2	174.3	174.6	-60.3	173.7	-173.8	173.4	0	110.5	L495 S497	L495-K499 HydrophobicContact CD1-CB 4.28Å; L495-K499 PolarHBondContact N-O 2.8Å; S497-K499 PolarHBondContact O-N 3.19Å; S497-K499 VanDerWaalsContact O-N 3.15Å
500	Y	85.8	Confident	83.5	Confident	61 Å²	61	53.8 Å²	53.8	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.3	177.1	-77.3	-102.3	0	0	0	111.9	C479 P480 C492 C493 K494	C479-Y500 HydrophobicContact CB-CD1 3.96Å; C479-Y500 HydrophobicContact CB-CG 3.77Å; P480-Y500 HydrophobicContact CB-CE1 4.29Å; P480-Y500 HydrophobicContact CB-CE2 4.28Å; P480-Y500 HydrophobicContact CG-CE1 4.15Å; P480-Y500 WeakPolarHBondContact O-CD2 3.49Å; P480-Y500 WeakPolarHBondContact O-CE2 3.48Å; C492-Y500 HydrophobicContact CB-CD1 4.26Å; C493-Y500 CarbonylContact O-C 3.48Å; C493-Y500 VanDerWaalsContact O-CA 3.25Å; C493-Y500 WeakPolarHBondContact O-CA 3.32Å; C493-Y500 WeakPolarHBondContact O-CD1 3.46Å; K494-Y500 HydrophobicContact CB-CD1 4.15Å; K494-Y500 HydrophobicContact CB-CE1 3.68Å; K494-Y500 HydrophobicContact CB-CE2 4.48Å; K494-Y500 HydrophobicContact CG-CE1 4.21Å; K494-Y500 HydrophobicContact CG-CE2 4.14Å
501	A	82.1	Confident	83.5	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.9	-172.8	0	0	0	0	0	110.3	C492 C493 L495 L555 F556	C492-A501 CarbonylContact C-O 3.35Å; C492-A501 WeakPolarHBondContact CA-O 3.32Å; C493-A501 HydrophobicContact CB-CB 4.38Å; C493-A501 PolarHBondContact N-O 3.39Å; C493-A501 PolarHBondContact O-N 2.77Å; L495-A501 HydrophobicContact CD2-CB 3.97Å; L495-A501 HydrophobicContact CG-CB 4.24Å; A501-L555 HydrophobicContact CB-CD2 3.8Å; A501-F556 HydrophobicContact CB-CE1 3.75Å; A501-F556 HydrophobicContact CB-CE2 4.04Å; A501-F556 HydrophobicContact CB-CZ 3.27Å
502	C	87.4	Confident	83.2	Confident	40 Å²	40	57.7 Å²	57.7	27%	0.27	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	104.4	173.3	-53.3	0	0	0	0	109.6	K485 C486	K485-C502 PolarHBondContact O-SG 2.98Å; C486-C502 WeakPolarHBondContact CA-SG 3.37Å; C486-C502 HydrophobicContact CB-CB 3.78Å; C486-C502 WeakPolarHBondContact CB-SG 3.35Å; C486-C502 WeakPolarHBondContact SG-CA 3.45Å; C486-C502 WeakPolarHBondContact SG-CB 3.23Å; C486-C502 CovalentContact SG-SG 2.03Å; C486-C502 PolarHBondContact SG-SG 2.91Å
503	C	87.9	Confident	82.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	130.9	161.9	176.5	0	0	0	0	108.7	S490 T491 I505 A508 C517	S490-C503 CarbonylContact C-O 3.35Å; S490-C503 WeakPolarHBondContact CA-O 3.39Å; S490-C503 WeakPolarHBondContact CB-O 3.28Å; T491-C503 PolarHBondContact N-O 2.89Å; T491-C503 PolarHBondContact O-N 2.03Å; C503-I505 PolarHBondContact O-N 3.32Å; C503-A508 HydrophobicContact CB-CB 4.24Å; C503-A508 WeakPolarHBondContact SG-CB 3.4Å; C503-C517 HydrophobicContact CB-CB 3.63Å; C503-C517 WeakPolarHBondContact CB-SG 3.4Å; C503-C517 WeakPolarHBondContact SG-CB 3.45Å; C503-C517 CovalentContact SG-SG 2.02Å; C503-C517 PolarHBondContact SG-SG 2.86Å
504	P	84.5	Confident	81.8	Confident	74 Å²	74	60.1 Å²	60.1	48%	0.481	36%	0.36	S	S	.	.	S	Bend	trans	-76.2	-3.5	-178.8	32	-36.8	0	0	0	114.2	L554	P504-L554 HydrophobicContact CG-CD2 4.1Å
505	I	83.9	Confident	81.2	Confident	30 Å²	30	59.3 Å²	59.3	15%	0.154	36%	0.361	C	S	.	.	S	Bend	trans	-89.2	134.9	173	-51.3	161.8	0	0	0	108.7	S489 S490 T491 C503 A508 P519 L554	S489-I505 CarbonylContact O-C 3.59Å; S490-I505 CarbonylContact C-O 3.6Å; T491-I505 PolarHBondContact N-O 2.85Å; T491-I505 PolarHBondContact OG1-O 2.82Å; C503-I505 PolarHBondContact O-N 3.32Å; I505-A508 HydrophobicContact CB-CB 4.02Å; I505-A508 HydrophobicContact CG2-CB 4.39Å; I505-P519 HydrophobicContact CD1-CG 4.18Å; I505-L554 HydrophobicContact CD1-CD1 3.73Å; I505-L554 HydrophobicContact CG1-CD1 4.12Å
506	P	81	Confident	81.3	Confident	68 Å²	68	59.6 Å²	59.6	44%	0.442	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	142.5	169.5	28.8	-33.3	0	0	0	111.4	S489 A508	S489-P506 WeakPolarHBondContact O-CA 3.09Å; S489-P506 WeakPolarHBondContact O-CB 3.23Å; S489-P506 VanDerWaalsContact O-CD 3.29Å; S489-P506 WeakPolarHBondContact O-CD 3.44Å; S489-P506 VanDerWaalsContact O-N 3.11Å; P506-A508 VanDerWaalsContact C-N 3.26Å; P506-A508 PolarHBondContact O-N 2.81Å
507	N	82.9	Confident	81.8	Confident	134 Å²	134	54.8 Å²	54.8	72%	0.717	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	37.9	-179.2	-56.9	-29.5	0	0	0	114	T491 P520	T491-N507 PolarHBondContact OG1-N 2.97Å; N507-P520 HydrophobicContact CB-CB 4.48Å; N507-P520 HydrophobicContact CB-CG 4.48Å; N507-P520 WeakPolarHBondContact O-CB 3.4Å
508	A	87	Confident	82.8	Confident	11 Å²	11	51.5 Å²	51.5	9%	0.091	30%	0.304	C	S	.	.			trans	-72.8	146.2	-177.6	0	0	0	0	0	112.9	T491 C503 I505 P506 C510 C517 C518	T491-A508 HydrophobicContact CG2-CB 4.18Å; T491-A508 PolarHBondContact OG1-N 2.86Å; C503-A508 HydrophobicContact CB-CB 4.24Å; C503-A508 WeakPolarHBondContact SG-CB 3.4Å; I505-A508 HydrophobicContact CB-CB 4.02Å; I505-A508 HydrophobicContact CG2-CB 4.39Å; P506-A508 VanDerWaalsContact C-N 3.26Å; P506-A508 PolarHBondContact O-N 2.81Å; A508-C510 PolarHBondContact O-N 2.99Å; A508-C517 HydrophobicContact CB-CB 4.07Å; A508-C518 CarbonylContact C-O 3.56Å; A508-C518 VanDerWaalsContact CA-O 3.3Å; A508-C518 WeakPolarHBondContact CA-O 3.16Å
509	I	87.9	Confident	83.3	Confident	72 Å²	72	51.4 Å²	51.4	37%	0.369	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	105.4	169.8	-70	164.5	0	0	0	107.5	C511 C517 C518 T522	I509-C511 PolarHBondContact O-N 3.48Å; I509-C517 WeakPolarHBondContact O-CA 3.02Å; I509-C518 HydrophobicContact CB-CB 4.44Å; I509-C518 PolarHBondContact N-O 2.87Å; I509-C518 PolarHBondContact O-N 3.01Å; I509-T522 WeakPolarHBondContact CD1-O 3.25Å
510	C	89.5	Confident	83.5	Confident	53 Å²	53	48.4 Å²	48.4	36%	0.358	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.1	178.6	-56.3	0	0	0	0	110.3	C493 A508	C493-C510 WeakPolarHBondContact CA-SG 3.23Å; C493-C510 HydrophobicContact CB-CB 3.65Å; C493-C510 WeakPolarHBondContact CB-SG 3.49Å; C493-C510 WeakPolarHBondContact SG-CB 3.27Å; C493-C510 CovalentContact SG-SG 2.04Å; C493-C510 PolarHBondContact SG-SG 3.11Å; A508-C510 PolarHBondContact O-N 2.99Å
511	C	85.5	Confident	83.3	Confident	10 Å²	10	48.1 Å²	48.1	7%	0.068	31%	0.305	C	S	.	.			trans	-79.1	149.9	-176.8	-55.9	0	0	0	0	111.7	I509 D513 D514 H516 C524	I509-C511 PolarHBondContact O-N 3.48Å; C511-D513 WeakPolarHBondContact CB-OD1 3.36Å; C511-D513 PolarHBondContact O-N 3.14Å; C511-D514 PolarHBondContact O-N 3.17Å; C511-H516 HydrophobicContact CB-CB 3.98Å; C511-H516 VanDerWaalsContact CB-O 3.23Å; C511-H516 WeakPolarHBondContact CB-O 3.44Å; C511-H516 PolarHBondContact N-O 2.64Å; C511-H516 PolarHBondContact SG-O 2.98Å; C511-H516 VanDerWaalsContact SG-O 3.4Å; C511-C524 WeakPolarHBondContact CA-SG 3.37Å; C511-C524 HydrophobicContact CB-CB 3.64Å; C511-C524 WeakPolarHBondContact CB-SG 2.97Å; C511-C524 WeakPolarHBondContact SG-CB 3.04Å; C511-C524 CovalentContact SG-SG 2.04Å; C511-C524 PolarHBondContact SG-SG 3.42Å
512	A	80.5	Confident	83.5	Confident	107 Å²	107	48.6 Å²	48.6	88%	0.884	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	6.4	-178.5	0	0	0	0	0	114.4
513	D	73.7	Confident	83.2	Confident	39 Å²	39	49.6 Å²	49.6	21%	0.209	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	0.1	173.7	61.4	18.8	0	0	0	113.2	C511 I515 H516	C511-D513 WeakPolarHBondContact CB-OD1 3.36Å; C511-D513 PolarHBondContact O-N 3.14Å; D513-I515 WeakPolarHBondContact O-CD1 3.37Å; D513-I515 VanDerWaalsContact O-CG1 3.28Å; D513-I515 WeakPolarHBondContact O-CG1 3.49Å; D513-I515 PolarHBondContact O-N 2.99Å; D513-I515 PolarHBondContact OD1-N 3.02Å; D513-H516 PolarHBondContact OD1-N 3.33Å; D513-H516 IonicContact OD1-ND1 3.16Å; D513-H516 IonicContact OD2-CE1 2.75Å; D513-H516 IonicContact OD2-CG 3.65Å; D513-H516 IonicContact OD2-ND1 2.64Å; D513-H516 PolarHBondContact OD2-ND1 3.48Å
514	D	75.8	Confident	83	Confident	43 Å²	43	51 Å²	51	23%	0.23	32%	0.324	C	S	.	.	S	Bend	trans	60.1	-0.2	-175.3	-52.2	-59.3	0	0	0	116	L495 S496 C511	L495-D514 VanDerWaalsContact C-OD1 3.32Å; L495-D514 VanDerWaalsContact CA-OD1 3.26Å; L495-D514 WeakPolarHBondContact CA-OD1 3.38Å; L495-D514 HydrophobicContact CB-CB 4.5Å; L495-D514 HydrophobicContact CD2-CB 3.87Å; L495-D514 VanDerWaalsContact CD2-O 3.25Å; L495-D514 WeakPolarHBondContact CD2-O 3.42Å; S496-D514 WeakPolarHBondContact CB-OD2 3.11Å; S496-D514 PolarHBondContact N-OD1 3.1Å; S496-D514 PolarHBondContact N-OD2 3.33Å; S496-D514 PolarHBondContact OG-OD2 3.25Å; C511-D514 PolarHBondContact O-N 3.17Å
515	I	72.8	Confident	82.8	Confident	110 Å²	110	49.8 Å²	49.8	56%	0.564	31%	0.314	S	S	*	.	S	Bend	trans	-120.2	-12.1	-166.6	-61.8	159	0	0	0	111.4	D513 L555	D513-I515 WeakPolarHBondContact O-CD1 3.37Å; D513-I515 VanDerWaalsContact O-CG1 3.28Å; D513-I515 WeakPolarHBondContact O-CG1 3.49Å; D513-I515 PolarHBondContact O-N 2.99Å; D513-I515 PolarHBondContact OD1-N 3.02Å; I515-L555 WeakPolarHBondContact O-CB 3.22Å; I515-L555 WeakPolarHBondContact O-CD1 3.09Å
516	H	80.7	Confident	82	Confident	35 Å²	35	55.7 Å²	55.7	16%	0.162	34%	0.336	C	S	.	.			trans	-124.7	151.3	173.2	-57.5	97.4	0	0	0	113.1	C511 D513	C511-H516 HydrophobicContact CB-CB 3.98Å; C511-H516 VanDerWaalsContact CB-O 3.23Å; C511-H516 WeakPolarHBondContact CB-O 3.44Å; C511-H516 PolarHBondContact N-O 2.64Å; C511-H516 PolarHBondContact SG-O 2.98Å; C511-H516 VanDerWaalsContact SG-O 3.4Å; D513-H516 PolarHBondContact OD1-N 3.33Å; D513-H516 IonicContact OD1-ND1 3.16Å; D513-H516 IonicContact OD2-CE1 2.75Å; D513-H516 IonicContact OD2-CG 3.65Å; D513-H516 IonicContact OD2-ND1 2.64Å; D513-H516 PolarHBondContact OD2-ND1 3.48Å
517	C	87.3	Confident	81.4	Confident	6 Å²	6	60.1 Å²	60.1	4%	0.041	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.3	165.7	61.6	0	0	0	0	109.7	C503 A508 I509 L554	C503-C517 HydrophobicContact CB-CB 3.63Å; C503-C517 WeakPolarHBondContact CB-SG 3.4Å; C503-C517 WeakPolarHBondContact SG-CB 3.45Å; C503-C517 CovalentContact SG-SG 2.02Å; C503-C517 PolarHBondContact SG-SG 2.86Å; A508-C517 HydrophobicContact CB-CB 4.07Å; I509-C517 WeakPolarHBondContact O-CA 3.02Å; C517-L554 PolarHBondContact SG-O 3.47Å; C517-L554 VanDerWaalsContact SG-O 3.38Å
518	C	89.2	Confident	80.5	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.014	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	149.3	-174.8	-78.6	0	0	0	0	111.9	A508 I509 T522 C531	A508-C518 CarbonylContact C-O 3.56Å; A508-C518 VanDerWaalsContact CA-O 3.3Å; A508-C518 WeakPolarHBondContact CA-O 3.16Å; I509-C518 HydrophobicContact CB-CB 4.44Å; I509-C518 PolarHBondContact N-O 2.87Å; I509-C518 PolarHBondContact O-N 3.01Å; C518-T522 WeakPolarHBondContact CB-OG1 3.36Å; C518-C531 WeakPolarHBondContact CA-SG 3.45Å; C518-C531 HydrophobicContact CB-CB 3.7Å; C518-C531 WeakPolarHBondContact CB-SG 3.5Å; C518-C531 WeakPolarHBondContact SG-CA 3.36Å; C518-C531 WeakPolarHBondContact SG-CB 3.42Å; C518-C531 CovalentContact SG-SG 2.04Å; C518-C531 PolarHBondContact SG-SG 2.87Å
519	P	84.7	Confident	79.5	Confident	47 Å²	47	60.8 Å²	60.8	31%	0.305	35%	0.353	S	S	.	.			trans	-56.6	149.9	174.7	-26	34.5	0	0	0	113.3	I505 G521 T522	I505-P519 HydrophobicContact CD1-CG 4.18Å; P519-G521 PolarHBondContact O-N 3.45Å; P519-T522 WeakPolarHBondContact CD-OG1 3.01Å; P519-T522 PolarHBondContact O-N 3.41Å; P519-T522 VanDerWaalsContact O-N 3.07Å; P519-T522 PolarHBondContact O-OG1 2.9Å
520	P	83.5	Confident	78.7	Confident	74 Å²	74	59 Å²	59	48%	0.481	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	136.2	171.5	18.6	-30.3	0	0	0	111.4	N507	N507-P520 HydrophobicContact CB-CB 4.48Å; N507-P520 HydrophobicContact CB-CG 4.48Å; N507-P520 WeakPolarHBondContact O-CB 3.4Å
521	G	80.5	Confident	78.3	Confident	54 Å²	54	57.7 Å²	57.7	56%	0.557	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	5.8	-174.6	0	0	0	0	0	115.6	P519 A534	P519-G521 PolarHBondContact O-N 3.45Å; G521-A534 PolarHBondContact O-N 2.04Å
522	T	86.6	Confident	78.1	Confident	11 Å²	11	60.3 Å²	60.3	7%	0.067	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.7	174.9	62.8	0	0	0	0	112.7	I509 C518 P519 V532 K533	I509-T522 WeakPolarHBondContact CD1-O 3.25Å; C518-T522 WeakPolarHBondContact CB-OG1 3.36Å; P519-T522 WeakPolarHBondContact CD-OG1 3.01Å; P519-T522 PolarHBondContact O-N 3.41Å; P519-T522 VanDerWaalsContact O-N 3.07Å; P519-T522 PolarHBondContact O-OG1 2.9Å; T522-V532 CarbonylContact C-O 3.53Å; T522-V532 WeakPolarHBondContact CA-O 3.14Å; T522-V532 WeakPolarHBondContact CB-O 3.25Å; T522-K533 HydrophobicContact CG2-CG 4.23Å
523	S	82.3	Confident	77.7	Confident	62 Å²	62	62.8 Å²	62.8	43%	0.434	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	149.5	175.3	-170.6	0	0	0	0	110.9	C531 V532	S523-C531 CarbonylContact O-C 3.48Å; S523-C531 WeakPolarHBondContact O-CA 3.33Å; S523-V532 PolarHBondContact N-O 3.06Å; S523-V532 PolarHBondContact O-N 2.01Å
524	C	83.4	Confident	76.9	Confident	28 Å²	28	63.9 Å²	63.9	19%	0.189	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	117.5	177.6	-57.1	0	0	0	0	111.7	C511	C511-C524 WeakPolarHBondContact CA-SG 3.37Å; C511-C524 HydrophobicContact CB-CB 3.64Å; C511-C524 WeakPolarHBondContact CB-SG 2.97Å; C511-C524 WeakPolarHBondContact SG-CB 3.04Å; C511-C524 CovalentContact SG-SG 2.04Å; C511-C524 PolarHBondContact SG-SG 3.42Å
525	D	79.8	Confident	75.8	Confident	50 Å²	50	69.3 Å²	69.3	27%	0.267	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	100.5	159.3	-170.3	-20	0	0	0	109.3	K527 T528 L529 S530 V532	D525-K527 PolarHBondContact O-N 3.03Å; D525-K527 WeakPolarHBondContact OD1-CA 3.39Å; D525-K527 VanDerWaalsContact OD1-CB 3.27Å; D525-K527 WeakPolarHBondContact OD1-CB 3.43Å; D525-K527 PolarHBondContact OD1-N 3.29Å; D525-T528 PolarHBondContact OD1-N 2.79Å; D525-L529 WeakPolarHBondContact O-CA 3.4Å; D525-L529 PolarHBondContact O-N 2.72Å; D525-S530 PolarHBondContact N-O 3.49Å; D525-S530 PolarHBondContact O-N 2.77Å; D525-V532 HydrophobicContact CB-CG1 4.33Å
526	Y	68	Low	74.5	Confident	154 Å²	154	72.3 Å²	72.3	60%	0.604	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-14.6	177	64.7	-91.4	0	0	0	113.5
527	K	67.8	Low	72.7	Confident	161 Å²	161	78.1 Å²	78.1	70%	0.7	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-38.4	179.4	-58.5	179.6	179.1	176.4	0	111.6	D525	D525-K527 PolarHBondContact O-N 3.03Å; D525-K527 WeakPolarHBondContact OD1-CA 3.39Å; D525-K527 VanDerWaalsContact OD1-CB 3.27Å; D525-K527 WeakPolarHBondContact OD1-CB 3.43Å; D525-K527 PolarHBondContact OD1-N 3.29Å
528	T	64.8	Low	70.6	Confident	82 Å²	82	86 Å²	86	50%	0.503	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-4.9	176.7	69.5	0	0	0	0	113.2	D525 S530	D525-T528 PolarHBondContact OD1-N 2.79Å; T528-S530 PolarHBondContact O-OG 2.88Å; T528-S530 VanDerWaalsContact O-OG 3.13Å; T528-S530 WeakPolarHBondContact OG1-CB 3.28Å; T528-S530 PolarHBondContact OG1-OG 2.76Å
529	L	65.1	Low	67.9	Low	76 Å²	76	90.9 Å²	90.9	40%	0.398	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	64.1	-168.9	-52.6	177.9	0	0	0	109.3	D525 P552	D525-L529 WeakPolarHBondContact O-CA 3.4Å; D525-L529 PolarHBondContact O-N 2.72Å; L529-P552 HydrophobicContact CB-CB 3.63Å; L529-P552 HydrophobicContact CB-CG 3.77Å; L529-P552 VanDerWaalsContact O-CB 3.27Å; L529-P552 WeakPolarHBondContact O-CB 3.43Å; L529-P552 WeakPolarHBondContact O-CG 3.13Å
530	S	70.8	Confident	65.7	Low	35 Å²	35	97.1 Å²	97.1	25%	0.245	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	156	-173.2	-52.5	0	0	0	0	112.8	D525 T528	D525-S530 PolarHBondContact N-O 3.49Å; D525-S530 PolarHBondContact O-N 2.77Å; T528-S530 PolarHBondContact O-OG 2.88Å; T528-S530 VanDerWaalsContact O-OG 3.13Å; T528-S530 WeakPolarHBondContact OG1-CB 3.28Å; T528-S530 PolarHBondContact OG1-OG 2.76Å
531	C	81.3	Confident	63.1	Low	26 Å²	26	96.9 Å²	96.9	18%	0.176	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	107.2	175.3	-56.5	0	0	0	0	109.3	C518 S523 L549	C518-C531 WeakPolarHBondContact CA-SG 3.45Å; C518-C531 HydrophobicContact CB-CB 3.7Å; C518-C531 WeakPolarHBondContact CB-SG 3.5Å; C518-C531 WeakPolarHBondContact SG-CA 3.36Å; C518-C531 WeakPolarHBondContact SG-CB 3.42Å; C518-C531 CovalentContact SG-SG 2.04Å; C518-C531 PolarHBondContact SG-SG 2.87Å; S523-C531 CarbonylContact O-C 3.48Å; S523-C531 WeakPolarHBondContact O-CA 3.33Å; C531-L549 VanDerWaalsContact O-CG 3.28Å; C531-L549 WeakPolarHBondContact O-CG 3.37Å
532	V	81.5	Confident	60.8	Low	65 Å²	65	100.3 Å²	100.3	39%	0.394	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.3	138.2	-178.8	-62.9	0	0	0	0	110.4	T522 S523 D525 A534	T522-V532 CarbonylContact C-O 3.53Å; T522-V532 WeakPolarHBondContact CA-O 3.14Å; T522-V532 WeakPolarHBondContact CB-O 3.25Å; S523-V532 PolarHBondContact N-O 3.06Å; S523-V532 PolarHBondContact O-N 2.01Å; D525-V532 HydrophobicContact CB-CG1 4.33Å; V532-A534 PolarHBondContact O-N 3.36Å
533	K	72.5	Confident	58.1	Low	158 Å²	158	105.8 Å²	105.8	69%	0.687	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.7	129.4	175.5	-76	-171	175.2	-174	0	109.9	T522 N535	T522-K533 HydrophobicContact CG2-CG 4.23Å; K533-N535 VanDerWaalsContact C-N 3.3Å; K533-N535 PolarHBondContact O-N 2.03Å
534	A	57.5	Low	55.7	Low	62 Å²	62	108.7 Å²	108.7	51%	0.512	62%	0.619	S	S	.	*	S	Bend	trans	-80.4	78	177.4	0	0	0	0	0	110.5	G521 V532	G521-A534 PolarHBondContact O-N 2.04Å; V532-A534 PolarHBondContact O-N 3.36Å
535	N	52.3	Low	53.4	Low	157 Å²	157	111.6 Å²	111.6	84%	0.84	65%	0.645	S	S	*	*			trans	-172.9	131.5	154	-94.6	-22	0	0	0	110.4	K533	K533-N535 VanDerWaalsContact C-N 3.3Å; K533-N535 PolarHBondContact O-N 2.03Å
536	N	44.6	Very low	51.3	Low	173 Å²	173	116 Å²	116	93%	0.925	67%	0.668	S	S	*	*			trans	-93.4	112.3	171.4	-74.8	-36.5	0	0	0	109.5
537	D	43	Very low	49.9	Very low	157 Å²	157	117.1 Å²	117.1	84%	0.84	68%	0.679	S	S	*	*			trans	-148.6	162.3	153.6	-149.9	-15.5	0	0	0	110.5
538	H	42.6	Very low	48.5	Very low	173 Å²	173	117 Å²	117	80%	0.801	69%	0.685	S	S	*	*			trans	-86.7	139.8	-166.8	-89.1	19.2	0	0	0	114.9
539	S	34	Very low	47.2	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	68%	0.683	S	S	*	*			trans	26.5	108.9	144	-59.2	0	0	0	0	119.6
540	I	37.1	Very low	45.8	Very low	177 Å²	177	124.9 Å²	124.9	91%	0.908	71%	0.706	S	S	*	*				-175.5	141.4	127.1	-96.6	150.2	0	0	0	110.9
541	G	30.2	Very low	44.2	Very low	69 Å²	69	129 Å²	129	71%	0.711	73%	0.726	S	S	*	*			trans	88	132.3	145.3	0	0	0	0	0	120.6
542	S	31.3	Very low	41.8	Very low	126 Å²	126	130.3 Å²	130.3	88%	0.881	73%	0.734	S	S	*	*			trans	64.2	155.8	158.7	-100.4	0	0	0	0	121.4
543	P	30.2	Very low	39.5	Very low	126 Å²	126	135 Å²	135	82%	0.818	75%	0.749	S	S	*	*			trans	-108.1	89.5	-171.6	38	-26.6	0	0	0	113.2
544	S	32.5	Very low	37.6	Very low	124 Å²	124	131.3 Å²	131.3	87%	0.867	74%	0.736	S	S	*	*			trans	-151.8	85.7	167	-167.2	0	0	0	0	112.3
545	A	34.6	Very low	36.4	Very low	89 Å²	89	130 Å²	130	74%	0.736	72%	0.721	S	S	*	*			trans	-163.3	41.8	175.4	0	0	0	0	0	112.2
546	N	36.4	Very low	35.4	Very low	141 Å²	141	128.1 Å²	128.1	75%	0.754	71%	0.705	S	S	*	*			trans	-78.7	158.3	-174	-90.6	13	0	0	0	114.4	L548	N546-L548 VanDerWaalsContact C-N 3.31Å; N546-L548 PolarHBondContact O-N 2.75Å
547	E	37.2	Very low	34.6	Very low	179 Å²	179	127.1 Å²	127.1	84%	0.836	71%	0.706	S	S	*	*	S	Bend	trans	61.8	-10.8	152.6	-127.8	80.4	-136.8	0	0	121.3
548	L	38.8	Very low	34.2	Very low	158 Å²	158	122.5 Å²	122.5	83%	0.827	70%	0.695	S	S	*	*	S	Bend	trans	-106.6	2.9	-179.1	-81.4	171.3	0	0	0	116.3	N546	N546-L548 VanDerWaalsContact C-N 3.31Å; N546-L548 PolarHBondContact O-N 2.75Å
549	L	37.6	Very low	33.9	Very low	86 Å²	86	119.3 Å²	119.3	45%	0.45	69%	0.687	S	S	.	*	S	Bend	trans	-118.8	16.8	-170.4	-127.8	81.4	0	0	0	115.9	C531	C531-L549 VanDerWaalsContact O-CG 3.28Å; C531-L549 WeakPolarHBondContact O-CG 3.37Å
550	R	36.2	Very low	34.3	Very low	237 Å²	237	122.9 Å²	122.9	89%	0.894	69%	0.685	S	S	*	*	S	Bend	trans	-140.5	17.2	-170.9	-76.5	-168.7	175	-121.4	-3.2	117
551	N	37.4	Very low	35.2	Very low	123 Å²	123	118 Å²	118	66%	0.658	66%	0.66	S	S	*	*			trans	-134.8	92.9	-175.9	-159.2	-1.9	0	0	0	113.1	K553	N551-K553 VanDerWaalsContact C-N 3.25Å; N551-K553 PolarHBondContact O-N 2.03Å
552	P	30.5	Very low	37.2	Very low	53 Å²	53	117.4 Å²	117.4	34%	0.344	64%	0.639	S	S	.	*			trans	-75.1	73.2	177	29.2	-33.3	0	0	0	112	L529	L529-P552 HydrophobicContact CB-CB 3.63Å; L529-P552 HydrophobicContact CB-CG 3.77Å; L529-P552 VanDerWaalsContact O-CB 3.27Å; L529-P552 WeakPolarHBondContact O-CB 3.43Å; L529-P552 WeakPolarHBondContact O-CG 3.13Å
553	K	33	Very low	39.4	Very low	163 Å²	163	114.5 Å²	114.5	71%	0.709	62%	0.615	S	S	*	*			trans	-142.8	54.8	177.5	-68.1	-164.6	175.2	-172.7	0	112.1	N551	N551-K553 VanDerWaalsContact C-N 3.25Å; N551-K553 PolarHBondContact O-N 2.03Å
554	L	33.5	Very low	41.9	Very low	80 Å²	80	108.6 Å²	108.6	42%	0.419	58%	0.577	S	S	.	*			trans	-132.8	77.3	173.6	-71.6	179.2	0	0	0	112.1	P504 I505 C517	P504-L554 HydrophobicContact CG-CD2 4.1Å; I505-L554 HydrophobicContact CD1-CD1 3.73Å; I505-L554 HydrophobicContact CG1-CD1 4.12Å; C517-L554 PolarHBondContact SG-O 3.47Å; C517-L554 VanDerWaalsContact SG-O 3.38Å
555	L	30.7	Very low	43.8	Very low	36 Å²	36	107.2 Å²	107.2	19%	0.188	57%	0.565	C	S	.	*	S	Bend	trans	-158	147.3	147	-115.1	153.3	0	0	0	111.4	A501 I515	A501-L555 HydrophobicContact CB-CD2 3.8Å; I515-L555 WeakPolarHBondContact O-CB 3.22Å; I515-L555 WeakPolarHBondContact O-CD1 3.09Å
556	F	32	Very low	45.2	Very low	116 Å²	116	104.7 Å²	104.7	51%	0.509	55%	0.548	S	S	.	.			trans	60.7	123.2	179.3	-65.2	-70.3	0	0	0	118.6	L495 A501 G558	L495-F556 HydrophobicContact CD1-CZ 4.17Å; L495-F556 HydrophobicContact CD2-CE2 4.33Å; L495-F556 HydrophobicContact CD2-CZ 4.3Å; A501-F556 HydrophobicContact CB-CE1 3.75Å; A501-F556 HydrophobicContact CB-CE2 4.04Å; A501-F556 HydrophobicContact CB-CZ 3.27Å; F556-G558 VanDerWaalsContact C-N 3.3Å; F556-G558 PolarHBondContact O-N 2.84Å
557	T	28.6	Very low	46.5	Very low	153 Å²	153	105 Å²	105	94%	0.939	55%	0.545	S	S	*	.			trans	-68.3	84.5	161.3	50.7	0	0	0	0	110.1
558	G	33	Very low	47.8	Very low	59 Å²	59	102.7 Å²	102.7	61%	0.608	53%	0.534	S	S	*	.			trans	-130.7	157	169.1	0	0	0	0	0	109.9	F556 R560	F556-G558 VanDerWaalsContact C-N 3.3Å; F556-G558 PolarHBondContact O-N 2.84Å; G558-R560 PolarHBondContact O-N 3.3Å
559	V	36.3	Very low	49.2	Very low	106 Å²	106	95.3 Å²	95.3	64%	0.642	50%	0.496	S	S	*	.			trans	-60.3	135.8	174.1	-179.1	0	0	0	0	108.4	D561	V559-D561 PolarHBondContact O-N 2.77Å
560	R	42.8	Very low	51.1	Low	180 Å²	180	92.1 Å²	92.1	68%	0.679	48%	0.479	S	S	*	.			trans	-65.2	116.9	170	-71.8	179.3	179.3	176.7	3.5	107.6	G558 S572 D573	G558-R560 PolarHBondContact O-N 3.3Å; R560-S572 CarbonylContact O-C 3.44Å; R560-D573 HydrophobicContact CB-CB 4.09Å; R560-D573 WeakPolarHBondContact CB-OD1 3.39Å; R560-D573 VanDerWaalsContact CB-OD2 3.23Å; R560-D573 WeakPolarHBondContact CB-OD2 3.31Å; R560-D573 WeakPolarHBondContact CD-OD2 3.09Å; R560-D573 WeakPolarHBondContact O-CB 3.25Å; R560-D573 PolarHBondContact O-N 2.87Å
561	D	56.1	Low	53.2	Low	73 Å²	73	80.9 Å²	80.9	39%	0.39	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.4	172.4	-66	-29.7	0	0	0	110.2	V559 T570 C571 S572	V559-D561 PolarHBondContact O-N 2.77Å; D561-T570 HydrophobicContact CB-CG2 4.47Å; D561-C571 CarbonylContact C-O 3.49Å; D561-C571 WeakPolarHBondContact CA-O 3.33Å; D561-C571 WeakPolarHBondContact CB-O 3.28Å; D561-S572 WeakPolarHBondContact OD1-CA 3.38Å; D561-S572 WeakPolarHBondContact OD1-CB 3.26Å; D561-S572 PolarHBondContact OD1-N 2.84Å; D561-S572 PolarHBondContact OD1-OG 3.08Å
562	H	72.5	Confident	55.1	Low	58 Å²	58	76.1 Å²	76.1	27%	0.269	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	145	169.6	68.8	-84.7	0	0	0	110.6	T570 C571 S572 Q575 C577	H562-T570 WeakPolarHBondContact O-CA 3.04Å; H562-C571 PolarHBondContact N-O 3.44Å; H562-C571 PolarHBondContact ND1-O 2.98Å; H562-C571 PolarHBondContact O-N 3.21Å; H562-S572 PolarHBondContact CE1-O 3.38Å; H562-S572 PolarHBondContact ND1-O 2.95Å; H562-Q575 PolarHBondContact CE1-O 3.18Å; H562-C577 PolarHBondContact CD2-SG 3.25Å; H562-C577 PolarHBondContact NE2-SG 3.31Å
563	V	78.3	Confident	56.9	Low	64 Å²	64	77.8 Å²	77.8	39%	0.388	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.9	-179.4	-176	0	0	0	0	109.2	H567 T570	V563-H567 HydrophobicContact CG1-CB 4.47Å; V563-T570 HydrophobicContact CB-CG2 4.5Å; V563-T570 HydrophobicContact CG2-CG2 4.01Å
564	C	81.2	Confident	58.7	Low	2 Å²	2	73.2 Å²	73.2	1%	0.014	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-73.3	153.3	179.9	-59	0	0	0	0	112.3	G566 H567 S569 C577 W585	C564-G566 PolarHBondContact O-N 2.04Å; C564-H567 PolarHBondContact O-N 2.77Å; C564-S569 PolarHBondContact N-O 3.29Å; C564-C577 WeakPolarHBondContact CA-SG 3.4Å; C564-C577 HydrophobicContact CB-CB 3.67Å; C564-C577 WeakPolarHBondContact CB-SG 3.37Å; C564-C577 WeakPolarHBondContact SG-CB 3.24Å; C564-C577 CovalentContact SG-SG 2.04Å; C564-C577 PolarHBondContact SG-SG 2.75Å; C564-W585 HydrophobicContact CB-CB 3.88Å; C564-W585 HydrophobicContact CB-CD2 3.79Å; C564-W585 HydrophobicContact CB-CE3 4.18Å; C564-W585 HydrophobicContact CB-CG 3.62Å
565	P	73	Confident	61.1	Low	95 Å²	95	72 Å²	72	62%	0.617	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	88.1	-177.5	-21.4	33	0	0	0	113.4	W585	P565-W585 HydrophobicContact CB-CH2 4.07Å; P565-W585 HydrophobicContact CB-CZ2 3.68Å; P565-W585 HydrophobicContact CG-CH2 3.84Å; P565-W585 HydrophobicContact CG-CZ2 3.94Å; P565-W585 HydrophobicContact CG-CZ3 4.47Å; P565-W585 VanDerWaalsContact O-CE2 3.24Å; P565-W585 VanDerWaalsContact O-CZ2 3.23Å; P565-W585 WeakPolarHBondContact O-CZ2 3.47Å; P565-W585 PolarHBondContact O-NE1 2.86Å
566	G	64.6	Low	63.7	Low	36 Å²	36	72.3 Å²	72.3	37%	0.371	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	148.8	-7.9	-168.6	0	0	0	0	0	114.2	C564 Q568	C564-G566 PolarHBondContact O-N 2.04Å; G566-Q568 PolarHBondContact O-N 3.16Å
567	H	63.5	Low	66.4	Low	149 Å²	149	67.5 Å²	67.5	69%	0.69	38%	0.379	S	S	*	.	S	Bend	trans	64.5	-13	170.3	-62.7	-101.2	0	0	0	117.4	V563 C564 S569	V563-H567 HydrophobicContact CG1-CB 4.47Å; C564-H567 PolarHBondContact O-N 2.77Å; H567-S569 PolarHBondContact O-N 3.42Å
568	Q	64.9	Low	69.2	Low	129 Å²	129	60.3 Å²	60.3	60%	0.603	34%	0.335	S	S	*	.	S	Bend	trans	-74.5	-8.3	178.7	-66.7	165.4	24	0	0	113.4	G566 S735 K736	G566-Q568 PolarHBondContact O-N 3.16Å; Q568-S735 CarbonylContact O-C 3.35Å; Q568-S735 WeakPolarHBondContact O-CA 3.05Å; Q568-K736 PolarHBondContact O-N 2.04Å
569	S	67.1	Low	71.8	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.028	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	148.3	-156.4	32.1	0	0	0	0	113.2	C564 H567 S733	C564-S569 PolarHBondContact N-O 3.29Å; H567-S569 PolarHBondContact O-N 3.42Å; S569-S733 WeakPolarHBondContact CB-OG 3.5Å
570	T	77.6	Confident	73.9	Confident	18 Å²	18	59.4 Å²	59.4	11%	0.11	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	146.4	-179.1	42.1	0	0	0	0	113.1	D561 H562 V563 C587 K736	D561-T570 HydrophobicContact CB-CG2 4.47Å; H562-T570 WeakPolarHBondContact O-CA 3.04Å; V563-T570 HydrophobicContact CB-CG2 4.5Å; V563-T570 HydrophobicContact CG2-CG2 4.01Å; T570-C587 PolarHBondContact O-SG 3.37Å; T570-C587 VanDerWaalsContact O-SG 3.36Å; T570-K736 HydrophobicContact CG2-CD 4.44Å; T570-K736 VanDerWaalsContact CG2-CE 3.49Å
571	C	79.9	Confident	75.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.014	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	151.8	176.1	-59.3	0	0	0	0	109.9	D561 H562 Q575 C577 C587	D561-C571 CarbonylContact C-O 3.49Å; D561-C571 WeakPolarHBondContact CA-O 3.33Å; D561-C571 WeakPolarHBondContact CB-O 3.28Å; H562-C571 PolarHBondContact N-O 3.44Å; H562-C571 PolarHBondContact ND1-O 2.98Å; H562-C571 PolarHBondContact O-N 3.21Å; C571-Q575 HydrophobicContact CB-CB 4.11Å; C571-C577 VanDerWaalsContact SG-SG 3.7Å; C571-C587 WeakPolarHBondContact CA-SG 3.33Å; C571-C587 HydrophobicContact CB-CB 3.75Å; C571-C587 WeakPolarHBondContact CB-SG 3.21Å; C571-C587 WeakPolarHBondContact SG-CA 3.44Å; C571-C587 WeakPolarHBondContact SG-CB 3.38Å; C571-C587 CovalentContact SG-SG 2.03Å; C571-C587 PolarHBondContact SG-SG 3.49Å
572	S	78.3	Confident	76.7	Confident	22 Å²	22	56 Å²	56	15%	0.154	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	155.5	-176.9	-57.6	0	0	0	0	113.9	R560 D561 H562 D574 Q575	R560-S572 CarbonylContact O-C 3.44Å; D561-S572 WeakPolarHBondContact OD1-CA 3.38Å; D561-S572 WeakPolarHBondContact OD1-CB 3.26Å; D561-S572 PolarHBondContact OD1-N 2.84Å; D561-S572 PolarHBondContact OD1-OG 3.08Å; H562-S572 PolarHBondContact CE1-O 3.38Å; H562-S572 PolarHBondContact ND1-O 2.95Å; S572-D574 PolarHBondContact O-N 3.47Å; S572-Q575 WeakPolarHBondContact O-CB 2.97Å; S572-Q575 PolarHBondContact O-N 2.78Å
573	D	68.1	Low	76.8	Confident	89 Å²	89	60.5 Å²	60.5	48%	0.476	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-22.7	-175.5	-104.8	18.5	0	0	0	114.1	R560	R560-D573 HydrophobicContact CB-CB 4.09Å; R560-D573 WeakPolarHBondContact CB-OD1 3.39Å; R560-D573 VanDerWaalsContact CB-OD2 3.23Å; R560-D573 WeakPolarHBondContact CB-OD2 3.31Å; R560-D573 WeakPolarHBondContact CD-OD2 3.09Å; R560-D573 WeakPolarHBondContact O-CB 3.25Å; R560-D573 PolarHBondContact O-N 2.87Å
574	D	71.5	Confident	76.9	Confident	66 Å²	66	59.3 Å²	59.3	35%	0.353	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-8.5	177.2	77.7	-37	0	0	0	114.4	S572 K591 N592	S572-D574 PolarHBondContact O-N 3.47Å; D574-K591 HydrophobicContact CB-CD 4.12Å; D574-K591 HydrophobicContact CB-CG 4.11Å; D574-K591 CarbonylContact O-C 3.54Å; D574-K591 VanDerWaalsContact O-CA 3.22Å; D574-K591 WeakPolarHBondContact O-CA 2.99Å; D574-N592 PolarHBondContact O-N 2.93Å
575	Q	83.3	Confident	77	Confident	56 Å²	56	61.6 Å²	61.6	26%	0.262	32%	0.324	S	S	.	.	S	Bend	trans	-83.6	-174.1	174.7	-64.4	176.9	-2.1	0	0	110.5	H562 C571 S572 C587 C588	H562-Q575 PolarHBondContact CE1-O 3.18Å; C571-Q575 HydrophobicContact CB-CB 4.11Å; S572-Q575 WeakPolarHBondContact O-CB 2.97Å; S572-Q575 PolarHBondContact O-N 2.78Å; Q575-C587 VanDerWaalsContact OE1-CB 3.28Å; Q575-C588 WeakPolarHBondContact CB-O 3.41Å
576	T	84.9	Confident	77.4	Confident	41 Å²	41	57.1 Å²	57.1	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	127.1	173.2	-59.1	0	0	0	0	110.2	C578 C588 G593	T576-C578 PolarHBondContact O-N 2.81Å; T576-C588 WeakPolarHBondContact O-CB 3.33Å; T576-C588 PolarHBondContact O-N 2.99Å; T576-G593 VanDerWaalsContact CB-O 3.26Å; T576-G593 WeakPolarHBondContact CB-O 3.2Å; T576-G593 WeakPolarHBondContact CG2-O 3.02Å; T576-G593 PolarHBondContact OG1-O 3.31Å
577	C	88.5	Confident	78.5	Confident	16 Å²	16	55.9 Å²	55.9	11%	0.108	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	116.5	173	-69.5	0	0	0	0	110.8	H562 C564 C571 W585	H562-C577 PolarHBondContact CD2-SG 3.25Å; H562-C577 PolarHBondContact NE2-SG 3.31Å; C564-C577 WeakPolarHBondContact CA-SG 3.4Å; C564-C577 HydrophobicContact CB-CB 3.67Å; C564-C577 WeakPolarHBondContact CB-SG 3.37Å; C564-C577 WeakPolarHBondContact SG-CB 3.24Å; C564-C577 CovalentContact SG-SG 2.04Å; C564-C577 PolarHBondContact SG-SG 2.75Å; C571-C577 VanDerWaalsContact SG-SG 3.7Å; C577-W585 HydrophobicContact CB-CE3 3.75Å; C577-W585 HydrophobicContact CB-CZ3 4.05Å; C577-W585 WeakPolarHBondContact O-CZ3 3.5Å
578	C	88.6	Confident	79.5	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.7	176.1	-61.9	0	0	0	0	110.5	T576 W585 G586 C595 L730	T576-C578 PolarHBondContact O-N 2.81Å; C578-W585 VanDerWaalsContact C-CE3 3.4Å; C578-W585 WeakPolarHBondContact O-CA 3.04Å; C578-G586 PolarHBondContact N-O 3.38Å; C578-G586 PolarHBondContact O-N 2.72Å; C578-C595 WeakPolarHBondContact CA-SG 3.02Å; C578-C595 HydrophobicContact CB-CB 3.69Å; C578-C595 WeakPolarHBondContact CB-SG 3.37Å; C578-C595 VanDerWaalsContact SG-CA 3.52Å; C578-C595 WeakPolarHBondContact SG-CB 3.47Å; C578-C595 CovalentContact SG-SG 2.03Å; C578-C595 PolarHBondContact SG-SG 3.47Å; C578-L730 HydrophobicContact CB-CD1 3.52Å; C578-L730 HydrophobicContact CB-CD2 3.53Å; C578-L730 HydrophobicContact CB-CG 4.18Å
579	R	86.8	Confident	80.2	Confident	123 Å²	123	45 Å²	45	46%	0.464	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.5	179.8	-167.3	-172.6	-163.8	-176.7	7.8	110.3	W585 H599	R579-W585 HydrophobicContact CB-CE3 4.44Å; R579-W585 HydrophobicContact CB-CH2 4.33Å; R579-W585 HydrophobicContact CB-CZ3 4.2Å; R579-H599 WeakPolarHBondContact O-CB 3.34Å; R579-H599 PolarHBondContact O-ND1 3.34Å
580	L	80.9	Confident	80.8	Confident	24 Å²	24	47 Å²	47	13%	0.126	25%	0.245	C	C	.	.			trans	-86.2	165.2	174.9	-75.8	166.6	0	0	0	111.4	D582 K583 S584 L730	L580-D582 VanDerWaalsContact C-N 3.28Å; L580-D582 WeakPolarHBondContact CB-OD1 2.99Å; L580-D582 PolarHBondContact O-N 3.39Å; L580-K583 WeakPolarHBondContact O-CA 3.45Å; L580-K583 PolarHBondContact O-N 3Å; L580-S584 WeakPolarHBondContact CD1-OG 3.24Å; L580-S584 PolarHBondContact N-O 2.95Å; L580-L730 HydrophobicContact CD2-CB 4.07Å; L580-L730 HydrophobicContact CD2-CD1 3.95Å; L580-L730 HydrophobicContact CG-CD1 4.5Å
581	P	79.6	Confident	80.7	Confident	71 Å²	71	53.1 Å²	53.1	46%	0.461	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.3	-173.4	-17.8	31.1	0	0	0	113.8	K583 H599 F600	P581-K583 PolarHBondContact O-N 3.34Å; P581-H599 HydrophobicContact CB-CB 4.44Å; P581-H599 WeakPolarHBondContact CD-O 3.49Å; P581-H599 HydrophobicContact CG-CB 3.93Å; P581-F600 HydrophobicContact CB-CZ 4.4Å; P581-F600 HydrophobicContact CG-CD1 4.16Å; P581-F600 HydrophobicContact CG-CD2 4.28Å; P581-F600 HydrophobicContact CG-CE1 3.71Å; P581-F600 HydrophobicContact CG-CE2 3.82Å; P581-F600 HydrophobicContact CG-CG 4.44Å; P581-F600 HydrophobicContact CG-CZ 3.53Å
582	D	78.9	Confident	80.6	Confident	110 Å²	110	57.5 Å²	57.5	59%	0.588	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	0.5	172.3	65.7	-11.9	0	0	0	113.4	L580 S584	L580-D582 VanDerWaalsContact C-N 3.28Å; L580-D582 WeakPolarHBondContact CB-OD1 2.99Å; L580-D582 PolarHBondContact O-N 3.39Å; D582-S584 VanDerWaalsContact C-N 3.25Å; D582-S584 PolarHBondContact O-N 2.91Å; D582-S584 WeakPolarHBondContact OD1-CB 3.44Å; D582-S584 PolarHBondContact OD1-N 3.06Å; D582-S584 PolarHBondContact OD1-OG 2.8Å; D582-S584 WeakPolarHBondContact OD2-CB 3.42Å; D582-S584 PolarHBondContact OD2-OG 3.4Å
583	K	74.2	Confident	80.8	Confident	153 Å²	153	56.6 Å²	56.6	67%	0.665	29%	0.287	S	S	*	.	S	Bend	trans	72.3	5.2	-172.5	-47.9	166.4	-174.4	169.7	0	114.7	L580 P581	L580-K583 WeakPolarHBondContact O-CA 3.45Å; L580-K583 PolarHBondContact O-N 3Å; P581-K583 PolarHBondContact O-N 3.34Å
584	S	79.8	Confident	81.7	Confident	39 Å²	39	55.4 Å²	55.4	27%	0.273	28%	0.282	S	S	.	.			trans	-76.4	-170.9	169.7	81.6	0	0	0	0	110.9	L580 D582	L580-S584 WeakPolarHBondContact CD1-OG 3.24Å; L580-S584 PolarHBondContact N-O 2.95Å; D582-S584 VanDerWaalsContact C-N 3.25Å; D582-S584 PolarHBondContact O-N 2.91Å; D582-S584 WeakPolarHBondContact OD1-CB 3.44Å; D582-S584 PolarHBondContact OD1-N 3.06Å; D582-S584 PolarHBondContact OD1-OG 2.8Å; D582-S584 WeakPolarHBondContact OD2-CB 3.42Å; D582-S584 PolarHBondContact OD2-OG 3.4Å
585	W	84.1	Confident	82.5	Confident	50 Å²	50	54.6 Å²	54.6	19%	0.189	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.6	-179.2	-68.1	92.5	0	0	0	111.4	C564 P565 C577 C578 R579 S733	C564-W585 HydrophobicContact CB-CB 3.88Å; C564-W585 HydrophobicContact CB-CD2 3.79Å; C564-W585 HydrophobicContact CB-CE3 4.18Å; C564-W585 HydrophobicContact CB-CG 3.62Å; P565-W585 HydrophobicContact CB-CH2 4.07Å; P565-W585 HydrophobicContact CB-CZ2 3.68Å; P565-W585 HydrophobicContact CG-CH2 3.84Å; P565-W585 HydrophobicContact CG-CZ2 3.94Å; P565-W585 HydrophobicContact CG-CZ3 4.47Å; P565-W585 VanDerWaalsContact O-CE2 3.24Å; P565-W585 VanDerWaalsContact O-CZ2 3.23Å; P565-W585 WeakPolarHBondContact O-CZ2 3.47Å; P565-W585 PolarHBondContact O-NE1 2.86Å; C577-W585 HydrophobicContact CB-CE3 3.75Å; C577-W585 HydrophobicContact CB-CZ3 4.05Å; C577-W585 WeakPolarHBondContact O-CZ3 3.5Å; C578-W585 VanDerWaalsContact C-CE3 3.4Å; C578-W585 WeakPolarHBondContact O-CA 3.04Å; R579-W585 HydrophobicContact CB-CE3 4.44Å; R579-W585 HydrophobicContact CB-CH2 4.33Å; R579-W585 HydrophobicContact CB-CZ3 4.2Å; W585-S733 VanDerWaalsContact O-CB 3.3Å; W585-S733 WeakPolarHBondContact O-CB 3.31Å; W585-S733 PolarHBondContact O-N 3.06Å; W585-S733 VanDerWaalsContact O-N 3.17Å; W585-S733 PolarHBondContact O-OG 2.73Å
586	G	81.4	Confident	82.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	156.2	166	0	0	0	0	0	110.9	C578 I731	C578-G586 PolarHBondContact N-O 3.38Å; C578-G586 PolarHBondContact O-N 2.72Å; G586-I731 CarbonylContact C-O 3.57Å; G586-I731 WeakPolarHBondContact CA-O 3.26Å
587	C	86.6	Confident	82.5	Confident	11 Å²	11	53.3 Å²	53.3	7%	0.074	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	129.8	172.1	-52.8	0	0	0	0	109.7	T570 C571 Q575 P589 I731	T570-C587 PolarHBondContact O-SG 3.37Å; T570-C587 VanDerWaalsContact O-SG 3.36Å; C571-C587 WeakPolarHBondContact CA-SG 3.33Å; C571-C587 HydrophobicContact CB-CB 3.75Å; C571-C587 WeakPolarHBondContact CB-SG 3.21Å; C571-C587 WeakPolarHBondContact SG-CA 3.44Å; C571-C587 WeakPolarHBondContact SG-CB 3.38Å; C571-C587 CovalentContact SG-SG 2.03Å; C571-C587 PolarHBondContact SG-SG 3.49Å; Q575-C587 VanDerWaalsContact OE1-CB 3.28Å; C587-P589 WeakPolarHBondContact O-CD 3.41Å; C587-I731 PolarHBondContact N-O 3.15Å; C587-I731 PolarHBondContact O-N 3.47Å; C587-I731 VanDerWaalsContact O-N 3.11Å
588	C	84.6	Confident	82.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	123.1	167	-179.6	0	0	0	0	110	Q575 T576 L590 C602 L730	Q575-C588 WeakPolarHBondContact CB-O 3.41Å; T576-C588 WeakPolarHBondContact O-CB 3.33Å; T576-C588 PolarHBondContact O-N 2.99Å; C588-L590 PolarHBondContact O-N 3.37Å; C588-C602 WeakPolarHBondContact CA-SG 3.27Å; C588-C602 HydrophobicContact CB-CB 3.67Å; C588-C602 WeakPolarHBondContact CB-SG 3.41Å; C588-C602 WeakPolarHBondContact SG-CB 3.37Å; C588-C602 CovalentContact SG-SG 2.03Å; C588-C602 PolarHBondContact SG-SG 2.62Å; C588-L730 HydrophobicContact CB-CD2 4.25Å
589	P	80.3	Confident	81.9	Confident	49 Å²	49	58 Å²	58	32%	0.318	31%	0.311	S	S	.	.	S	Bend	trans	-80.4	13.5	179	34.3	-37.6	0	0	0	113.8	C587 P728 I731	C587-P589 WeakPolarHBondContact O-CD 3.41Å; P589-P728 HydrophobicContact CG-CB 4.28Å; P589-I731 HydrophobicContact CB-CD1 3.83Å; P589-I731 HydrophobicContact CB-CG1 4.42Å; P589-I731 HydrophobicContact CG-CD1 4.22Å; P589-I731 HydrophobicContact CG-CG1 4.33Å
590	L	78.5	Confident	81.5	Confident	47 Å²	47	57.5 Å²	57.5	25%	0.246	31%	0.313	C	S	.	.	S	Bend	trans	-107	136.6	173.7	-60.6	178.8	0	0	0	109.3	C588 N592 G593 P604 P728	C588-L590 PolarHBondContact O-N 3.37Å; L590-N592 PolarHBondContact O-N 3.17Å; L590-N592 VanDerWaalsContact O-N 3.17Å; L590-G593 PolarHBondContact O-N 2.8Å; L590-P604 HydrophobicContact CD1-CB 4.11Å; L590-P604 HydrophobicContact CD1-CG 4.46Å; L590-P728 HydrophobicContact CD1-CG 3.54Å; L590-P728 HydrophobicContact CD2-CG 4.05Å; L590-P728 HydrophobicContact CG-CG 3.65Å
591	K	77	Confident	81.5	Confident	146 Å²	146	58.1 Å²	58.1	64%	0.635	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	118.7	177.3	-177.3	152.5	-174.8	166.5	0	110.9	D574 G593	D574-K591 HydrophobicContact CB-CD 4.12Å; D574-K591 HydrophobicContact CB-CG 4.11Å; D574-K591 CarbonylContact O-C 3.54Å; D574-K591 VanDerWaalsContact O-CA 3.22Å; D574-K591 WeakPolarHBondContact O-CA 2.99Å; K591-G593 VanDerWaalsContact C-N 3.26Å; K591-G593 PolarHBondContact O-N 2.86Å
592	N	77.2	Confident	81.7	Confident	94 Å²	94	54.8 Å²	54.8	50%	0.503	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	36.8	-174.9	-55.4	-19.6	0	0	0	113.8	D574 L590 A605	D574-N592 PolarHBondContact O-N 2.93Å; L590-N592 PolarHBondContact O-N 3.17Å; L590-N592 VanDerWaalsContact O-N 3.17Å; N592-A605 HydrophobicContact CB-CB 4.16Å; N592-A605 WeakPolarHBondContact O-CB 2.96Å
593	G	82.9	Confident	81.9	Confident	2 Å²	2	49.5 Å²	49.5	2%	0.021	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-70	141.1	-173.8	0	0	0	0	0	115.1	T576 L590 K591 C603	T576-G593 VanDerWaalsContact CB-O 3.26Å; T576-G593 WeakPolarHBondContact CB-O 3.2Å; T576-G593 WeakPolarHBondContact CG2-O 3.02Å; T576-G593 PolarHBondContact OG1-O 3.31Å; L590-G593 PolarHBondContact O-N 2.8Å; K591-G593 VanDerWaalsContact C-N 3.26Å; K591-G593 PolarHBondContact O-N 2.86Å; G593-C603 CarbonylContact C-O 3.58Å; G593-C603 WeakPolarHBondContact CA-O 3.17Å
594	V	85.7	Confident	82.2	Confident	64 Å²	64	44.3 Å²	44.3	39%	0.388	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124	178	-178.3	0	0	0	0	109.9	C602 C603	V594-C602 CarbonylContact O-C 3.54Å; V594-C602 WeakPolarHBondContact O-CA 3.43Å; V594-C602 VanDerWaalsContact O-CB 3.3Å; V594-C602 WeakPolarHBondContact O-CB 3.48Å; V594-C603 PolarHBondContact N-O 2.93Å; V594-C603 PolarHBondContact O-N 2.76Å
595	C	88.6	Confident	81.8	Confident	50 Å²	50	45.1 Å²	45.1	34%	0.338	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	133.8	175.1	-50.6	0	0	0	0	111.3	C578	C578-C595 WeakPolarHBondContact CA-SG 3.02Å; C578-C595 HydrophobicContact CB-CB 3.69Å; C578-C595 WeakPolarHBondContact CB-SG 3.37Å; C578-C595 VanDerWaalsContact SG-CA 3.52Å; C578-C595 WeakPolarHBondContact SG-CB 3.47Å; C578-C595 CovalentContact SG-SG 2.03Å; C578-C595 PolarHBondContact SG-SG 3.47Å
596	C	86.7	Confident	81	Confident	10 Å²	10	46 Å²	46	7%	0.068	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-84.6	151.3	176.2	-60.7	0	0	0	0	112	D598 H599 H601 C603 C609 L611	C596-D598 PolarHBondContact O-N 3.23Å; C596-D598 VanDerWaalsContact O-N 3.14Å; C596-H599 PolarHBondContact O-N 2.86Å; C596-H601 HydrophobicContact CB-CB 4.23Å; C596-H601 WeakPolarHBondContact CB-O 3.46Å; C596-H601 PolarHBondContact N-O 2.96Å; C596-C603 VanDerWaalsContact SG-SG 3.67Å; C596-C609 WeakPolarHBondContact CA-SG 3.45Å; C596-C609 HydrophobicContact CB-CB 3.69Å; C596-C609 WeakPolarHBondContact CB-SG 3.33Å; C596-C609 WeakPolarHBondContact SG-CB 3.28Å; C596-C609 CovalentContact SG-SG 2.05Å; C596-C609 PolarHBondContact SG-SG 3.4Å; C596-L611 HydrophobicContact CB-CD2 3.98Å
597	G	82.3	Confident	80.8	Confident	59 Å²	59	46.4 Å²	46.4	61%	0.608	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-7	-179.8	0	0	0	0	0	115.1	H599	G597-H599 VanDerWaalsContact C-N 3.31Å
598	D	80.7	Confident	80.4	Confident	42 Å²	42	50 Å²	50	23%	0.225	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.5	174.7	66.1	11.1	0	0	0	114.1	C596 F600 H601 L611	C596-D598 PolarHBondContact O-N 3.23Å; C596-D598 VanDerWaalsContact O-N 3.14Å; D598-F600 WeakPolarHBondContact O-CD2 3.31Å; D598-F600 PolarHBondContact O-N 2.9Å; D598-F600 VanDerWaalsContact O-N 3.1Å; D598-F600 PolarHBondContact OD1-N 3.24Å; D598-H601 PolarHBondContact OD1-N 2.62Å; D598-H601 IonicContact OD1-ND1 2.72Å; D598-H601 IonicContact OD2-CE1 2.63Å; D598-H601 IonicContact OD2-CG 2.71Å; D598-H601 IonicContact OD2-ND1 2.86Å; D598-H601 PolarHBondContact OD2-ND1 3.49Å; D598-L611 HydrophobicContact CB-CD2 4.2Å
599	H	82.6	Confident	80.2	Confident	73 Å²	73	51.4 Å²	51.4	34%	0.338	31%	0.314	S	S	.	.	S	Bend	trans	60.8	8.8	-175.5	-63	-66.2	0	0	0	115.7	R579 P581 C596 G597	R579-H599 WeakPolarHBondContact O-CB 3.34Å; R579-H599 PolarHBondContact O-ND1 3.34Å; P581-H599 HydrophobicContact CB-CB 4.44Å; P581-H599 WeakPolarHBondContact CD-O 3.49Å; P581-H599 HydrophobicContact CG-CB 3.93Å; C596-H599 PolarHBondContact O-N 2.86Å; G597-H599 VanDerWaalsContact C-N 3.31Å
600	F	78.3	Confident	80	Confident	114 Å²	114	50.4 Å²	50.4	50%	0.5	31%	0.306	S	S	.	.	S	Bend	trans	-111.9	-29.3	178.9	-73.7	-74.4	0	0	0	113.3	P581 D598 T729 L730	P581-F600 HydrophobicContact CB-CZ 4.4Å; P581-F600 HydrophobicContact CG-CD1 4.16Å; P581-F600 HydrophobicContact CG-CD2 4.28Å; P581-F600 HydrophobicContact CG-CE1 3.71Å; P581-F600 HydrophobicContact CG-CE2 3.82Å; P581-F600 HydrophobicContact CG-CG 4.44Å; P581-F600 HydrophobicContact CG-CZ 3.53Å; D598-F600 WeakPolarHBondContact O-CD2 3.31Å; D598-F600 PolarHBondContact O-N 2.9Å; D598-F600 VanDerWaalsContact O-N 3.1Å; D598-F600 PolarHBondContact OD1-N 3.24Å; F600-T729 CarbonylContact O-C 3.4Å; F600-T729 WeakPolarHBondContact O-CA 3.45Å; F600-T729 WeakPolarHBondContact O-CG2 3.44Å; F600-L730 PolarHBondContact O-N 2.74Å
601	H	80.5	Confident	79.9	Confident	37 Å²	37	51.9 Å²	51.9	17%	0.171	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-120.4	162.7	-172.6	-58.3	100.1	0	0	0	113.6	C596 D598 A727 P728	C596-H601 HydrophobicContact CB-CB 4.23Å; C596-H601 WeakPolarHBondContact CB-O 3.46Å; C596-H601 PolarHBondContact N-O 2.96Å; D598-H601 PolarHBondContact OD1-N 2.62Å; D598-H601 IonicContact OD1-ND1 2.72Å; D598-H601 IonicContact OD2-CE1 2.63Å; D598-H601 IonicContact OD2-CG 2.71Å; D598-H601 IonicContact OD2-ND1 2.86Å; D598-H601 PolarHBondContact OD2-ND1 3.49Å; H601-A727 HydrophobicContact CB-CB 3.76Å; H601-A727 PolarHBondContact CD2-O 3.47Å; H601-P728 WeakPolarHBondContact CA-O 3.25Å
602	C	85.2	Confident	79.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.3	160.7	66.2	0	0	0	0	111.2	C588 V594 P728 L730	C588-C602 WeakPolarHBondContact CA-SG 3.27Å; C588-C602 HydrophobicContact CB-CB 3.67Å; C588-C602 WeakPolarHBondContact CB-SG 3.41Å; C588-C602 WeakPolarHBondContact SG-CB 3.37Å; C588-C602 CovalentContact SG-SG 2.03Å; C588-C602 PolarHBondContact SG-SG 2.62Å; V594-C602 CarbonylContact O-C 3.54Å; V594-C602 WeakPolarHBondContact O-CA 3.43Å; V594-C602 VanDerWaalsContact O-CB 3.3Å; V594-C602 WeakPolarHBondContact O-CB 3.48Å; C602-P728 PolarHBondContact N-O 2.95Å; C602-P728 WeakPolarHBondContact O-CD 3.47Å; C602-L730 HydrophobicContact CB-CD2 3.81Å
603	C	83.5	Confident	78.9	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	155	-176.4	-82	0	0	0	0	111.9	G593 V594 C596 S607 C616	G593-C603 CarbonylContact C-O 3.58Å; G593-C603 WeakPolarHBondContact CA-O 3.17Å; V594-C603 PolarHBondContact N-O 2.93Å; V594-C603 PolarHBondContact O-N 2.76Å; C596-C603 VanDerWaalsContact SG-SG 3.67Å; C603-S607 WeakPolarHBondContact CB-OG 3.37Å; C603-C616 WeakPolarHBondContact CA-SG 3.41Å; C603-C616 HydrophobicContact CB-CB 3.63Å; C603-C616 WeakPolarHBondContact CB-SG 3.35Å; C603-C616 WeakPolarHBondContact SG-CA 3.05Å; C603-C616 WeakPolarHBondContact SG-CB 3.41Å; C603-C616 CovalentContact SG-SG 2.03Å; C603-C616 PolarHBondContact SG-SG 3.48Å
604	P	79.1	Confident	78.2	Confident	43 Å²	43	57.3 Å²	57.3	28%	0.279	35%	0.345	S	S	.	.			trans	-64.5	151.4	-179	24.4	-31.6	0	0	0	111.9	L590 G606 S607 C616	L590-P604 HydrophobicContact CD1-CB 4.11Å; L590-P604 HydrophobicContact CD1-CG 4.46Å; P604-G606 PolarHBondContact O-N 2.65Å; P604-S607 VanDerWaalsContact CD-OG 3.24Å; P604-S607 WeakPolarHBondContact CD-OG 3.39Å; P604-S607 WeakPolarHBondContact CG-OG 3.47Å; P604-S607 PolarHBondContact O-N 2.03Å; P604-S607 PolarHBondContact O-OG 2.82Å; P604-C616 VanDerWaalsContact CD-SG 3.57Å
605	A	72.1	Confident	77.5	Confident	56 Å²	56	56.1 Å²	56.1	46%	0.463	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	126.7	178.8	0	0	0	0	0	111.8	N592	N592-A605 HydrophobicContact CB-CB 4.16Å; N592-A605 WeakPolarHBondContact O-CB 2.96Å
606	G	68.2	Low	76.7	Confident	70 Å²	70	53.7 Å²	53.7	72%	0.722	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	3.9	-179.3	0	0	0	0	0	115.9	P604	P604-G606 PolarHBondContact O-N 2.65Å
607	S	76.4	Confident	75.9	Confident	7 Å²	7	55.1 Å²	55.1	5%	0.049	33%	0.326	C	S	.	.			trans	-107.6	155.5	170.8	64.8	0	0	0	0	112.6	C603 P604 I617	C603-S607 WeakPolarHBondContact CB-OG 3.37Å; P604-S607 VanDerWaalsContact CD-OG 3.24Å; P604-S607 WeakPolarHBondContact CD-OG 3.39Å; P604-S607 WeakPolarHBondContact CG-OG 3.47Å; P604-S607 PolarHBondContact O-N 2.03Å; P604-S607 PolarHBondContact O-OG 2.82Å; S607-I617 CarbonylContact C-O 3.42Å; S607-I617 WeakPolarHBondContact CA-O 3.3Å; S607-I617 WeakPolarHBondContact CB-O 2.85Å
608	V	77.8	Confident	74.9	Confident	88 Å²	88	55.1 Å²	55.1	53%	0.533	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	137.8	178.9	-178.6	0	0	0	0	109.7	D610 C616 I617	V608-D610 PolarHBondContact O-N 3.29Å; V608-C616 CarbonylContact O-C 3.6Å; V608-C616 WeakPolarHBondContact O-CA 3.07Å; V608-I617 PolarHBondContact N-O 2.95Å; V608-I617 PolarHBondContact O-N 2.87Å
609	C	79.4	Confident	73.5	Confident	29 Å²	29	59.8 Å²	59.8	20%	0.196	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	111.7	173.5	-56.9	0	0	0	0	110.8	C596 L611	C596-C609 WeakPolarHBondContact CA-SG 3.45Å; C596-C609 HydrophobicContact CB-CB 3.69Å; C596-C609 WeakPolarHBondContact CB-SG 3.33Å; C596-C609 WeakPolarHBondContact SG-CB 3.28Å; C596-C609 CovalentContact SG-SG 2.05Å; C596-C609 PolarHBondContact SG-SG 3.4Å; C609-L611 HydrophobicContact CB-CD2 3.93Å; C609-L611 PolarHBondContact O-N 2.91Å
610	D	78	Confident	71.8	Confident	28 Å²	28	60 Å²	60	15%	0.15	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	99.6	163.9	167.6	-8.4	0	0	0	106.9	V608 D612 T613 K614 Q615 I617 K724	V608-D610 PolarHBondContact O-N 3.29Å; D610-D612 VanDerWaalsContact C-N 3.34Å; D610-D612 PolarHBondContact OD1-N 2.85Å; D610-T613 PolarHBondContact OD1-N 2.89Å; D610-T613 PolarHBondContact OD1-OG1 2.84Å; D610-T613 WeakPolarHBondContact OD2-CG2 3.12Å; D610-T613 PolarHBondContact OD2-OG1 2.83Å; D610-K614 VanDerWaalsContact O-CA 3.28Å; D610-K614 WeakPolarHBondContact O-CA 3.26Å; D610-K614 PolarHBondContact O-N 3.36Å; D610-Q615 WeakPolarHBondContact CB-O 3.42Å; D610-Q615 PolarHBondContact N-O 2.84Å; D610-Q615 PolarHBondContact O-N 2.75Å; D610-I617 HydrophobicContact CB-CD1 3.66Å; D610-I617 HydrophobicContact CB-CG1 3.79Å; D610-K724 IonicContact OD2-NZ 3.77Å; D610-K724 PolarHBondContact OD2-NZ 3.46Å
611	L	75.3	Confident	69.9	Low	77 Å²	77	60.4 Å²	60.4	40%	0.403	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-30.1	-174.6	-57.6	-176.9	0	0	0	112	C596 D598 C609	C596-L611 HydrophobicContact CB-CD2 3.98Å; D598-L611 HydrophobicContact CB-CD2 4.2Å; C609-L611 HydrophobicContact CB-CD2 3.93Å; C609-L611 PolarHBondContact O-N 2.91Å
612	D	70.4	Confident	67.9	Low	161 Å²	161	63.5 Å²	63.5	86%	0.861	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-44.5	-178.9	-58.4	-45.2	0	0	0	111.1	D610	D610-D612 VanDerWaalsContact C-N 3.34Å; D610-D612 PolarHBondContact OD1-N 2.85Å
613	T	64.2	Low	65.5	Low	60 Å²	60	69 Å²	69	37%	0.368	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-3.6	176.3	78.6	0	0	0	0	114.2	D610 Q615 K724	D610-T613 PolarHBondContact OD1-N 2.89Å; D610-T613 PolarHBondContact OD1-OG1 2.84Å; D610-T613 WeakPolarHBondContact OD2-CG2 3.12Å; D610-T613 PolarHBondContact OD2-OG1 2.83Å; T613-Q615 VanDerWaalsContact C-N 3.29Å; T613-Q615 WeakPolarHBondContact O-CG 3.49Å; T613-Q615 PolarHBondContact O-N 2.88Å; T613-Q615 WeakPolarHBondContact OG1-CB 3.4Å; T613-Q615 PolarHBondContact OG1-OE1 3.08Å; T613-K724 PolarHBondContact OG1-NZ 3.04Å; T613-K724 VanDerWaalsContact OG1-NZ 3.17Å
614	K	67.5	Low	63.2	Low	135 Å²	135	77 Å²	77	59%	0.587	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	40	-177.1	-58.3	175	-176.1	171.3	0	112.9	D610	D610-K614 VanDerWaalsContact O-CA 3.28Å; D610-K614 WeakPolarHBondContact O-CA 3.26Å; D610-K614 PolarHBondContact O-N 3.36Å
615	Q	70.9	Confident	61.2	Low	39 Å²	39	79.4 Å²	79.4	18%	0.182	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.4	-175.8	-69.4	169.6	13.5	0	0	111.4	D610 T613 K724	D610-Q615 WeakPolarHBondContact CB-O 3.42Å; D610-Q615 PolarHBondContact N-O 2.84Å; D610-Q615 PolarHBondContact O-N 2.75Å; T613-Q615 VanDerWaalsContact C-N 3.29Å; T613-Q615 WeakPolarHBondContact O-CG 3.49Å; T613-Q615 PolarHBondContact O-N 2.88Å; T613-Q615 WeakPolarHBondContact OG1-CB 3.4Å; T613-Q615 PolarHBondContact OG1-OE1 3.08Å; Q615-K724 VanDerWaalsContact OE1-CG 3.3Å
616	C	72.6	Confident	59.4	Low	0 Å²	0	82.9 Å²	82.9	0%	0	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	117.4	166.3	-47.1	0	0	0	0	108.2	C603 P604 V608 K724 S725 A727	C603-C616 WeakPolarHBondContact CA-SG 3.41Å; C603-C616 HydrophobicContact CB-CB 3.63Å; C603-C616 WeakPolarHBondContact CB-SG 3.35Å; C603-C616 WeakPolarHBondContact SG-CA 3.05Å; C603-C616 WeakPolarHBondContact SG-CB 3.41Å; C603-C616 CovalentContact SG-SG 2.03Å; C603-C616 PolarHBondContact SG-SG 3.48Å; P604-C616 VanDerWaalsContact CD-SG 3.57Å; V608-C616 CarbonylContact O-C 3.6Å; V608-C616 WeakPolarHBondContact O-CA 3.07Å; C616-K724 WeakPolarHBondContact O-CA 3.16Å; C616-S725 PolarHBondContact N-O 3.29Å; C616-S725 PolarHBondContact O-N 3.4Å; C616-A727 VanDerWaalsContact SG-CA 3.55Å; C616-A727 VanDerWaalsContact SG-CB 3.54Å
617	I	69.1	Low	58	Low	40 Å²	40	84.5 Å²	84.5	21%	0.205	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	106.9	172.1	-62.7	-175.4	0	0	0	107.9	S607 V608 D610 Q619 I722 K724	S607-I617 CarbonylContact C-O 3.42Å; S607-I617 WeakPolarHBondContact CA-O 3.3Å; S607-I617 WeakPolarHBondContact CB-O 2.85Å; V608-I617 PolarHBondContact N-O 2.95Å; V608-I617 PolarHBondContact O-N 2.87Å; D610-I617 HydrophobicContact CB-CD1 3.66Å; D610-I617 HydrophobicContact CB-CG1 3.79Å; I617-Q619 HydrophobicContact CG2-CG 4.04Å; I617-I722 HydrophobicContact CG2-CG2 4.1Å; I617-K724 HydrophobicContact CG1-CG 4.29Å
618	L	60.5	Low	56.9	Low	58 Å²	58	89.9 Å²	89.9	30%	0.304	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	101.7	165	-169.2	76.1	0	0	0	107.6	L620 M723	L618-L620 HydrophobicContact CD2-CD2 4.22Å; L618-L620 PolarHBondContact O-N 2.91Å; L618-L620 VanDerWaalsContact O-N 3.12Å; L618-M723 HydrophobicContact CB-CB 3.93Å; L618-M723 HydrophobicContact CD2-CB 4.2Å; L618-M723 HydrophobicContact CD2-SD 4.28Å; L618-M723 PolarHBondContact N-O 2.03Å; L618-M723 PolarHBondContact O-N 2.92Å
619	Q	52	Low	55.9	Low	141 Å²	141	90.2 Å²	90.2	66%	0.659	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	106.3	173.7	-77.2	-179.5	-60.8	0	0	109.3	I617 E621	I617-Q619 HydrophobicContact CG2-CG 4.04Å; Q619-E621 PolarHBondContact O-N 3.38Å
620	L	46.4	Very low	55.5	Low	76 Å²	76	91.6 Å²	91.6	40%	0.398	48%	0.48	S	S	.	.			trans	-86.8	88.5	171.5	-70.4	172.7	0	0	0	107.7	L618 L622 N721 M723	L618-L620 HydrophobicContact CD2-CD2 4.22Å; L618-L620 PolarHBondContact O-N 2.91Å; L618-L620 VanDerWaalsContact O-N 3.12Å; L620-L622 VanDerWaalsContact C-N 3.28Å; L620-L622 PolarHBondContact O-N 2.93Å; L620-N721 PolarHBondContact N-O 3.05Å; L620-N721 WeakPolarHBondContact O-CB 3.43Å; L620-M723 HydrophobicContact CD1-CB 4.03Å; L620-M723 HydrophobicContact CD1-CG 3.79Å; L620-M723 HydrophobicContact CD1-SD 4.08Å; L620-M723 HydrophobicContact CG-CB 4.49Å
621	E	37.9	Very low	55.5	Low	123 Å²	123	93.6 Å²	93.6	58%	0.575	49%	0.486	S	S	*	.			trans	-60.6	86.5	173.5	-66.3	175.3	145.2	0	0	111	R101 Q619	R101-E621 IonicContact CZ-OE2 2.64Å; R101-E621 PolarHBondContact NH1-O 2.7Å; R101-E621 IonicContact NH1-OE2 2.78Å; R101-E621 IonicContact NH2-OE2 3.53Å; R101-E621 PolarHBondContact NH2-OE2 2.72Å; Q619-E621 PolarHBondContact O-N 3.38Å
622	L	39.6	Very low	55.8	Low	102 Å²	102	95.1 Å²	95.1	53%	0.534	49%	0.494	S	S	.	.			trans	-98.5	93.6	165.9	-136.6	121.9	0	0	0	107.4	L620 Q624 N721	L620-L622 VanDerWaalsContact C-N 3.28Å; L620-L622 PolarHBondContact O-N 2.93Å; L622-Q624 PolarHBondContact O-N 2.8Å; L622-N721 VanDerWaalsContact CB-OD1 3.28Å; L622-N721 WeakPolarHBondContact CB-OD1 3Å; L622-N721 PolarHBondContact O-ND2 2.84Å
623	N	33.9	Very low	56.2	Low	117 Å²	117	87.9 Å²	87.9	63%	0.626	46%	0.458	S	S	*	.			trans	-58.4	133.5	172.1	-89.1	-0.9	0	0	0	109.2	S625	N623-S625 PolarHBondContact O-N 2.04Å
624	Q	36.4	Very low	57.1	Low	167 Å²	167	87.9 Å²	87.9	78%	0.78	45%	0.453	S	S	*	.			trans	-81.3	103.4	-171.6	-64.4	171.4	-0.7	0	0	110.1	L622	L622-Q624 PolarHBondContact O-N 2.8Å
625	S	35.7	Very low	57.8	Low	94 Å²	94	86.1 Å²	86.1	66%	0.657	45%	0.454	S	S	*	.			trans	-86.2	127.9	144.5	-176.1	0	0	0	0	107.4	N623 T627	N623-S625 PolarHBondContact O-N 2.04Å; S625-T627 PolarHBondContact O-N 3.15Å; S625-T627 VanDerWaalsContact O-N 3.11Å
626	T	34.5	Very low	58.1	Low	129 Å²	129	84.7 Å²	84.7	79%	0.791	45%	0.447	S	S	*	.			trans	-83.8	29.2	-173.5	42.4	0	0	0	0	113.5	K628	T626-K628 PolarHBondContact O-N 3.14Å
627	T	40.4	Very low	58.1	Low	104 Å²	104	89.9 Å²	89.9	64%	0.638	47%	0.471	S	S	*	.			trans	-70.6	98.7	159.1	45.9	0	0	0	0	108.6	S625 I629	S625-T627 PolarHBondContact O-N 3.15Å; S625-T627 VanDerWaalsContact O-N 3.11Å; T627-I629 PolarHBondContact O-N 3.13Å
628	K	53.2	Low	58	Low	119 Å²	119	93.4 Å²	93.4	52%	0.517	49%	0.489	S	S	.	.			trans	-53.9	112	166.1	-69.1	-169.4	163.6	-147.5	0	107.8	T626 V630 E716	T626-K628 PolarHBondContact O-N 3.14Å; K628-V630 HydrophobicContact CB-CG2 3.69Å; K628-V630 PolarHBondContact O-N 3.07Å; K628-E716 HydrophobicContact CB-CG 4.23Å; K628-E716 HydrophobicContact CD-CG 4.31Å; K628-E716 WeakPolarHBondContact CD-OE1 3.5Å; K628-E716 WeakPolarHBondContact CE-OE1 3.41Å; K628-E716 HydrophobicContact CG-CG 4.36Å; K628-E716 WeakPolarHBondContact CG-OE1 3.38Å; K628-E716 VanDerWaalsContact NZ-CD 3.29Å; K628-E716 IonicContact NZ-OE1 3.51Å; K628-E716 PolarHBondContact NZ-OE1 3.4Å; K628-E716 IonicContact NZ-OE2 3.42Å; K628-E716 PolarHBondContact NZ-OE2 2.71Å
629	I	55.1	Low	57.8	Low	95 Å²	95	92.1 Å²	92.1	49%	0.487	49%	0.487	S	S	.	.			trans	-74.5	90.8	174.5	-57.4	179.7	0	0	0	106.4	T627 Y631 K717	T627-I629 PolarHBondContact O-N 3.13Å; I629-Y631 HydrophobicContact CG2-CD1 3.93Å; I629-Y631 HydrophobicContact CG2-CE1 3.94Å; I629-K717 HydrophobicContact CB-CB 4.09Å; I629-K717 HydrophobicContact CD1-CD 4.37Å; I629-K717 PolarHBondContact O-N 3.32Å
630	V	72.2	Confident	57.8	Low	59 Å²	59	91.8 Å²	91.8	36%	0.358	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.2	-179.9	-178.7	0	0	0	0	108.7	K628 L710 K714 C715 E716	K628-V630 HydrophobicContact CB-CG2 3.69Å; K628-V630 PolarHBondContact O-N 3.07Å; V630-L710 HydrophobicContact CB-CD1 4.49Å; V630-L710 HydrophobicContact CG1-CD1 3.8Å; V630-L710 HydrophobicContact CG2-CD1 3.81Å; V630-K714 HydrophobicContact CG1-CB 3.47Å; V630-K714 VanDerWaalsContact CG1-CB 3.47Å; V630-K714 HydrophobicContact CG1-CD 3.57Å; V630-K714 HydrophobicContact CG1-CG 4.14Å; V630-C715 WeakPolarHBondContact CA-O 3.31Å; V630-E716 HydrophobicContact CG2-CB 4.48Å
631	Y	78.4	Confident	57.7	Low	69 Å²	69	99.7 Å²	99.7	27%	0.271	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	160.1	170.9	40.5	-89.6	0	0	0	108.7	I629 P704 S707 K714 C715 K717	I629-Y631 HydrophobicContact CG2-CD1 3.93Å; I629-Y631 HydrophobicContact CG2-CE1 3.94Å; Y631-P704 HydrophobicContact CE2-CG 3.61Å; Y631-S707 VanDerWaalsContact OH-CB 3.31Å; Y631-S707 WeakPolarHBondContact OH-CB 3.34Å; Y631-S707 PolarHBondContact OH-OG 2.69Å; Y631-K714 CarbonylContact O-C 3.5Å; Y631-K714 WeakPolarHBondContact O-CA 3.34Å; Y631-K714 WeakPolarHBondContact O-CB 3.34Å; Y631-C715 HydrophobicContact CD2-CB 3.86Å; Y631-C715 HydrophobicContact CE2-CB 3.42Å; Y631-C715 VanDerWaalsContact CE2-CB 3.42Å; Y631-C715 PolarHBondContact N-O 3.39Å; Y631-C715 PolarHBondContact O-N 3.4Å; Y631-K717 HydrophobicContact CE1-CB 4.33Å
632	D	81.8	Confident	57.7	Low	109 Å²	109	102.6 Å²	102.6	58%	0.583	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	136.4	177.4	-59	-55.2	0	0	0	110.2	K714	D632-K714 WeakPolarHBondContact OD1-CE 3.3Å; D632-K714 IonicContact OD1-NZ 3.31Å; D632-K714 PolarHBondContact OD1-NZ 2.04Å; D632-K714 IonicContact OD2-NZ 3.39Å
633	G	77.7	Confident	57.4	Low	10 Å²	10	103.6 Å²	103.6	10%	0.103	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-77.5	156.9	176.5	0	0	0	0	0	111.2	T635 G713 C715	G633-T635 PolarHBondContact O-N 3.34Å; G633-G713 PolarHBondContact N-O 2.68Å; G633-C715 WeakPolarHBondContact CA-SG 3.45Å
634	F	83.3	Confident	57.3	Low	59 Å²	59	103.3 Å²	103.3	26%	0.259	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.1	-179.4	-178.5	-84.3	0	0	0	110.3	M636 H637 W674 P689 Y690 I701 C702	F634-M636 PolarHBondContact O-N 3.28Å; F634-H637 AromaticContact CE1-CD2 3.79Å; F634-H637 AromaticContact CZ-CD2 3.75Å; F634-H637 AromaticContact CZ-NE2 3.81Å; F634-W674 HydrophobicContact CE1-CZ3 4.18Å; F634-W674 HydrophobicContact CZ-CH2 4.32Å; F634-W674 HydrophobicContact CZ-CZ3 4.33Å; F634-P689 HydrophobicContact CD1-CG 3.72Å; F634-P689 HydrophobicContact CD2-CG 3.78Å; F634-P689 HydrophobicContact CE1-CG 3.75Å; F634-P689 HydrophobicContact CE2-CG 3.81Å; F634-P689 HydrophobicContact CG-CG 3.73Å; F634-P689 HydrophobicContact CZ-CG 3.8Å; F634-Y690 HydrophobicContact CB-CD2 4.4Å; F634-Y690 HydrophobicContact CB-CE2 3.61Å; F634-I701 CarbonylContact O-C 3.46Å; F634-I701 WeakPolarHBondContact O-CA 3.41Å; F634-C702 PolarHBondContact N-O 3.35Å; F634-C702 PolarHBondContact O-N 2.73Å
635	T	83	Confident	57.1	Low	98 Å²	98	103 Å²	103	60%	0.601	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.3	113.6	173.6	-52	0	0	0	0	110.2	G633	G633-T635 PolarHBondContact O-N 3.34Å
636	M	75.6	Confident	56.8	Low	10 Å²	10	110 Å²	110	5%	0.049	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-71.2	136.2	-172.7	-53.1	-171.6	-66.8	0	0	110.9	F634 C677 S686 C687 C688 N700 C702	F634-M636 PolarHBondContact O-N 3.28Å; M636-C677 HydrophobicContact CE-CB 3.75Å; M636-C677 HydrophobicContact SD-CB 3.24Å; M636-C677 WeakPolarHBondContact SD-CB 3.14Å; M636-C677 PolarHBondContact SD-SG 2.83Å; M636-S686 VanDerWaalsContact CB-CB 3.48Å; M636-C687 WeakPolarHBondContact CA-O 3.4Å; M636-C688 HydrophobicContact SD-CB 4.46Å; M636-N700 PolarHBondContact N-O 2.82Å; M636-C702 HydrophobicContact CG-CB 3.99Å; M636-C702 HydrophobicContact SD-CB 3.8Å
637	H	72.6	Confident	56.7	Low	108 Å²	108	109.9 Å²	109.9	50%	0.5	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78	127	177	-73.2	-104	0	0	0	109.8	F634 A639 W674 S686 C687	F634-H637 AromaticContact CE1-CD2 3.79Å; F634-H637 AromaticContact CZ-CD2 3.75Å; F634-H637 AromaticContact CZ-NE2 3.81Å; H637-A639 PolarHBondContact O-N 3.38Å; H637-W674 HydrophobicContact CB-CZ3 4.19Å; H637-W674 AromaticContact CD2-CH2 3.65Å; H637-W674 AromaticContact CD2-CZ3 3.6Å; H637-S686 CarbonylContact O-C 3.55Å; H637-S686 VanDerWaalsContact O-CA 3.32Å; H637-S686 WeakPolarHBondContact O-CA 3.33Å; H637-S686 WeakPolarHBondContact O-CB 3.47Å; H637-C687 PolarHBondContact N-O 3.48Å; H637-C687 VanDerWaalsContact N-O 3.12Å; H637-C687 PolarHBondContact O-N 2.02Å
638	I	67.8	Low	56.1	Low	114 Å²	114	113.3 Å²	113.3	59%	0.585	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-56.8	133.9	174.7	-61.4	172.8	0	0	0	109.2	N640	I638-N640 PolarHBondContact O-N 2.95Å
639	A	56.9	Low	54.9	Low	31 Å²	31	112.5 Å²	112.5	26%	0.256	57%	0.569	S	S	.	*			trans	-67.5	78.8	174.6	0	0	0	0	0	111.1	H637 R641 A669 W685	H637-A639 PolarHBondContact O-N 3.38Å; A639-R641 PolarHBondContact O-N 2.04Å; A639-A669 HydrophobicContact CB-CB 4.07Å; A639-W685 WeakPolarHBondContact CB-O 3.17Å; A639-W685 PolarHBondContact N-O 3.04Å
640	N	52.3	Low	53.9	Low	134 Å²	134	116.4 Å²	116.4	72%	0.717	59%	0.585	S	S	*	*			trans	-62.8	124.3	-174.5	-103.2	-22.8	0	0	0	111.5	I638 K642	I638-N640 PolarHBondContact O-N 2.95Å; N640-K642 PolarHBondContact O-N 2.93Å; N640-K642 VanDerWaalsContact O-N 3.07Å
641	R	42.9	Very low	51.8	Low	243 Å²	243	118.9 Å²	118.9	92%	0.917	60%	0.602	S	S	*	*			trans	-61.7	109.5	179.2	-66.5	-178.4	-179.2	-179.2	1.5	110.6	A639 S643	A639-R641 PolarHBondContact O-N 2.04Å; R641-S643 PolarHBondContact O-N 3.4Å
642	K	39.4	Very low	49.4	Very low	184 Å²	184	122.6 Å²	122.6	80%	0.8	63%	0.632	S	S	*	*			trans	-70.7	122.3	154.9	-76.5	-167.9	174	-175.3	0	108.2	N640 S644	N640-K642 PolarHBondContact O-N 2.93Å; N640-K642 VanDerWaalsContact O-N 3.07Å; K642-S644 PolarHBondContact O-N 2.9Å; K642-S644 VanDerWaalsContact O-N 3.08Å
643	S	32	Very low	46.9	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	64%	0.643	S	S	*	*	S	Bend	trans	-86.5	69.3	-168.8	57.5	0	0	0	0	112.8	R641	R641-S643 PolarHBondContact O-N 3.4Å
644	S	32.2	Very low	44.4	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	67%	0.671	S	S	*	*			trans	-166	83	158.2	-156.9	0	0	0	0	112.2	K642	K642-S644 PolarHBondContact O-N 2.9Å; K642-S644 VanDerWaalsContact O-N 3.08Å
645	D	31.7	Very low	41.7	Very low	160 Å²	160	135 Å²	135	86%	0.856	70%	0.696	S	S	*	*			trans	-159.2	144.5	140.5	-117.3	-37.9	0	0	0	109.8
646	R	30.3	Very low	39	Very low	242 Å²	242	134.7 Å²	134.7	91%	0.913	70%	0.698	S	S	*	*			trans	-117.4	18.6	-157.7	-133.4	-177.6	-165.7	-166	5.1	115.9
647	L	31.1	Very low	36.8	Very low	127 Å²	127	140.2 Å²	140.2	67%	0.665	73%	0.733	S	S	*	*	S	Bend	trans	-114	156.3	175.2	-78.8	76	0	0	0	111.6
648	Y	29.3	Very low	34.7	Very low	175 Å²	175	143.1 Å²	143.1	69%	0.686	75%	0.75	S	S	*	*			trans	65.4	53	173.3	-55.5	-74	0	0	0	117.7
649	S	27.5	Very low	32.7	Very low	102 Å²	102	145 Å²	145	71%	0.713	76%	0.761	S	S	*	*			trans	-133.1	60.9	176.2	71.6	0	0	0	0	115.7
650	Q	33.9	Very low	31.2	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	78%	0.776	S	S	*	*			trans	-134.6	153.4	161.7	-70.9	-166.5	-4.8	0	0	111.6
651	P	27.2	Very low	30.1	Very low	111 Å²	111	145.9 Å²	145.9	72%	0.721	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-103.5	137.3	175.4	36.3	-28.4	0	0	0	112.1
652	V	28.7	Very low	29.4	Very low	147 Å²	147	141.5 Å²	141.5	89%	0.891	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-101.9	120.8	169.7	-178.9	0	0	0	0	109.2
653	K	28.8	Very low	29	Very low	185 Å²	185	139 Å²	139	80%	0.804	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-91.2	157.3	166.2	-71.4	-179.9	176.1	179.9	0	109.2
654	S	26.8	Very low	29.1	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	76%	0.759	S	S	*	*	S	Bend	trans	59	106.4	164.7	56.6	0	0	0	0	119.5
655	I	26.7	Very low	29.3	Very low	154 Å²	154	137 Å²	137	79%	0.79	75%	0.747	S	S	*	*				75.4	113.5	120.1	-65.9	164.4	0	0	0	119.2
656	S	26.4	Very low	30	Very low	92 Å²	92	140 Å²	140	64%	0.643	75%	0.746	S	S	*	*			trans	72	145.6	148.5	75.7	0	0	0	0	120.3
657	T	27.6	Very low	31.2	Very low	126 Å²	126	130.7 Å²	130.7	77%	0.773	72%	0.718	S	S	*	*			trans	69.1	159.8	174.6	74	0	0	0	0	116.7
658	I	28.4	Very low	32.2	Very low	169 Å²	169	128 Å²	128	87%	0.867	72%	0.721	S	S	*	*			trans	79.4	141.5	176.6	-53.9	172	0	0	0	115.1
659	D	26.9	Very low	33.5	Very low	152 Å²	152	122.6 Å²	122.6	81%	0.813	71%	0.713	S	S	*	*			trans	-92.2	170.6	-171.6	-164.4	-1.5	0	0	0	111.6
660	A	26.1	Very low	35.3	Very low	70 Å²	70	118.7 Å²	118.7	58%	0.579	69%	0.685	S	S	*	*	S	Bend	trans	64.9	127.8	167.9	0	0	0	0	0	119.7
661	S	28.1	Very low	36.5	Very low	115 Å²	115	112.1 Å²	112.1	80%	0.804	67%	0.665	S	S	*	*			trans	52.6	78.1	148	56.7	0	0	0	0	119.1
662	V	29.2	Very low	37.9	Very low	150 Å²	150	115.3 Å²	115.3	91%	0.909	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-95.9	120.1	161.7	-179.2	0	0	0	0	110.1
663	Q	30	Very low	39.3	Very low	132 Å²	132	112.9 Å²	112.9	62%	0.617	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-82.1	129.7	-176.7	-65.3	173	-24	0	0	112.2
664	A	33.8	Very low	41.5	Very low	72 Å²	72	108.2 Å²	108.2	60%	0.595	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-73.8	143	168.2	0	0	0	0	0	111.1	W666	A664-W666 VanDerWaalsContact O-CD1 3.25Å; A664-W666 PolarHBondContact O-N 2.9Å
665	K	38	Very low	43.5	Very low	118 Å²	118	104.9 Å²	104.9	51%	0.513	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-67.6	131.7	174	-75.7	173.6	-179	161.7	0	110.1	W685	K665-W685 PolarHBondContact O-NE1 3.36Å; K665-W685 VanDerWaalsContact O-NE1 3.09Å
666	W	44.7	Very low	45.9	Very low	224 Å²	224	99.2 Å²	99.2	85%	0.848	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-77.3	150.9	-158.7	-78	49	0	0	0	115.1	A664 G668	A664-W666 VanDerWaalsContact O-CD1 3.25Å; A664-W666 PolarHBondContact O-N 2.9Å; W666-G668 PolarHBondContact O-N 2.86Å
667	C	56.6	Low	48.5	Very low	46 Å²	46	94.9 Å²	94.9	31%	0.311	56%	0.56	S	S	.	*			trans	-79.5	18.8	171.2	-158.3	0	0	0	0	114.6	A669 C670 C676	C667-A669 PolarHBondContact O-N 3.34Å; C667-C670 PolarHBondContact O-N 3.42Å; C667-C670 VanDerWaalsContact O-N 3.11Å; C667-C670 PolarHBondContact SG-SG 2.94Å; C667-C676 HydrophobicContact CB-CB 3.79Å; C667-C676 WeakPolarHBondContact CB-SG 3.46Å; C667-C676 WeakPolarHBondContact SG-CB 3.02Å; C667-C676 CovalentContact SG-SG 2.01Å; C667-C676 PolarHBondContact SG-SG 2.76Å
668	G	51.2	Low	50.8	Low	72 Å²	72	89.7 Å²	89.7	74%	0.742	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	3.7	-167.5	0	0	0	0	0	116.9	W666	W666-G668 PolarHBondContact O-N 2.86Å
669	A	57.7	Low	52.7	Low	61 Å²	61	82.9 Å²	82.9	50%	0.504	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-8.8	176.5	0	0	0	0	0	113.8	A639 C667	A639-A669 HydrophobicContact CB-CB 4.07Å; C667-A669 PolarHBondContact O-N 3.34Å
670	C	65.2	Low	54.7	Low	20 Å²	20	78.6 Å²	78.6	14%	0.135	48%	0.48	C	S	.	.	S	Bend	trans	-89.7	137	173.5	-54.2	0	0	0	0	109.7	C667 W674 C687	C667-C670 PolarHBondContact O-N 3.42Å; C667-C670 VanDerWaalsContact O-N 3.11Å; C667-C670 PolarHBondContact SG-SG 2.94Å; C670-W674 HydrophobicContact CB-CB 4.21Å; C670-C687 WeakPolarHBondContact CA-SG 3.12Å; C670-C687 HydrophobicContact CB-CB 3.74Å; C670-C687 WeakPolarHBondContact CB-SG 3.47Å; C670-C687 WeakPolarHBondContact SG-CA 3.29Å; C670-C687 WeakPolarHBondContact SG-CB 3.42Å; C670-C687 CovalentContact SG-SG 2.03Å; C670-C687 PolarHBondContact SG-SG 3.11Å
671	G	58.5	Low	56.7	Low	39 Å²	39	79.4 Å²	79.4	40%	0.402	48%	0.478	S	S	.	.			trans	-71	159.9	179.9	0	0	0	0	0	112.9	T673 W674	G671-T673 PolarHBondContact O-N 3Å; G671-W674 WeakPolarHBondContact O-CB 3.32Å; G671-W674 PolarHBondContact O-N 3.01Å
672	D	56.5	Low	58.3	Low	177 Å²	177	80.6 Å²	80.6	95%	0.947	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-12.5	-171.8	-56	-17.5	0	0	0	116.9
673	T	58.3	Low	60	Low	96 Å²	96	79.5 Å²	79.5	59%	0.589	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	6.6	178.6	51.9	0	0	0	0	114	G671 V691	G671-T673 PolarHBondContact O-N 3Å; T673-V691 WeakPolarHBondContact O-CG2 3Å
674	W	74	Confident	61.8	Low	88 Å²	88	75.7 Å²	75.7	33%	0.333	45%	0.446	S	S	.	.			trans	-117.5	135.9	-175.2	-64.3	52.6	0	0	0	110.9	F634 H637 C670 G671 C687 C688 P689	F634-W674 HydrophobicContact CE1-CZ3 4.18Å; F634-W674 HydrophobicContact CZ-CH2 4.32Å; F634-W674 HydrophobicContact CZ-CZ3 4.33Å; H637-W674 HydrophobicContact CB-CZ3 4.19Å; H637-W674 AromaticContact CD2-CH2 3.65Å; H637-W674 AromaticContact CD2-CZ3 3.6Å; C670-W674 HydrophobicContact CB-CB 4.21Å; G671-W674 WeakPolarHBondContact O-CB 3.32Å; G671-W674 PolarHBondContact O-N 3.01Å; W674-C687 HydrophobicContact CD2-CB 4.35Å; W674-C687 HydrophobicContact CE3-CB 3.47Å; W674-C687 VanDerWaalsContact CE3-CB 3.47Å; W674-C687 HydrophobicContact CZ3-CB 4Å; W674-C688 CarbonylContact C-O 3.32Å; W674-C688 WeakPolarHBondContact CA-O 3.01Å; W674-C688 WeakPolarHBondContact CB-O 2.99Å; W674-P689 HydrophobicContact CD2-CB 4.22Å; W674-P689 HydrophobicContact CE3-CB 4.41Å
675	A	70.6	Confident	63.6	Low	29 Å²	29	75.9 Å²	75.9	24%	0.24	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	153	172.5	0	0	0	0	0	111.9	C688	A675-C688 HydrophobicContact CB-CB 4.46Å; A675-C688 PolarHBondContact N-O 2.83Å; A675-C688 PolarHBondContact O-N 2.91Å
676	C	75.6	Confident	65.7	Low	36 Å²	36	70.4 Å²	70.4	24%	0.243	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.1	171.3	-125.9	0	0	0	0	112	C667 W685	C667-C676 HydrophobicContact CB-CB 3.79Å; C667-C676 WeakPolarHBondContact CB-SG 3.46Å; C667-C676 WeakPolarHBondContact SG-CB 3.02Å; C667-C676 CovalentContact SG-SG 2.01Å; C667-C676 PolarHBondContact SG-SG 2.76Å; C676-W685 HydrophobicContact CB-CE3 3.85Å; C676-W685 HydrophobicContact CB-CZ3 4.15Å; C676-W685 VanDerWaalsContact SG-CE3 3.55Å
677	C	80.7	Confident	67.5	Low	0 Å²	0	60.2 Å²	60.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.5	169.7	-66.4	0	0	0	0	110.3	M636 W685 S686 C695	M636-C677 HydrophobicContact CE-CB 3.75Å; M636-C677 HydrophobicContact SD-CB 3.24Å; M636-C677 WeakPolarHBondContact SD-CB 3.14Å; M636-C677 PolarHBondContact SD-SG 2.83Å; C677-W685 WeakPolarHBondContact O-CA 3.19Å; C677-S686 PolarHBondContact N-O 2.9Å; C677-S686 PolarHBondContact O-N 3.13Å; C677-C695 WeakPolarHBondContact CA-SG 3.34Å; C677-C695 HydrophobicContact CB-CB 3.58Å; C677-C695 WeakPolarHBondContact CB-SG 3.01Å; C677-C695 WeakPolarHBondContact SG-CB 3.06Å; C677-C695 CovalentContact SG-SG 2.03Å; C677-C695 PolarHBondContact SG-SG 3.01Å
678	P	75.8	Confident	68.7	Low	18 Å²	18	58 Å²	58	12%	0.117	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	155.2	175.6	32.2	-34.3	0	0	0	111.4	F682 W685 I697	P678-F682 HydrophobicContact CB-CD1 3.78Å; P678-F682 HydrophobicContact CB-CE1 4.18Å; P678-F682 HydrophobicContact CG-CD1 3.98Å; P678-F682 HydrophobicContact CG-CE1 3.86Å; P678-W685 HydrophobicContact CB-CE3 4.01Å; P678-W685 HydrophobicContact CB-CH2 4.37Å; P678-W685 HydrophobicContact CB-CZ3 3.94Å; P678-W685 HydrophobicContact CG-CZ3 4.26Å; P678-I697 HydrophobicContact CG-CD1 4.41Å
679	D	70.2	Confident	70.1	Confident	26 Å²	26	56.6 Å²	56.6	14%	0.139	33%	0.333	C	S	.	.			trans	-73.7	171.3	164.9	73.4	29.3	0	0	0	112.3	T681 F682 N683 S684	D679-T681 PolarHBondContact O-N 3.04Å; D679-T681 VanDerWaalsContact OD1-C 3.29Å; D679-T681 VanDerWaalsContact OD1-CA 3.23Å; D679-T681 WeakPolarHBondContact OD1-CA 3.02Å; D679-T681 WeakPolarHBondContact OD1-CB 3.01Å; D679-T681 PolarHBondContact OD1-N 2.6Å; D679-T681 PolarHBondContact OD1-OG1 3.05Å; D679-T681 PolarHBondContact OD2-OG1 2.99Å; D679-F682 PolarHBondContact O-N 3.02Å; D679-F682 PolarHBondContact OD1-N 3.1Å; D679-N683 PolarHBondContact OD1-N 2.95Å; D679-S684 PolarHBondContact N-O 3.48Å; D679-S684 WeakPolarHBondContact OD2-CA 2.97Å; D679-S684 WeakPolarHBondContact OD2-CB 3.35Å; D679-S684 PolarHBondContact OD2-N 3.39Å; D679-S684 PolarHBondContact OD2-OG 3.2Å
680	A	68.3	Low	71.1	Confident	62 Å²	62	57.3 Å²	57.3	51%	0.512	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-8.4	179.2	0	0	0	0	0	115.2	I697	A680-I697 HydrophobicContact CB-CG2 4.18Å
681	T	67	Low	71	Confident	87 Å²	87	60.8 Å²	60.8	53%	0.534	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-6.1	176.9	78.6	0	0	0	0	112.4	D679 N683	D679-T681 PolarHBondContact O-N 3.04Å; D679-T681 VanDerWaalsContact OD1-C 3.29Å; D679-T681 VanDerWaalsContact OD1-CA 3.23Å; D679-T681 WeakPolarHBondContact OD1-CA 3.02Å; D679-T681 WeakPolarHBondContact OD1-CB 3.01Å; D679-T681 PolarHBondContact OD1-N 2.6Å; D679-T681 PolarHBondContact OD1-OG1 3.05Å; D679-T681 PolarHBondContact OD2-OG1 2.99Å; T681-N683 VanDerWaalsContact CB-ND2 3.33Å; T681-N683 WeakPolarHBondContact CB-ND2 3.41Å; T681-N683 PolarHBondContact O-N 2.91Å; T681-N683 PolarHBondContact O-ND2 3.48Å; T681-N683 WeakPolarHBondContact OG1-CB 3.34Å; T681-N683 PolarHBondContact OG1-N 2.9Å; T681-N683 PolarHBondContact OG1-ND2 2.05Å
682	F	63.1	Low	71.3	Confident	139 Å²	139	61.8 Å²	61.8	61%	0.61	36%	0.355	S	S	*	.	S	Bend	trans	55.9	20.1	-170.4	-59.7	-95.1	0	0	0	114.5	P678 D679 I697	P678-F682 HydrophobicContact CB-CD1 3.78Å; P678-F682 HydrophobicContact CB-CE1 4.18Å; P678-F682 HydrophobicContact CG-CD1 3.98Å; P678-F682 HydrophobicContact CG-CE1 3.86Å; D679-F682 PolarHBondContact O-N 3.02Å; D679-F682 PolarHBondContact OD1-N 3.1Å; F682-I697 HydrophobicContact CZ-CD1 4.24Å
683	N	64.9	Low	71.9	Confident	127 Å²	127	54.5 Å²	54.5	68%	0.679	32%	0.321	S	S	*	.	S	Bend	trans	-100.2	-24.1	-178.7	-67.1	-72.5	0	0	0	114.2	D679 T681	D679-N683 PolarHBondContact OD1-N 2.95Å; T681-N683 VanDerWaalsContact CB-ND2 3.33Å; T681-N683 WeakPolarHBondContact CB-ND2 3.41Å; T681-N683 PolarHBondContact O-N 2.91Å; T681-N683 PolarHBondContact O-ND2 3.48Å; T681-N683 WeakPolarHBondContact OG1-CB 3.34Å; T681-N683 PolarHBondContact OG1-N 2.9Å; T681-N683 PolarHBondContact OG1-ND2 2.05Å
684	S	66.8	Low	73	Confident	52 Å²	52	54 Å²	54	36%	0.364	31%	0.312	S	S	.	.			trans	-126.4	164.6	170.7	84	0	0	0	0	112	D679	D679-S684 PolarHBondContact N-O 3.48Å; D679-S684 WeakPolarHBondContact OD2-CA 2.97Å; D679-S684 WeakPolarHBondContact OD2-CB 3.35Å; D679-S684 PolarHBondContact OD2-N 3.39Å; D679-S684 PolarHBondContact OD2-OG 3.2Å
685	W	72.7	Confident	73.6	Confident	76 Å²	76	51.7 Å²	51.7	29%	0.288	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.9	-177.5	-61.8	90.9	0	0	0	109.9	A639 K665 C676 C677 P678	A639-W685 WeakPolarHBondContact CB-O 3.17Å; A639-W685 PolarHBondContact N-O 3.04Å; K665-W685 PolarHBondContact O-NE1 3.36Å; K665-W685 VanDerWaalsContact O-NE1 3.09Å; C676-W685 HydrophobicContact CB-CE3 3.85Å; C676-W685 HydrophobicContact CB-CZ3 4.15Å; C676-W685 VanDerWaalsContact SG-CE3 3.55Å; C677-W685 WeakPolarHBondContact O-CA 3.19Å; P678-W685 HydrophobicContact CB-CE3 4.01Å; P678-W685 HydrophobicContact CB-CH2 4.37Å; P678-W685 HydrophobicContact CB-CZ3 3.94Å; P678-W685 HydrophobicContact CG-CZ3 4.26Å
686	S	80.5	Confident	74.3	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.028	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.1	173.4	-59	0	0	0	0	110.6	M636 H637 C677	M636-S686 VanDerWaalsContact CB-CB 3.48Å; H637-S686 CarbonylContact O-C 3.55Å; H637-S686 VanDerWaalsContact O-CA 3.32Å; H637-S686 WeakPolarHBondContact O-CA 3.33Å; H637-S686 WeakPolarHBondContact O-CB 3.47Å; C677-S686 PolarHBondContact N-O 2.9Å; C677-S686 PolarHBondContact O-N 3.13Å
687	C	82.6	Confident	74.3	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.2	-174.9	-51.9	0	0	0	0	111	M636 H637 C670 W674	M636-C687 WeakPolarHBondContact CA-O 3.4Å; H637-C687 PolarHBondContact N-O 3.48Å; H637-C687 VanDerWaalsContact N-O 3.12Å; H637-C687 PolarHBondContact O-N 2.02Å; C670-C687 WeakPolarHBondContact CA-SG 3.12Å; C670-C687 HydrophobicContact CB-CB 3.74Å; C670-C687 WeakPolarHBondContact CB-SG 3.47Å; C670-C687 WeakPolarHBondContact SG-CA 3.29Å; C670-C687 WeakPolarHBondContact SG-CB 3.42Å; C670-C687 CovalentContact SG-SG 2.03Å; C670-C687 PolarHBondContact SG-SG 3.11Å; W674-C687 HydrophobicContact CD2-CB 4.35Å; W674-C687 HydrophobicContact CE3-CB 3.47Å; W674-C687 VanDerWaalsContact CE3-CB 3.47Å; W674-C687 HydrophobicContact CZ3-CB 4Å
688	C	82.5	Confident	74	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129	178.1	174.8	0	0	0	0	110.7	M636 W674 A675 Y690 C702	M636-C688 HydrophobicContact SD-CB 4.46Å; W674-C688 CarbonylContact C-O 3.32Å; W674-C688 WeakPolarHBondContact CA-O 3.01Å; W674-C688 WeakPolarHBondContact CB-O 2.99Å; A675-C688 HydrophobicContact CB-CB 4.46Å; A675-C688 PolarHBondContact N-O 2.83Å; A675-C688 PolarHBondContact O-N 2.91Å; C688-Y690 PolarHBondContact O-N 3.33Å; C688-C702 HydrophobicContact CB-CB 3.72Å; C688-C702 WeakPolarHBondContact CB-SG 3.38Å; C688-C702 WeakPolarHBondContact SG-CB 3.28Å; C688-C702 CovalentContact SG-SG 2.02Å; C688-C702 PolarHBondContact SG-SG 3.15Å
689	P	81	Confident	73.9	Confident	41 Å²	41	56.9 Å²	56.9	27%	0.266	34%	0.339	S	S	.	.	S	Bend	trans	-74.1	-4.6	-178.5	32.3	-38	0	0	0	113.9	F634 W674 V691	F634-P689 HydrophobicContact CD1-CG 3.72Å; F634-P689 HydrophobicContact CD2-CG 3.78Å; F634-P689 HydrophobicContact CE1-CG 3.75Å; F634-P689 HydrophobicContact CE2-CG 3.81Å; F634-P689 HydrophobicContact CG-CG 3.73Å; F634-P689 HydrophobicContact CZ-CG 3.8Å; W674-P689 HydrophobicContact CD2-CB 4.22Å; W674-P689 HydrophobicContact CE3-CB 4.41Å; P689-V691 PolarHBondContact O-N 2.78Å
690	Y	79.3	Confident	74.3	Confident	76 Å²	76	59.7 Å²	59.7	30%	0.298	35%	0.354	S	S	.	.			trans	-94.1	95	-178.7	-57.2	-47.4	0	0	0	111.6	F634 C688 G692 G693 C703 P704	F634-Y690 HydrophobicContact CB-CD2 4.4Å; F634-Y690 HydrophobicContact CB-CE2 3.61Å; C688-Y690 PolarHBondContact O-N 3.33Å; Y690-G692 PolarHBondContact O-N 3.48Å; Y690-G693 PolarHBondContact O-N 3.27Å; Y690-C703 VanDerWaalsContact CD2-C 3.45Å; Y690-P704 HydrophobicContact CD1-CB 3.99Å; Y690-P704 HydrophobicContact CD2-CB 4.08Å; Y690-P704 HydrophobicContact CE1-CB 4.07Å; Y690-P704 HydrophobicContact CE2-CB 4.14Å; Y690-P704 HydrophobicContact CE2-CG 4.42Å; Y690-P704 HydrophobicContact CG-CB 4Å
691	V	62.9	Low	75.2	Confident	93 Å²	93	57.9 Å²	57.9	56%	0.564	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	117.2	169.8	-175.5	0	0	0	0	109.6	T673 P689 P705	T673-V691 WeakPolarHBondContact O-CG2 3Å; P689-V691 PolarHBondContact O-N 2.78Å; V691-P705 WeakPolarHBondContact O-CG 3.32Å
692	G	63.2	Low	76.2	Confident	61 Å²	61	53.7 Å²	53.7	63%	0.629	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	17	-173.5	0	0	0	0	0	114.7	Y690 P705	Y690-G692 PolarHBondContact O-N 3.48Å; G692-P705 WeakPolarHBondContact O-CA 3.28Å; G692-P705 WeakPolarHBondContact O-CB 3.41Å
693	G	70.8	Confident	77.4	Confident	24 Å²	24	47.1 Å²	47.1	25%	0.247	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-73.5	173.2	170.2	0	0	0	0	0	113.8	Y690 C703	Y690-G693 PolarHBondContact O-N 3.27Å; G693-C703 CarbonylContact C-O 3.59Å; G693-C703 WeakPolarHBondContact CA-O 3.44Å
694	E	81.2	Confident	78.2	Confident	85 Å²	85	42.2 Å²	42.2	40%	0.397	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127	177.1	-162.5	172.4	110.9	0	0	110.1	C702 C703 S707 R708 C709	E694-C702 WeakPolarHBondContact O-CA 3.2Å; E694-C703 HydrophobicContact CB-CB 4.35Å; E694-C703 PolarHBondContact N-O 3.26Å; E694-C703 PolarHBondContact O-N 2.75Å; E694-S707 WeakPolarHBondContact CB-O 3.28Å; E694-R708 VanDerWaalsContact OE1-CA 3.27Å; E694-R708 WeakPolarHBondContact OE1-CA 3.07Å; E694-C709 PolarHBondContact OE1-N 3.15Å
695	C	85.3	Confident	78.6	Confident	39 Å²	39	43.6 Å²	43.6	26%	0.264	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	119.9	-176.9	-65.1	0	0	0	0	111.4	C677 I697	C677-C695 WeakPolarHBondContact CA-SG 3.34Å; C677-C695 HydrophobicContact CB-CB 3.58Å; C677-C695 WeakPolarHBondContact CB-SG 3.01Å; C677-C695 WeakPolarHBondContact SG-CB 3.06Å; C677-C695 CovalentContact SG-SG 2.03Å; C677-C695 PolarHBondContact SG-SG 3.01Å; C695-I697 VanDerWaalsContact C-N 3.34Å; C695-I697 PolarHBondContact O-N 3.02Å
696	C	86.5	Confident	78.4	Confident	3 Å²	3	42 Å²	42	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	78.6	178.9	-48.4	0	0	0	0	110.5	G698 Q699 I701 C709	C696-G698 PolarHBondContact O-N 2.87Å; C696-Q699 HydrophobicContact CB-CB 4.02Å; C696-Q699 HydrophobicContact CB-CG 4.26Å; C696-Q699 PolarHBondContact O-N 2.85Å; C696-I701 WeakPolarHBondContact CA-O 3.37Å; C696-I701 HydrophobicContact CB-CB 4.37Å; C696-I701 HydrophobicContact CB-CG2 4.4Å; C696-I701 WeakPolarHBondContact CB-O 3.36Å; C696-I701 PolarHBondContact N-O 3.33Å; C696-C709 WeakPolarHBondContact CA-SG 3.36Å; C696-C709 HydrophobicContact CB-CB 3.74Å; C696-C709 WeakPolarHBondContact CB-SG 3.42Å; C696-C709 PolarHBondContact N-SG 3.44Å; C696-C709 WeakPolarHBondContact SG-CB 3.43Å; C696-C709 CovalentContact SG-SG 2.04Å; C696-C709 PolarHBondContact SG-SG 2.85Å
697	I	75.3	Confident	78.4	Confident	86 Å²	86	42 Å²	42	44%	0.441	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	124.8	179.1	-59	177.9	0	0	0	109.6	P678 A680 F682 C695	P678-I697 HydrophobicContact CG-CD1 4.41Å; A680-I697 HydrophobicContact CB-CG2 4.18Å; F682-I697 HydrophobicContact CZ-CD1 4.24Å; C695-I697 VanDerWaalsContact C-N 3.34Å; C695-I697 PolarHBondContact O-N 3.02Å
698	G	73.9	Confident	78.5	Confident	51 Å²	51	47 Å²	47	53%	0.526	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-1.7	-177.8	0	0	0	0	0	116.4	C696	C696-G698 PolarHBondContact O-N 2.87Å
699	Q	73.2	Confident	78.6	Confident	53 Å²	53	48.4 Å²	48.4	25%	0.248	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-3.1	177.9	-55.1	-173.8	20.1	0	0	114.2	C696 I701 L710 G713	C696-Q699 HydrophobicContact CB-CB 4.02Å; C696-Q699 HydrophobicContact CB-CG 4.26Å; C696-Q699 PolarHBondContact O-N 2.85Å; Q699-I701 HydrophobicContact CB-CB 4.24Å; Q699-I701 WeakPolarHBondContact O-CG1 3.23Å; Q699-I701 PolarHBondContact O-N 2.8Å; Q699-I701 VanDerWaalsContact O-N 3.16Å; Q699-L710 VanDerWaalsContact CD-O 3.31Å; Q699-L710 PolarHBondContact NE2-O 3.34Å; Q699-L710 PolarHBondContact OE1-O 2.77Å; Q699-G713 VanDerWaalsContact OE1-CA 3.3Å; Q699-G713 VanDerWaalsContact OE1-N 3.16Å
700	N	80.2	Confident	78.8	Confident	85 Å²	85	48 Å²	48	46%	0.455	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	29.7	-171.6	-64.5	-10.8	0	0	0	113.7	M636	M636-N700 PolarHBondContact N-O 2.82Å
701	I	86.6	Confident	78.7	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	152.6	-173.4	-78.5	165.7	0	0	0	110	F634 C696 Q699 G713	F634-I701 CarbonylContact O-C 3.46Å; F634-I701 WeakPolarHBondContact O-CA 3.41Å; C696-I701 WeakPolarHBondContact CA-O 3.37Å; C696-I701 HydrophobicContact CB-CB 4.37Å; C696-I701 HydrophobicContact CB-CG2 4.4Å; C696-I701 WeakPolarHBondContact CB-O 3.36Å; C696-I701 PolarHBondContact N-O 3.33Å; Q699-I701 HydrophobicContact CB-CB 4.24Å; Q699-I701 WeakPolarHBondContact O-CG1 3.23Å; Q699-I701 PolarHBondContact O-N 2.8Å; Q699-I701 VanDerWaalsContact O-N 3.16Å; I701-G713 VanDerWaalsContact CD1-CA 3.44Å
702	C	88.2	Confident	79.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	156.3	169.1	71.3	0	0	0	0	113.1	F634 M636 C688 E694	F634-C702 PolarHBondContact N-O 3.35Å; F634-C702 PolarHBondContact O-N 2.73Å; M636-C702 HydrophobicContact CG-CB 3.99Å; M636-C702 HydrophobicContact SD-CB 3.8Å; C688-C702 HydrophobicContact CB-CB 3.72Å; C688-C702 WeakPolarHBondContact CB-SG 3.38Å; C688-C702 WeakPolarHBondContact SG-CB 3.28Å; C688-C702 CovalentContact SG-SG 2.02Å; C688-C702 PolarHBondContact SG-SG 3.15Å; E694-C702 WeakPolarHBondContact O-CA 3.2Å
703	C	88.5	Confident	80.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	149.6	-178.1	-63.2	0	0	0	0	112.4	Y690 G693 E694 C715	Y690-C703 VanDerWaalsContact CD2-C 3.45Å; G693-C703 CarbonylContact C-O 3.59Å; G693-C703 WeakPolarHBondContact CA-O 3.44Å; E694-C703 HydrophobicContact CB-CB 4.35Å; E694-C703 PolarHBondContact N-O 3.26Å; E694-C703 PolarHBondContact O-N 2.75Å; C703-C715 WeakPolarHBondContact CA-SG 3.01Å; C703-C715 HydrophobicContact CB-CB 3.72Å; C703-C715 WeakPolarHBondContact CB-SG 3.28Å; C703-C715 VanDerWaalsContact SG-CA 3.56Å; C703-C715 WeakPolarHBondContact SG-CB 3.16Å; C703-C715 CovalentContact SG-SG 2.03Å; C703-C715 PolarHBondContact SG-SG 3.17Å
704	P	81.5	Confident	81	Confident	25 Å²	25	52.6 Å²	52.6	16%	0.162	30%	0.299	C	S	.	.			trans	-70.4	163.1	176.6	30.2	-34.4	0	0	0	112.1	Y631 Y690 G706 S707	Y631-P704 HydrophobicContact CE2-CG 3.61Å; Y690-P704 HydrophobicContact CD1-CB 3.99Å; Y690-P704 HydrophobicContact CD2-CB 4.08Å; Y690-P704 HydrophobicContact CE1-CB 4.07Å; Y690-P704 HydrophobicContact CE2-CB 4.14Å; Y690-P704 HydrophobicContact CE2-CG 4.42Å; Y690-P704 HydrophobicContact CG-CB 4Å; P704-G706 PolarHBondContact O-N 2.77Å; P704-S707 WeakPolarHBondContact O-CB 3.07Å; P704-S707 PolarHBondContact O-N 3.39Å; P704-S707 PolarHBondContact O-OG 3.01Å
705	P	73.9	Confident	81.2	Confident	81 Å²	81	48.5 Å²	48.5	53%	0.526	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	131.4	-174	-23.3	33.1	0	0	0	113	V691 G692	V691-P705 WeakPolarHBondContact O-CG 3.32Å; G692-P705 WeakPolarHBondContact O-CA 3.28Å; G692-P705 WeakPolarHBondContact O-CB 3.41Å
706	G	69.4	Low	81.1	Confident	42 Å²	42	47.5 Å²	47.5	43%	0.433	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	30.8	-178.6	0	0	0	0	0	114.7	P704 I718	P704-G706 PolarHBondContact O-N 2.77Å; G706-I718 PolarHBondContact O-N 2.56Å
707	S	81.1	Confident	80.5	Confident	4 Å²	4	53 Å²	53	3%	0.028	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	141	-175.7	-29.2	0	0	0	0	110	Y631 E694 P704 E716	Y631-S707 VanDerWaalsContact OH-CB 3.31Å; Y631-S707 WeakPolarHBondContact OH-CB 3.34Å; Y631-S707 PolarHBondContact OH-OG 2.69Å; E694-S707 WeakPolarHBondContact CB-O 3.28Å; P704-S707 WeakPolarHBondContact O-CB 3.07Å; P704-S707 PolarHBondContact O-N 3.39Å; P704-S707 PolarHBondContact O-OG 3.01Å; S707-E716 CarbonylContact C-O 3.57Å; S707-E716 WeakPolarHBondContact CA-O 3.04Å
708	R	84	Confident	80	Confident	115 Å²	115	51.7 Å²	51.7	43%	0.434	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	151.5	175.4	64.9	173.6	171	-152.2	-8.8	112.4	E694 C715 E716 I718	E694-R708 VanDerWaalsContact OE1-CA 3.27Å; E694-R708 WeakPolarHBondContact OE1-CA 3.07Å; R708-C715 CarbonylContact O-C 3.59Å; R708-C715 WeakPolarHBondContact O-CA 3.17Å; R708-E716 HydrophobicContact CG-CB 3.92Å; R708-E716 IonicContact CZ-OE1 2.71Å; R708-E716 IonicContact CZ-OE2 3.81Å; R708-E716 VanDerWaalsContact CZ-OE2 3.3Å; R708-E716 PolarHBondContact N-O 2.9Å; R708-E716 IonicContact NE-OE1 3.64Å; R708-E716 IonicContact NE-OE2 2.72Å; R708-E716 PolarHBondContact NE-OE2 2.96Å; R708-E716 IonicContact NH2-OE1 3.69Å; R708-E716 PolarHBondContact NH2-OE1 3.21Å; R708-E716 IonicContact NH2-OE2 3.86Å; R708-E716 PolarHBondContact NH2-OE2 3.44Å; R708-E716 PolarHBondContact O-N 2.92Å; R708-I718 HydrophobicContact CB-CD1 3.97Å; R708-I718 HydrophobicContact CB-CG1 4.06Å; R708-I718 HydrophobicContact CG-CG1 4.21Å
709	C	84.7	Confident	78.9	Confident	30 Å²	30	53 Å²	53	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	145.5	169.3	-60.5	0	0	0	0	112.6	E694 C696	E694-C709 PolarHBondContact OE1-N 3.15Å; C696-C709 WeakPolarHBondContact CA-SG 3.36Å; C696-C709 HydrophobicContact CB-CB 3.74Å; C696-C709 WeakPolarHBondContact CB-SG 3.42Å; C696-C709 PolarHBondContact N-SG 3.44Å; C696-C709 WeakPolarHBondContact SG-CB 3.43Å; C696-C709 CovalentContact SG-SG 2.04Å; C696-C709 PolarHBondContact SG-SG 2.85Å
710	L	84.9	Confident	77.7	Confident	32 Å²	32	57.8 Å²	57.8	17%	0.168	31%	0.31	C	S	.	.			trans	-115.6	154.1	168.2	-66.7	174.4	0	0	0	110.1	V630 Q699 N712 G713 K714 E716	V630-L710 HydrophobicContact CB-CD1 4.49Å; V630-L710 HydrophobicContact CG1-CD1 3.8Å; V630-L710 HydrophobicContact CG2-CD1 3.81Å; Q699-L710 VanDerWaalsContact CD-O 3.31Å; Q699-L710 PolarHBondContact NE2-O 3.34Å; Q699-L710 PolarHBondContact OE1-O 2.77Å; L710-N712 WeakPolarHBondContact CB-OD1 3.12Å; L710-N712 PolarHBondContact O-N 2.88Å; L710-G713 PolarHBondContact O-N 2.86Å; L710-K714 WeakPolarHBondContact CB-O 3.38Å; L710-K714 HydrophobicContact CD1-CB 4.27Å; L710-K714 PolarHBondContact N-O 2.8Å; L710-E716 HydrophobicContact CD1-CB 4.04Å; L710-E716 HydrophobicContact CD2-CB 4.21Å; L710-E716 WeakPolarHBondContact CD2-OE2 3.29Å; L710-E716 HydrophobicContact CG-CB 4.05Å
711	N	78.1	Confident	76.1	Confident	166 Å²	166	56.1 Å²	56.1	89%	0.888	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	4	-175.2	-65	0.4	0	0	0	115.5
712	N	78.7	Confident	74.2	Confident	102 Å²	102	60 Å²	60	55%	0.545	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	23	-175.4	64.5	-15.1	0	0	0	113.4	L710 K714	L710-N712 WeakPolarHBondContact CB-OD1 3.12Å; L710-N712 PolarHBondContact O-N 2.88Å; N712-K714 VanDerWaalsContact C-N 3.28Å; N712-K714 PolarHBondContact O-N 2.99Å; N712-K714 WeakPolarHBondContact OD1-CB 3.26Å
713	G	78.9	Confident	72.1	Confident	13 Å²	13	65.5 Å²	65.5	13%	0.134	35%	0.348	C	S	.	.	S	Bend	trans	74.2	15.4	-179.6	0	0	0	0	0	114.5	G633 Q699 I701 L710	G633-G713 PolarHBondContact N-O 2.68Å; Q699-G713 VanDerWaalsContact OE1-CA 3.3Å; Q699-G713 VanDerWaalsContact OE1-N 3.16Å; I701-G713 VanDerWaalsContact CD1-CA 3.44Å; L710-G713 PolarHBondContact O-N 2.86Å
714	K	86.9	Confident	70.2	Confident	69 Å²	69	69.7 Å²	69.7	30%	0.3	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	161.7	-178.4	-54.1	-168.3	-175.7	-105.1	0	111.7	V630 Y631 D632 L710 N712	V630-K714 HydrophobicContact CG1-CB 3.47Å; V630-K714 VanDerWaalsContact CG1-CB 3.47Å; V630-K714 HydrophobicContact CG1-CD 3.57Å; V630-K714 HydrophobicContact CG1-CG 4.14Å; Y631-K714 CarbonylContact O-C 3.5Å; Y631-K714 WeakPolarHBondContact O-CA 3.34Å; Y631-K714 WeakPolarHBondContact O-CB 3.34Å; D632-K714 WeakPolarHBondContact OD1-CE 3.3Å; D632-K714 IonicContact OD1-NZ 3.31Å; D632-K714 PolarHBondContact OD1-NZ 2.04Å; D632-K714 IonicContact OD2-NZ 3.39Å; L710-K714 WeakPolarHBondContact CB-O 3.38Å; L710-K714 HydrophobicContact CD1-CB 4.27Å; L710-K714 PolarHBondContact N-O 2.8Å; N712-K714 VanDerWaalsContact C-N 3.28Å; N712-K714 PolarHBondContact O-N 2.99Å; N712-K714 WeakPolarHBondContact OD1-CB 3.26Å
715	C	85.9	Confident	68.5	Low	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.6	-175.6	-64.1	0	0	0	0	110.4	V630 Y631 G633 C703 R708	V630-C715 WeakPolarHBondContact CA-O 3.31Å; Y631-C715 HydrophobicContact CD2-CB 3.86Å; Y631-C715 HydrophobicContact CE2-CB 3.42Å; Y631-C715 VanDerWaalsContact CE2-CB 3.42Å; Y631-C715 PolarHBondContact N-O 3.39Å; Y631-C715 PolarHBondContact O-N 3.4Å; G633-C715 WeakPolarHBondContact CA-SG 3.45Å; C703-C715 WeakPolarHBondContact CA-SG 3.01Å; C703-C715 HydrophobicContact CB-CB 3.72Å; C703-C715 WeakPolarHBondContact CB-SG 3.28Å; C703-C715 VanDerWaalsContact SG-CA 3.56Å; C703-C715 WeakPolarHBondContact SG-CB 3.16Å; C703-C715 CovalentContact SG-SG 2.03Å; C703-C715 PolarHBondContact SG-SG 3.17Å; R708-C715 CarbonylContact O-C 3.59Å; R708-C715 WeakPolarHBondContact O-CA 3.17Å
716	E	82	Confident	67.3	Low	17 Å²	17	73.9 Å²	73.9	8%	0.079	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117	175.9	-176.3	-176.3	170.2	0	0	109.9	K628 V630 S707 R708 L710 I718	K628-E716 HydrophobicContact CB-CG 4.23Å; K628-E716 HydrophobicContact CD-CG 4.31Å; K628-E716 WeakPolarHBondContact CD-OE1 3.5Å; K628-E716 WeakPolarHBondContact CE-OE1 3.41Å; K628-E716 HydrophobicContact CG-CG 4.36Å; K628-E716 WeakPolarHBondContact CG-OE1 3.38Å; K628-E716 VanDerWaalsContact NZ-CD 3.29Å; K628-E716 IonicContact NZ-OE1 3.51Å; K628-E716 PolarHBondContact NZ-OE1 3.4Å; K628-E716 IonicContact NZ-OE2 3.42Å; K628-E716 PolarHBondContact NZ-OE2 2.71Å; V630-E716 HydrophobicContact CG2-CB 4.48Å; S707-E716 CarbonylContact C-O 3.57Å; S707-E716 WeakPolarHBondContact CA-O 3.04Å; R708-E716 HydrophobicContact CG-CB 3.92Å; R708-E716 IonicContact CZ-OE1 2.71Å; R708-E716 IonicContact CZ-OE2 3.81Å; R708-E716 VanDerWaalsContact CZ-OE2 3.3Å; R708-E716 PolarHBondContact N-O 2.9Å; R708-E716 IonicContact NE-OE1 3.64Å; R708-E716 IonicContact NE-OE2 2.72Å; R708-E716 PolarHBondContact NE-OE2 2.96Å; R708-E716 IonicContact NH2-OE1 3.69Å; R708-E716 PolarHBondContact NH2-OE1 3.21Å; R708-E716 IonicContact NH2-OE2 3.86Å; R708-E716 PolarHBondContact NH2-OE2 3.44Å; R708-E716 PolarHBondContact O-N 2.92Å; L710-E716 HydrophobicContact CD1-CB 4.04Å; L710-E716 HydrophobicContact CD2-CB 4.21Å; L710-E716 WeakPolarHBondContact CD2-OE2 3.29Å; L710-E716 HydrophobicContact CG-CB 4.05Å; E716-I718 PolarHBondContact O-N 3.03Å
717	K	73.8	Confident	66.3	Low	120 Å²	120	72.5 Å²	72.5	52%	0.522	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	125.7	178.5	-165.6	174.1	-177.7	176.2	0	111.4	I629 Y631	I629-K717 HydrophobicContact CB-CB 4.09Å; I629-K717 HydrophobicContact CD1-CD 4.37Å; I629-K717 PolarHBondContact O-N 3.32Å; Y631-K717 HydrophobicContact CE1-CB 4.33Å
718	I	64.8	Low	64.9	Low	57 Å²	57	73.1 Å²	73.1	29%	0.292	37%	0.369	S	S	.	.			trans	-89.3	109.5	179.7	-48.7	167.5	0	0	0	109.4	G706 R708 E716 K720	G706-I718 PolarHBondContact O-N 2.56Å; R708-I718 HydrophobicContact CB-CD1 3.97Å; R708-I718 HydrophobicContact CB-CG1 4.06Å; R708-I718 HydrophobicContact CG-CG1 4.21Å; E716-I718 PolarHBondContact O-N 3.03Å; I718-K720 VanDerWaalsContact C-N 3.28Å; I718-K720 HydrophobicContact CB-CG 4.43Å; I718-K720 HydrophobicContact CG2-CG 3.76Å; I718-K720 PolarHBondContact O-N 2.92Å
719	S	51.2	Low	63.5	Low	78 Å²	78	71.7 Å²	71.7	55%	0.545	37%	0.373	S	S	.	.			trans	-70.5	78.4	171.7	-58.9	0	0	0	0	111.9	N721	S719-N721 PolarHBondContact O-N 3.41Å; S719-N721 VanDerWaalsContact O-N 3.07Å; S719-N721 PolarHBondContact O-OD1 2.97Å
720	K	48.3	Very low	61.8	Low	155 Å²	155	70.9 Å²	70.9	67%	0.674	37%	0.366	S	S	*	.			trans	-77.4	84.2	172.2	-66.4	-170.6	178.4	-179.6	0	110	I718 I722	I718-K720 VanDerWaalsContact C-N 3.28Å; I718-K720 HydrophobicContact CB-CG 4.43Å; I718-K720 HydrophobicContact CG2-CG 3.76Å; I718-K720 PolarHBondContact O-N 2.92Å; K720-I722 PolarHBondContact O-N 3.18Å
721	N	46.8	Very low	60.3	Low	50 Å²	50	73.8 Å²	73.8	27%	0.267	38%	0.381	S	S	.	.			trans	-66.4	19.4	-173.7	-74.1	12.7	0	0	0	116.5	L620 L622 S719	L620-N721 PolarHBondContact N-O 3.05Å; L620-N721 WeakPolarHBondContact O-CB 3.43Å; L622-N721 VanDerWaalsContact CB-OD1 3.28Å; L622-N721 WeakPolarHBondContact CB-OD1 3Å; L622-N721 PolarHBondContact O-ND2 2.84Å; S719-N721 PolarHBondContact O-N 3.41Å; S719-N721 VanDerWaalsContact O-N 3.07Å; S719-N721 PolarHBondContact O-OD1 2.97Å
722	I	45.9	Very low	59.1	Low	103 Å²	103	70.7 Å²	70.7	53%	0.528	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	115.8	-177.8	-57.2	177.7	0	0	0	109.7	I617 K720 K724	I617-I722 HydrophobicContact CG2-CG2 4.1Å; K720-I722 PolarHBondContact O-N 3.18Å; I722-K724 HydrophobicContact CG2-CD 4.35Å; I722-K724 HydrophobicContact CG2-CG 4.08Å
723	M	44.4	Very low	57.6	Low	116 Å²	116	67.1 Å²	67.1	57%	0.571	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.4	163	-104.7	-172.1	167.2	0	0	109.3	L618 L620	L618-M723 HydrophobicContact CB-CB 3.93Å; L618-M723 HydrophobicContact CD2-CB 4.2Å; L618-M723 HydrophobicContact CD2-SD 4.28Å; L618-M723 PolarHBondContact N-O 2.03Å; L618-M723 PolarHBondContact O-N 2.92Å; L620-M723 HydrophobicContact CD1-CB 4.03Å; L620-M723 HydrophobicContact CD1-CG 3.79Å; L620-M723 HydrophobicContact CD1-SD 4.08Å; L620-M723 HydrophobicContact CG-CB 4.49Å
724	K	48.9	Very low	56	Low	89 Å²	89	72.5 Å²	72.5	39%	0.387	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.2	173.3	-87.7	165.2	159.1	-65.4	0	109.4	D610 T613 Q615 C616 I617 I722	D610-K724 IonicContact OD2-NZ 3.77Å; D610-K724 PolarHBondContact OD2-NZ 3.46Å; T613-K724 PolarHBondContact OG1-NZ 3.04Å; T613-K724 VanDerWaalsContact OG1-NZ 3.17Å; Q615-K724 VanDerWaalsContact OE1-CG 3.3Å; C616-K724 WeakPolarHBondContact O-CA 3.16Å; I617-K724 HydrophobicContact CG1-CG 4.29Å; I722-K724 HydrophobicContact CG2-CD 4.35Å; I722-K724 HydrophobicContact CG2-CG 4.08Å
725	S	46.3	Very low	53.8	Low	50 Å²	50	72.6 Å²	72.6	35%	0.35	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.5	174.8	64.3	0	0	0	0	111.7	C616 A727	C616-S725 PolarHBondContact N-O 3.29Å; C616-S725 PolarHBondContact O-N 3.4Å; S725-A727 PolarHBondContact O-N 3.27Å
726	F	49.4	Very low	51.7	Low	143 Å²	143	78.2 Å²	78.2	63%	0.627	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	131.7	174	-84.2	-83	0	0	0	111.9	P728	F726-P728 WeakPolarHBondContact O-CD 2.96Å
727	A	46.9	Very low	49.5	Very low	14 Å²	14	83 Å²	83	12%	0.116	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-75	122.2	172.5	0	0	0	0	0	110.3	H601 C616 S725	H601-A727 HydrophobicContact CB-CB 3.76Å; H601-A727 PolarHBondContact CD2-O 3.47Å; C616-A727 VanDerWaalsContact SG-CA 3.55Å; C616-A727 VanDerWaalsContact SG-CB 3.54Å; S725-A727 PolarHBondContact O-N 3.27Å
728	P	52.6	Low	47.4	Very low	17 Å²	17	84.9 Å²	84.9	11%	0.11	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-67.6	143.3	170	25.8	-35	0	0	0	112.2	P589 L590 H601 C602 F726	P589-P728 HydrophobicContact CG-CB 4.28Å; L590-P728 HydrophobicContact CD1-CG 3.54Å; L590-P728 HydrophobicContact CD2-CG 4.05Å; L590-P728 HydrophobicContact CG-CG 3.65Å; H601-P728 WeakPolarHBondContact CA-O 3.25Å; C602-P728 PolarHBondContact N-O 2.95Å; C602-P728 WeakPolarHBondContact O-CD 3.47Å; F726-P728 WeakPolarHBondContact O-CD 2.96Å
729	T	54.7	Low	45.7	Very low	84 Å²	84	89.6 Å²	89.6	52%	0.515	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-63.8	143.8	169.3	-39.5	0	0	0	0	110.8	F600	F600-T729 CarbonylContact O-C 3.4Å; F600-T729 WeakPolarHBondContact O-CA 3.45Å; F600-T729 WeakPolarHBondContact O-CG2 3.44Å
730	L	48	Very low	44.6	Very low	13 Å²	13	93.4 Å²	93.4	7%	0.068	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-62.2	148.9	173	-62.2	177	0	0	0	111.7	C578 L580 C588 F600 C602	C578-L730 HydrophobicContact CB-CD1 3.52Å; C578-L730 HydrophobicContact CB-CD2 3.53Å; C578-L730 HydrophobicContact CB-CG 4.18Å; L580-L730 HydrophobicContact CD2-CB 4.07Å; L580-L730 HydrophobicContact CD2-CD1 3.95Å; L580-L730 HydrophobicContact CG-CD1 4.5Å; C588-L730 HydrophobicContact CB-CD2 4.25Å; F600-L730 PolarHBondContact O-N 2.74Å; C602-L730 HydrophobicContact CB-CD2 3.81Å
731	I	54.2	Low	43.8	Very low	93 Å²	93	95.5 Å²	95.5	48%	0.477	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129	172.9	-56.5	-178.2	0	0	0	108	G586 C587 P589 S733	G586-I731 CarbonylContact C-O 3.57Å; G586-I731 WeakPolarHBondContact CA-O 3.26Å; C587-I731 PolarHBondContact N-O 3.15Å; C587-I731 PolarHBondContact O-N 3.47Å; C587-I731 VanDerWaalsContact O-N 3.11Å; P589-I731 HydrophobicContact CB-CD1 3.83Å; P589-I731 HydrophobicContact CB-CG1 4.42Å; P589-I731 HydrophobicContact CG-CD1 4.22Å; P589-I731 HydrophobicContact CG-CG1 4.33Å; I731-S733 PolarHBondContact O-N 3.39Å
732	P	52.9	Low	42.9	Very low	101 Å²	101	102.7 Å²	102.7	66%	0.656	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.4	133.6	173.1	-25.9	35.2	0	0	0	111.7
733	S	47.9	Very low	42	Very low	27 Å²	27	103.2 Å²	103.2	19%	0.189	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-76.4	162.1	-179.7	62.6	0	0	0	0	112.3	S569 W585 I731 S735	S569-S733 WeakPolarHBondContact CB-OG 3.5Å; W585-S733 VanDerWaalsContact O-CB 3.3Å; W585-S733 WeakPolarHBondContact O-CB 3.31Å; W585-S733 PolarHBondContact O-N 3.06Å; W585-S733 VanDerWaalsContact O-N 3.17Å; W585-S733 PolarHBondContact O-OG 2.73Å; I731-S733 PolarHBondContact O-N 3.39Å; S733-S735 PolarHBondContact O-N 3.29Å
734	I	44.9	Very low	41.1	Very low	127 Å²	127	106.7 Å²	106.7	65%	0.651	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.7	120.4	178.7	-57.3	175.9	0	0	0	109.1	K736	I734-K736 PolarHBondContact O-N 2.73Å
735	S	39.6	Very low	40	Very low	71 Å²	71	111.1 Å²	111.1	50%	0.497	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.2	129.9	173.3	177.3	0	0	0	0	110.8	Q568 S733 N737	Q568-S735 CarbonylContact O-C 3.35Å; Q568-S735 WeakPolarHBondContact O-CA 3.05Å; S733-S735 PolarHBondContact O-N 3.29Å; S735-N737 VanDerWaalsContact C-N 3.29Å; S735-N737 PolarHBondContact OG-N 3.44Å; S735-N737 VanDerWaalsContact OG-N 3.1Å; S735-N737 PolarHBondContact OG-O 2.03Å
736	K	42.3	Very low	39.1	Very low	118 Å²	118	115.8 Å²	115.8	51%	0.513	59%	0.593	S	S	.	*	S	Bend	trans	-76.5	-13.3	169.7	-82.4	-176.1	166.3	174.7	0	114	Q568 T570 I734	Q568-K736 PolarHBondContact O-N 2.04Å; T570-K736 HydrophobicContact CG2-CD 4.44Å; T570-K736 VanDerWaalsContact CG2-CE 3.49Å; I734-K736 PolarHBondContact O-N 2.73Å
737	N	36.3	Very low	38.1	Very low	116 Å²	116	117.5 Å²	117.5	62%	0.62	60%	0.603	S	S	*	*			trans	-102.7	108.8	175.6	-80	-8.5	0	0	0	110.8	S735 N739	S735-N737 VanDerWaalsContact C-N 3.29Å; S735-N737 PolarHBondContact OG-N 3.44Å; S735-N737 VanDerWaalsContact OG-N 3.1Å; S735-N737 PolarHBondContact OG-O 2.03Å; N737-N739 VanDerWaalsContact C-N 3.29Å; N737-N739 PolarHBondContact O-N 3.05Å
738	N	28.8	Very low	37.4	Very low	161 Å²	161	125.8 Å²	125.8	86%	0.861	64%	0.64	S	S	*	*			trans	-72.8	83.1	159.8	-81.8	-18.8	0	0	0	109.3
739	N	28.9	Very low	36.2	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	67%	0.67	S	S	*	*			trans	-157.5	149.6	162.2	-103.5	-42.4	0	0	0	111.2	N737	N737-N739 VanDerWaalsContact C-N 3.29Å; N737-N739 PolarHBondContact O-N 3.05Å
740	L	28.4	Very low	34.7	Very low	158 Å²	158	135.1 Å²	135.1	83%	0.827	69%	0.685	S	S	*	*			trans	-64	139.9	-173.6	-92.2	62	0	0	0	113.6
741	Q	32.2	Very low	33.8	Very low	200 Å²	200	141.3 Å²	141.3	94%	0.935	72%	0.723	S	S	*	*			trans	-147.8	135.6	141.6	-112.6	173.5	4.7	0	0	111
742	K	27.7	Very low	32.5	Very low	201 Å²	201	145.9 Å²	145.9	87%	0.874	74%	0.74	S	S	*	*			trans	-104.8	133.3	-179.8	-81.7	-179.8	172.5	177.6	0	111.1
743	S	27.1	Very low	31.3	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	75%	0.752	S	S	*	*			trans	177.7	154.1	153.6	46.3	0	0	0	0	110.1
744	Y	24.8	Very low	30.3	Very low	189 Å²	189	156 Å²	156	74%	0.741	78%	0.78	S	S	*	*			cis	-163.7	154.3	-33.7	-134.2	-77.3	0	0	0	107.6
745	F	25.3	Very low	29.5	Very low	182 Å²	182	160 Å²	160	80%	0.798	79%	0.793	S	S	*	*			trans	64.9	155.4	169.8	-63.8	-65.8	0	0	0	117.5
746	I	28.2	Very low	28.9	Very low	149 Å²	149	164.9 Å²	164.9	76%	0.764	81%	0.807	S	S	*	*			cis	-121	143.2	-0.4	-65	173.8	0	0	0	109.8
747	Q	28	Very low	28.2	Very low	179 Å²	179	167.2 Å²	167.2	84%	0.836	82%	0.824	S	S	*	*			trans	-90.8	135.6	164.9	-64.5	170.3	-52.2	0	0	110.8
748	Q	31.7	Very low	27.8	Very low	188 Å²	188	169.2 Å²	169.2	88%	0.879	83%	0.829	S	S	*	*			trans	-142.8	108.3	149.4	-76.8	-157.9	-11.7	0	0	112.2
749	N	27.4	Very low	27.9	Very low	142 Å²	142	169 Å²	169	76%	0.759	83%	0.826	S	S	*	*			trans	-6.9	130.6	156.3	-57.3	-16.7	0	0	0	117.7
750	N	24.6	Very low	28	Very low	154 Å²	154	166.2 Å²	166.2	82%	0.824	82%	0.818	S	S	*	*				61.5	91.7	74.6	-85.4	-14.7	0	0	0	115.1
751	V	29.1	Very low	28.1	Very low	143 Å²	143	165.4 Å²	165.4	87%	0.867	82%	0.815	S	S	*	*			trans	-140	136.3	132.1	179.1	0	0	0	0	107.1
752	K	25.5	Very low	28	Very low	190 Å²	190	164.3 Å²	164.3	83%	0.826	81%	0.813	S	S	*	*			trans	-92.6	140.4	168.9	-73	179.5	176.2	178.4	0	109
753	E	28.6	Very low	28.1	Very low	193 Å²	193	159.1 Å²	159.1	90%	0.902	81%	0.807	S	S	*	*			trans	-155	140.1	143.7	-124.8	160.4	-144.2	0	0	111
754	N	27.3	Very low	28.3	Very low	146 Å²	146	163.2 Å²	163.2	78%	0.781	81%	0.811	S	S	*	*			trans	-98.6	141.1	-177.3	-67.5	-27	0	0	0	109.6
755	F	28	Very low	28.6	Very low	212 Å²	212	159.8 Å²	159.8	93%	0.93	81%	0.812	S	S	*	*			trans	-151.5	128.7	142.4	-108	-72.9	0	0	0	111.4
756	H	25.8	Very low	28.7	Very low	173 Å²	173	153.8 Å²	153.8	80%	0.801	80%	0.796	S	S	*	*			trans	-84.2	149.6	166.5	-96.8	-122.8	0	0	0	109.9
757	I	28.6	Very low	28.8	Very low	168 Å²	168	156 Å²	156	86%	0.862	80%	0.803	S	S	*	*			trans	-167.9	150.2	142.5	-99	148.8	0	0	0	107.7
758	E	28.7	Very low	29.1	Very low	157 Å²	157	159.4 Å²	159.4	73%	0.734	81%	0.808	S	S	*	*			trans	-101.9	154.7	-165.8	-64.5	-174.4	106.5	0	0	114.8
759	M	29.6	Very low	29.4	Very low	158 Å²	158	154.4 Å²	154.4	78%	0.778	79%	0.787	S	S	*	*			trans	54.2	135.4	144.2	-72.3	172.3	53.1	0	0	119.6
760	S	31.7	Very low	30	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	79%	0.785	S	S	*	*			cis	-166.5	148.6	43.7	42.2	0	0	0	0	114.3
761	N	29.2	Very low	30.5	Very low	141 Å²	141	152.2 Å²	152.2	75%	0.754	77%	0.774	S	S	*	*			trans	44.3	154.8	143	-59.1	-24.4	0	0	0	123.8
762	I	30.9	Very low	31	Very low	177 Å²	177	150.4 Å²	150.4	91%	0.908	76%	0.759	S	S	*	*			trans	79.8	130.4	174.1	-52.1	159.6	0	0	0	112.3
763	A	29.3	Very low	31.6	Very low	91 Å²	91	144.3 Å²	144.3	75%	0.752	74%	0.735	S	S	*	*			cis	-135.9	-176.3	9.4	0	0	0	0	0	114.7
764	K	31.1	Very low	32.4	Very low	200 Å²	200	138 Å²	138	87%	0.87	71%	0.709	S	S	*	*			trans	-98.5	159.8	162.1	-75.5	174.2	-176.8	169.7	0	108
765	P	31.1	Very low	33	Very low	116 Å²	116	136.8 Å²	136.8	75%	0.753	69%	0.694	S	S	*	*			cis	-145.1	151.9	40.9	39.9	-20.2	0	0	0	118.5
766	A	28.8	Very low	33.7	Very low	56 Å²	56	130.2 Å²	130.2	46%	0.463	67%	0.666	S	S	.	*			trans	-157.8	59.1	167.4	0	0	0	0	0	112.8	R768 L773	A766-R768 PolarHBondContact O-N 3.46Å; A766-L773 HydrophobicContact CB-CD1 3.64Å
767	Q	29.6	Very low	34.3	Very low	195 Å²	195	129.5 Å²	129.5	91%	0.911	66%	0.657	S	S	*	*			trans	-85.5	106.5	175.1	-80.4	-177.6	-42.4	0	0	112.1
768	R	35	Very low	35.2	Very low	252 Å²	252	130.3 Å²	130.3	95%	0.951	65%	0.649	S	S	*	*	S	Bend	trans	-171.5	-11.5	140	-111.4	171.3	-177.1	-177.5	0.7	116.1	A766	A766-R768 PolarHBondContact O-N 3.46Å
769	N	38	Very low	35.8	Very low	82 Å²	82	129.5 Å²	129.5	44%	0.439	64%	0.64	S	S	.	*			trans	-148.5	115.6	172.6	-175.2	-34.8	0	0	0	110.6	L771 L772 L773	N769-L771 PolarHBondContact O-N 3.08Å; N769-L771 WeakPolarHBondContact OD1-CA 3.01Å; N769-L771 VanDerWaalsContact OD1-CB 3.23Å; N769-L771 WeakPolarHBondContact OD1-CB 3.3Å; N769-L771 PolarHBondContact OD1-N 3.38Å; N769-L772 HydrophobicContact CB-CB 4.03Å; N769-L772 HydrophobicContact CB-CD1 3.95Å; N769-L772 HydrophobicContact CB-CG 3.91Å; N769-L772 PolarHBondContact O-N 3.21Å; N769-L772 VanDerWaalsContact O-N 3.16Å; N769-L772 PolarHBondContact OD1-N 3.47Å; N769-L773 PolarHBondContact O-N 2.84Å
770	I	38.8	Very low	36.4	Very low	138 Å²	138	125.8 Å²	125.8	71%	0.708	62%	0.622	S	S	*	*	H	α-helix	trans	-65.6	-27.5	-176	-137	167.1	0	0	0	112.1	L773 V774	I770-L773 PolarHBondContact O-N 3.1Å; I770-V774 WeakPolarHBondContact O-CB 3.33Å; I770-V774 VanDerWaalsContact O-CG2 3.31Å; I770-V774 WeakPolarHBondContact O-CG2 3.26Å; I770-V774 PolarHBondContact O-N 2.89Å
771	L	35.8	Very low	36.8	Very low	112 Å²	112	130.2 Å²	130.2	59%	0.586	63%	0.629	S	S	*	*	H	α-helix	trans	-75.9	-33.5	176.7	-147.2	77.6	0	0	0	111.9	N769 R775	N769-L771 PolarHBondContact O-N 3.08Å; N769-L771 WeakPolarHBondContact OD1-CA 3.01Å; N769-L771 VanDerWaalsContact OD1-CB 3.23Å; N769-L771 WeakPolarHBondContact OD1-CB 3.3Å; N769-L771 PolarHBondContact OD1-N 3.38Å; L771-R775 WeakPolarHBondContact O-CB 3.04Å; L771-R775 PolarHBondContact O-N 2.69Å
772	L	39.6	Very low	37.4	Very low	106 Å²	106	131.7 Å²	131.7	56%	0.555	62%	0.624	S	S	*	*	H	α-helix	trans	-70.5	-40	169.2	-67.1	-177.6	0	0	0	111.2	N769 V774 R775 H776	N769-L772 HydrophobicContact CB-CB 4.03Å; N769-L772 HydrophobicContact CB-CD1 3.95Å; N769-L772 HydrophobicContact CB-CG 3.91Å; N769-L772 PolarHBondContact O-N 3.21Å; N769-L772 VanDerWaalsContact O-N 3.16Å; N769-L772 PolarHBondContact OD1-N 3.47Å; L772-V774 VanDerWaalsContact C-N 3.33Å; L772-V774 PolarHBondContact O-N 2.89Å; L772-R775 PolarHBondContact O-N 2.85Å; L772-H776 VanDerWaalsContact O-CB 3.28Å; L772-H776 WeakPolarHBondContact O-CB 3.32Å; L772-H776 PolarHBondContact O-N 2.74Å
773	L	37.1	Very low	38.4	Very low	61 Å²	61	131.1 Å²	131.1	32%	0.319	62%	0.618	S	S	.	*	H	α-helix	trans	-59.3	-44.1	174.5	-170.6	68.7	0	0	0	111.2	A766 N769 I770 H776 Y777	A766-L773 HydrophobicContact CB-CD1 3.64Å; N769-L773 PolarHBondContact O-N 2.84Å; I770-L773 PolarHBondContact O-N 3.1Å; L773-H776 PolarHBondContact O-N 3.1Å; L773-Y777 WeakPolarHBondContact O-CB 3.03Å; L773-Y777 PolarHBondContact O-N 3.15Å
774	V	45.6	Very low	39.6	Very low	60 Å²	60	131.2 Å²	131.2	36%	0.364	61%	0.605	S	S	.	*	H	α-helix	trans	-67.8	-36.9	174.6	169.4	0	0	0	0	112.3	I770 L772 R778	I770-V774 WeakPolarHBondContact O-CB 3.33Å; I770-V774 VanDerWaalsContact O-CG2 3.31Å; I770-V774 WeakPolarHBondContact O-CG2 3.26Å; I770-V774 PolarHBondContact O-N 2.89Å; L772-V774 VanDerWaalsContact C-N 3.33Å; L772-V774 PolarHBondContact O-N 2.89Å; V774-R778 HydrophobicContact CG1-CG 4.44Å; V774-R778 VanDerWaalsContact O-CB 3.28Å; V774-R778 WeakPolarHBondContact O-CB 3.39Å; V774-R778 WeakPolarHBondContact O-CG 3.46Å; V774-R778 PolarHBondContact O-N 3.14Å
775	R	41.3	Very low	40.9	Very low	122 Å²	122	125.5 Å²	125.5	46%	0.46	58%	0.582	S	S	.	*	H	α-helix	trans	-65.7	-39.3	172.2	-89.5	-179.7	164.9	157.4	-3.4	112.4	L771 L772 R778 R779	L771-R775 WeakPolarHBondContact O-CB 3.04Å; L771-R775 PolarHBondContact O-N 2.69Å; L772-R775 PolarHBondContact O-N 2.85Å; R775-R778 PolarHBondContact O-N 3.37Å; R775-R779 WeakPolarHBondContact O-CG 3.34Å; R775-R779 PolarHBondContact O-N 3.03Å
776	H	41	Very low	42.8	Very low	73 Å²	73	122.2 Å²	122.2	34%	0.338	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-49.2	176.5	179.7	70.7	0	0	0	110.7	L772 L773 R778 R779 L780	L772-H776 VanDerWaalsContact O-CB 3.28Å; L772-H776 WeakPolarHBondContact O-CB 3.32Å; L772-H776 PolarHBondContact O-N 2.74Å; L773-H776 PolarHBondContact O-N 3.1Å; H776-R778 VanDerWaalsContact C-N 3.32Å; H776-R778 PolarHBondContact O-N 2.89Å; H776-R779 PolarHBondContact O-N 2.93Å; H776-L780 WeakPolarHBondContact O-CG 3.04Å; H776-L780 PolarHBondContact O-N 3.46Å
777	Y	40.1	Very low	44.8	Very low	158 Å²	158	124.7 Å²	124.7	62%	0.62	56%	0.564	S	S	*	*	H	α-helix	trans	-56.2	-42.1	170.6	-107.9	-90.3	0	0	0	112.7	L773 R779 L780 K781	L773-Y777 WeakPolarHBondContact O-CB 3.03Å; L773-Y777 PolarHBondContact O-N 3.15Å; Y777-R779 VanDerWaalsContact C-N 3.3Å; Y777-R779 PolarHBondContact O-N 3.42Å; Y777-L780 PolarHBondContact O-N 3.29Å; Y777-K781 WeakPolarHBondContact O-CB 3.43Å; Y777-K781 PolarHBondContact O-N 2.99Å
778	R	46.7	Very low	47.2	Very low	185 Å²	185	115.5 Å²	115.5	70%	0.698	52%	0.521	S	S	*	.	H	α-helix	trans	-68.8	-23.3	176.9	-75.7	172.9	179.3	178.6	0.2	113.9	V774 R775 H776	V774-R778 HydrophobicContact CG1-CG 4.44Å; V774-R778 VanDerWaalsContact O-CB 3.28Å; V774-R778 WeakPolarHBondContact O-CB 3.39Å; V774-R778 WeakPolarHBondContact O-CG 3.46Å; V774-R778 PolarHBondContact O-N 3.14Å; R775-R778 PolarHBondContact O-N 3.37Å; H776-R778 VanDerWaalsContact C-N 3.32Å; H776-R778 PolarHBondContact O-N 2.89Å
779	R	42	Very low	49	Very low	141 Å²	141	108.1 Å²	108.1	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-79.8	-40.4	170.6	-75.9	177.7	173.7	-175.7	-3.9	111.7	R775 H776 Y777 H785	R775-R779 WeakPolarHBondContact O-CG 3.34Å; R775-R779 PolarHBondContact O-N 3.03Å; H776-R779 PolarHBondContact O-N 2.93Å; Y777-R779 VanDerWaalsContact C-N 3.3Å; Y777-R779 PolarHBondContact O-N 3.42Å; R779-H785 PolarHBondContact O-CE1 3.09Å; R779-H785 PolarHBondContact O-ND1 2.6Å
780	L	41.6	Very low	50.5	Low	79 Å²	79	106.6 Å²	106.6	41%	0.414	50%	0.498	S	S	.	.	H	α-helix	trans	-68	-37.4	176.3	-73.1	165.3	0	0	0	113.1	H776 Y777 R782 Y794	H776-L780 WeakPolarHBondContact O-CG 3.04Å; H776-L780 PolarHBondContact O-N 3.46Å; Y777-L780 PolarHBondContact O-N 3.29Å; L780-R782 PolarHBondContact O-N 2.04Å; L780-Y794 HydrophobicContact CD2-CD1 4.48Å; L780-Y794 HydrophobicContact CD2-CE1 3.85Å
781	K	41	Very low	51.7	Low	189 Å²	189	103.8 Å²	103.8	82%	0.822	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	17.1	-177	-132.1	-169.5	-172.9	-164.2	0	115	Y777	Y777-K781 WeakPolarHBondContact O-CB 3.43Å; Y777-K781 PolarHBondContact O-N 2.99Å
782	R	42	Very low	52.6	Low	172 Å²	172	104.7 Å²	104.7	65%	0.649	50%	0.495	S	S	*	.	S	Bend	trans	-125.4	131.5	168.9	-68.4	-175.3	171.5	-173.6	-4.8	108.2	L780 L784	L780-R782 PolarHBondContact O-N 2.04Å; R782-L784 HydrophobicContact CB-CB 4.41Å; R782-L784 HydrophobicContact CB-CD1 3.89Å; R782-L784 HydrophobicContact CB-CG 3.99Å; R782-L784 HydrophobicContact CG-CD1 4.44Å; R782-L784 PolarHBondContact O-N 3.45Å
783	Q	51.5	Low	54.2	Low	165 Å²	165	102.5 Å²	102.5	77%	0.771	48%	0.482	S	S	*	.	S	Bend	trans	-68.7	34	177	-61.6	-178.3	-11.7	0	0	113.7	K797	Q783-K797 WeakPolarHBondContact O-CD 3.02Å
784	L	53	Low	55.9	Low	94 Å²	94	103.5 Å²	103.5	49%	0.492	48%	0.482	S	S	.	.			trans	-91.9	3.7	-173.2	-70.8	173.7	0	0	0	112.9	R782 G796 K797	R782-L784 HydrophobicContact CB-CB 4.41Å; R782-L784 HydrophobicContact CB-CD1 3.89Å; R782-L784 HydrophobicContact CB-CG 3.99Å; R782-L784 HydrophobicContact CG-CD1 4.44Å; R782-L784 PolarHBondContact O-N 3.45Å; L784-G796 CarbonylContact O-C 3.56Å; L784-G796 WeakPolarHBondContact O-CA 3.49Å; L784-K797 PolarHBondContact O-N 2.75Å
785	H	58.4	Low	57.6	Low	80 Å²	80	100.7 Å²	100.7	37%	0.37	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.8	-167.7	-52.1	103.9	0	0	0	114.9	R779 C795	R779-H785 PolarHBondContact O-CE1 3.09Å; R779-H785 PolarHBondContact O-ND1 2.6Å; H785-C795 CarbonylContact C-O 3.3Å; H785-C795 WeakPolarHBondContact CA-O 3.4Å; H785-C795 WeakPolarHBondContact CB-O 3.46Å
786	T	71.1	Confident	59.1	Low	47 Å²	47	95.7 Å²	95.7	29%	0.288	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.5	163.4	-58.6	0	0	0	0	108.3	Y794 C795 G796 E799	T786-Y794 CarbonylContact O-C 3.53Å; T786-Y794 WeakPolarHBondContact O-CA 3.49Å; T786-C795 PolarHBondContact N-O 2.74Å; T786-C795 PolarHBondContact O-N 2.98Å; T786-G796 PolarHBondContact OG1-O 3Å; T786-E799 WeakPolarHBondContact CB-O 3.45Å; T786-E799 PolarHBondContact OG1-O 3.49Å
787	I	71.6	Confident	60.4	Low	107 Å²	107	98.8 Å²	98.8	55%	0.549	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.4	179.3	-51.3	178.7	0	0	0	109.2	Y794	I787-Y794 HydrophobicContact CB-CD1 4.45Å; I787-Y794 HydrophobicContact CG1-CD1 4.12Å; I787-Y794 HydrophobicContact CG1-CE1 4.37Å; I787-Y794 HydrophobicContact CG2-CD1 4.18Å; I787-Y794 HydrophobicContact CG2-CE1 4.04Å
788	C	79.3	Confident	62.2	Low	2 Å²	2	95.4 Å²	95.4	1%	0.014	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-85.5	155	177.6	-54.7	0	0	0	0	112.3	D790 S791 H793 C795 C801 Y809	C788-D790 PolarHBondContact O-N 3.36Å; C788-S791 PolarHBondContact O-N 2.86Å; C788-H793 HydrophobicContact CB-CB 3.83Å; C788-H793 WeakPolarHBondContact CB-O 3.48Å; C788-H793 PolarHBondContact N-O 3.35Å; C788-C795 VanDerWaalsContact SG-SG 3.64Å; C788-C801 WeakPolarHBondContact CA-SG 3.16Å; C788-C801 HydrophobicContact CB-CB 3.71Å; C788-C801 WeakPolarHBondContact CB-SG 3.25Å; C788-C801 WeakPolarHBondContact SG-CB 3.46Å; C788-C801 CovalentContact SG-SG 2.04Å; C788-C801 PolarHBondContact SG-SG 2.91Å; C788-Y809 HydrophobicContact CB-CD1 4.11Å; C788-Y809 HydrophobicContact CB-CD2 4Å; C788-Y809 HydrophobicContact CB-CG 3.71Å
789	P	74.5	Confident	64.1	Low	98 Å²	98	89.8 Å²	89.8	64%	0.636	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.6	-175.6	-26.7	33.4	0	0	0	116.5	S791 Y809	P789-S791 VanDerWaalsContact C-N 3.28Å; P789-Y809 HydrophobicContact CB-CE2 4.35Å; P789-Y809 WeakPolarHBondContact CB-OH 2.99Å; P789-Y809 HydrophobicContact CG-CE1 3.99Å
790	D	68.7	Low	66.2	Low	50 Å²	50	85.2 Å²	85.2	27%	0.267	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.9	173.8	67.6	-1	0	0	0	114.1	C788 L792 H793 Y809	C788-D790 PolarHBondContact O-N 3.36Å; D790-L792 PolarHBondContact O-N 3.33Å; D790-L792 VanDerWaalsContact O-N 3.1Å; D790-L792 PolarHBondContact OD1-N 3.37Å; D790-H793 PolarHBondContact OD1-N 2.95Å; D790-H793 IonicContact OD1-ND1 3.83Å; D790-H793 IonicContact OD2-CE1 2.69Å; D790-H793 IonicContact OD2-CG 3.75Å; D790-H793 IonicContact OD2-ND1 2.65Å; D790-H793 PolarHBondContact OD2-ND1 2.02Å; D790-Y809 HydrophobicContact CB-CD2 3.99Å; D790-Y809 HydrophobicContact CB-CE2 3.88Å
791	S	63.6	Low	68.4	Low	79 Å²	79	82.9 Å²	82.9	55%	0.552	42%	0.419	S	S	*	.	S	Bend	trans	57.9	10.6	-171.1	-54.8	0	0	0	0	115.5	C788 P789 Y794	C788-S791 PolarHBondContact O-N 2.86Å; P789-S791 VanDerWaalsContact C-N 3.28Å; S791-Y794 PolarHBondContact O-OH 2.79Å; S791-Y794 VanDerWaalsContact O-OH 3.12Å
792	L	55.9	Low	70.6	Confident	131 Å²	131	74 Å²	74	69%	0.686	38%	0.381	S	S	*	.	S	Bend	trans	-104.1	-31.2	178.1	-64.2	167.7	0	0	0	111.5	D790 Y794	D790-L792 PolarHBondContact O-N 3.33Å; D790-L792 VanDerWaalsContact O-N 3.1Å; D790-L792 PolarHBondContact OD1-N 3.37Å; L792-Y794 WeakPolarHBondContact O-CE2 3.44Å
793	H	73	Confident	72.3	Confident	60 Å²	60	69.3 Å²	69.3	28%	0.278	37%	0.369	S	S	.	.			trans	-102.2	145.9	179.9	-70.2	86.8	0	0	0	113.1	C788 D790 F807	C788-H793 HydrophobicContact CB-CB 3.83Å; C788-H793 WeakPolarHBondContact CB-O 3.48Å; C788-H793 PolarHBondContact N-O 3.35Å; D790-H793 PolarHBondContact OD1-N 2.95Å; D790-H793 IonicContact OD1-ND1 3.83Å; D790-H793 IonicContact OD2-CE1 2.69Å; D790-H793 IonicContact OD2-CG 3.75Å; D790-H793 IonicContact OD2-ND1 2.65Å; D790-H793 PolarHBondContact OD2-ND1 2.02Å; H793-F807 PolarHBondContact CE1-O 3.4Å; H793-F807 PolarHBondContact NE2-O 2.77Å
794	Y	73.2	Confident	73.2	Confident	81 Å²	81	61.7 Å²	61.7	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	121.8	-178.6	-47.7	-84.6	0	0	0	109	L780 T786 I787 S791 L792	L780-Y794 HydrophobicContact CD2-CD1 4.48Å; L780-Y794 HydrophobicContact CD2-CE1 3.85Å; T786-Y794 CarbonylContact O-C 3.53Å; T786-Y794 WeakPolarHBondContact O-CA 3.49Å; I787-Y794 HydrophobicContact CB-CD1 4.45Å; I787-Y794 HydrophobicContact CG1-CD1 4.12Å; I787-Y794 HydrophobicContact CG1-CE1 4.37Å; I787-Y794 HydrophobicContact CG2-CD1 4.18Å; I787-Y794 HydrophobicContact CG2-CE1 4.04Å; S791-Y794 PolarHBondContact O-OH 2.79Å; S791-Y794 VanDerWaalsContact O-OH 3.12Å; L792-Y794 WeakPolarHBondContact O-CE2 3.44Å
795	C	79.9	Confident	73.6	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	168	174.9	-53.9	0	0	0	0	110	H785 T786 C788 E799 C811	H785-C795 CarbonylContact C-O 3.3Å; H785-C795 WeakPolarHBondContact CA-O 3.4Å; H785-C795 WeakPolarHBondContact CB-O 3.46Å; T786-C795 PolarHBondContact N-O 2.74Å; T786-C795 PolarHBondContact O-N 2.98Å; C788-C795 VanDerWaalsContact SG-SG 3.64Å; C795-E799 HydrophobicContact CB-CB 3.75Å; C795-C811 WeakPolarHBondContact CA-SG 3.47Å; C795-C811 HydrophobicContact CB-CB 3.5Å; C795-C811 VanDerWaalsContact CB-CB 3.5Å; C795-C811 WeakPolarHBondContact CB-SG 3.42Å; C795-C811 WeakPolarHBondContact SG-CA 3.35Å; C795-C811 WeakPolarHBondContact SG-CB 3.39Å; C795-C811 CovalentContact SG-SG 2.03Å; C795-C811 PolarHBondContact SG-SG 3.42Å
796	G	73.5	Confident	73.7	Confident	16 Å²	16	65.9 Å²	65.9	17%	0.165	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	162.3	174	0	0	0	0	0	113.8	L784 T786 S798 E799	L784-G796 CarbonylContact O-C 3.56Å; L784-G796 WeakPolarHBondContact O-CA 3.49Å; T786-G796 PolarHBondContact OG1-O 3Å; G796-S798 PolarHBondContact O-N 3.05Å; G796-E799 PolarHBondContact N-OE2 2.77Å; G796-E799 WeakPolarHBondContact O-CA 3.08Å; G796-E799 WeakPolarHBondContact O-CB 3.33Å; G796-E799 PolarHBondContact O-N 3.4Å
797	K	68.9	Low	73.3	Confident	138 Å²	138	68.1 Å²	68.1	60%	0.6	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-24.2	174.8	-165.4	-174.6	-169.9	169.8	0	112.7	Q783 L784 E799	Q783-K797 WeakPolarHBondContact O-CD 3.02Å; L784-K797 PolarHBondContact O-N 2.75Å; K797-E799 VanDerWaalsContact C-N 3.3Å
798	S	77	Confident	73.4	Confident	88 Å²	88	64.7 Å²	64.7	62%	0.615	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	7.8	173.3	49.9	0	0	0	0	113.6	G796 N814	G796-S798 PolarHBondContact O-N 3.05Å; S798-N814 VanDerWaalsContact O-CB 3.28Å; S798-N814 WeakPolarHBondContact O-CB 3.02Å; S798-N814 PolarHBondContact O-N 2.86Å
799	E	86.5	Confident	73.4	Confident	67 Å²	67	66.8 Å²	66.8	31%	0.313	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.5	-172.5	-62.4	170.4	-177.6	0	0	111.3	T786 C795 G796 K797 C811 T812	T786-E799 WeakPolarHBondContact CB-O 3.45Å; T786-E799 PolarHBondContact OG1-O 3.49Å; C795-E799 HydrophobicContact CB-CB 3.75Å; G796-E799 PolarHBondContact N-OE2 2.77Å; G796-E799 WeakPolarHBondContact O-CA 3.08Å; G796-E799 WeakPolarHBondContact O-CB 3.33Å; G796-E799 PolarHBondContact O-N 3.4Å; K797-E799 VanDerWaalsContact C-N 3.3Å; E799-C811 WeakPolarHBondContact OE2-CB 3.38Å; E799-T812 CarbonylContact C-O 3.59Å; E799-T812 WeakPolarHBondContact CA-O 3.38Å; E799-T812 VanDerWaalsContact CB-O 3.27Å; E799-T812 WeakPolarHBondContact CB-O 3.33Å
800	Q	86.9	Confident	73.8	Confident	45 Å²	45	63.8 Å²	63.8	21%	0.21	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	161.1	176.9	66.9	-172.4	12.5	0	0	109.9	T812 S816	Q800-T812 WeakPolarHBondContact CG-OG1 3.02Å; Q800-T812 PolarHBondContact N-O 3.28Å; Q800-T812 PolarHBondContact NE2-OG1 3.44Å; Q800-T812 PolarHBondContact O-N 3.1Å; Q800-T812 PolarHBondContact O-OG1 2.04Å; Q800-S816 PolarHBondContact NE2-O 3.12Å; Q800-S816 PolarHBondContact NE2-OG 2.95Å
801	C	86.8	Confident	74.6	Confident	29 Å²	29	63.5 Å²	63.5	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114	179.1	-58.1	0	0	0	0	110.9	C788 Y809	C788-C801 WeakPolarHBondContact CA-SG 3.16Å; C788-C801 HydrophobicContact CB-CB 3.71Å; C788-C801 WeakPolarHBondContact CB-SG 3.25Å; C788-C801 WeakPolarHBondContact SG-CB 3.46Å; C788-C801 CovalentContact SG-SG 2.04Å; C788-C801 PolarHBondContact SG-SG 2.91Å; C801-Y809 HydrophobicContact CB-CD1 3.82Å; C801-Y809 HydrophobicContact CB-CG 4.48Å
802	C	86.8	Confident	75.7	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.02	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	152.3	164.3	-66.1	0	0	0	0	110	Y809 T810 T812 C818	C802-Y809 CarbonylContact O-C 3.37Å; C802-Y809 VanDerWaalsContact O-CA 3.3Å; C802-Y809 WeakPolarHBondContact O-CA 3Å; C802-Y809 WeakPolarHBondContact O-CD1 3.07Å; C802-T810 HydrophobicContact CB-CG2 3.99Å; C802-T810 PolarHBondContact N-O 2.92Å; C802-T810 PolarHBondContact O-N 2.84Å; C802-T812 HydrophobicContact CB-CG2 4Å; C802-T812 VanDerWaalsContact SG-CG2 3.53Å; C802-T812 PolarHBondContact SG-OG1 2.73Å; C802-C818 WeakPolarHBondContact CA-SG 3.34Å; C802-C818 HydrophobicContact CB-CB 3.68Å; C802-C818 WeakPolarHBondContact CB-SG 2.96Å; C802-C818 VanDerWaalsContact SG-CA 3.54Å; C802-C818 WeakPolarHBondContact SG-CB 3.44Å; C802-C818 CovalentContact SG-SG 2.03Å; C802-C818 PolarHBondContact SG-SG 3.16Å
803	L	77.5	Confident	77.1	Confident	74 Å²	74	57 Å²	57	39%	0.387	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	149.5	170.1	-121.3	78.1	0	0	0	110.4	Y809	L803-Y809 HydrophobicContact CD1-CD1 4.43Å; L803-Y809 HydrophobicContact CD1-CE1 3.58Å
804	S	70.5	Confident	77.3	Confident	5 Å²	5	58.5 Å²	58.5	4%	0.035	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	125.1	172.8	168.5	0	0	0	0	110	K806 F807 G808 D824	S804-K806 PolarHBondContact O-N 3.16Å; S804-K806 PolarHBondContact OG-N 2.74Å; S804-F807 PolarHBondContact OG-N 2.99Å; S804-G808 PolarHBondContact N-O 3.07Å; S804-G808 CarbonylContact O-C 3.53Å; S804-G808 WeakPolarHBondContact O-CA 3.22Å; S804-G808 PolarHBondContact O-N 3.26Å; S804-D824 WeakPolarHBondContact CA-OD1 3.25Å; S804-D824 VanDerWaalsContact CB-OD1 3.29Å; S804-D824 WeakPolarHBondContact CB-OD1 3.37Å; S804-D824 PolarHBondContact OG-OD1 2.83Å
805	N	63	Low	77.7	Confident	109 Å²	109	62 Å²	62	58%	0.583	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.3	174.9	-100.1	-11	0	0	0	112.8	N822 D824	N805-N822 VanDerWaalsContact ND2-CA 3.31Å; N805-N822 WeakPolarHBondContact ND2-CA 3.33Å; N805-N822 PolarHBondContact ND2-O 3.11Å; N805-N822 PolarHBondContact ND2-OD1 2.88Å; N805-D824 PolarHBondContact N-OD1 2.84Å
806	K	59.6	Low	78	Confident	153 Å²	153	62.6 Å²	62.6	67%	0.665	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-29	-178.4	-168	172.8	-179.9	178.9	0	113.5	S804 D824	S804-K806 PolarHBondContact O-N 3.16Å; S804-K806 PolarHBondContact OG-N 2.74Å; K806-D824 VanDerWaalsContact CB-OD2 3.28Å; K806-D824 WeakPolarHBondContact CB-OD2 3.08Å
807	F	62.4	Low	78.6	Confident	93 Å²	93	64.3 Å²	64.3	41%	0.408	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-5.5	-174	-55.8	-68	0	0	0	114.4	H793 S804 Y809	H793-F807 PolarHBondContact CE1-O 3.4Å; H793-F807 PolarHBondContact NE2-O 2.77Å; S804-F807 PolarHBondContact OG-N 2.99Å; F807-Y809 VanDerWaalsContact C-N 3.25Å; F807-Y809 PolarHBondContact O-N 2.97Å
808	G	74.1	Confident	79.5	Confident	35 Å²	35	60.3 Å²	60.3	36%	0.361	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	87.5	-60	-170.3	0	0	0	0	0	111	S804	S804-G808 PolarHBondContact N-O 3.07Å; S804-G808 CarbonylContact O-C 3.53Å; S804-G808 WeakPolarHBondContact O-CA 3.22Å; S804-G808 PolarHBondContact O-N 3.26Å
809	Y	79.2	Confident	79.6	Confident	46 Å²	46	56.4 Å²	56.4	18%	0.18	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149	170.9	-73	-87.1	0	0	0	112.1	C788 P789 D790 C801 C802 L803 F807	C788-Y809 HydrophobicContact CB-CD1 4.11Å; C788-Y809 HydrophobicContact CB-CD2 4Å; C788-Y809 HydrophobicContact CB-CG 3.71Å; P789-Y809 HydrophobicContact CB-CE2 4.35Å; P789-Y809 WeakPolarHBondContact CB-OH 2.99Å; P789-Y809 HydrophobicContact CG-CE1 3.99Å; D790-Y809 HydrophobicContact CB-CD2 3.99Å; D790-Y809 HydrophobicContact CB-CE2 3.88Å; C801-Y809 HydrophobicContact CB-CD1 3.82Å; C801-Y809 HydrophobicContact CB-CG 4.48Å; C802-Y809 CarbonylContact O-C 3.37Å; C802-Y809 VanDerWaalsContact O-CA 3.3Å; C802-Y809 WeakPolarHBondContact O-CA 3Å; C802-Y809 WeakPolarHBondContact O-CD1 3.07Å; L803-Y809 HydrophobicContact CD1-CD1 4.43Å; L803-Y809 HydrophobicContact CD1-CE1 3.58Å; F807-Y809 VanDerWaalsContact C-N 3.25Å; F807-Y809 PolarHBondContact O-N 2.97Å
810	T	82.7	Confident	78.7	Confident	35 Å²	35	55.7 Å²	55.7	22%	0.215	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	155.8	171.6	-170.3	0	0	0	0	110.5	C802 T812	C802-T810 HydrophobicContact CB-CG2 3.99Å; C802-T810 PolarHBondContact N-O 2.92Å; C802-T810 PolarHBondContact O-N 2.84Å; T810-T812 HydrophobicContact CG2-CG2 4.21Å
811	C	85.4	Confident	77.2	Confident	44 Å²	44	57.5 Å²	57.5	30%	0.297	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.3	-171	-63.4	0	0	0	0	111	C795 E799	C795-C811 WeakPolarHBondContact CA-SG 3.47Å; C795-C811 HydrophobicContact CB-CB 3.5Å; C795-C811 VanDerWaalsContact CB-CB 3.5Å; C795-C811 WeakPolarHBondContact CB-SG 3.42Å; C795-C811 WeakPolarHBondContact SG-CA 3.35Å; C795-C811 WeakPolarHBondContact SG-CB 3.39Å; C795-C811 CovalentContact SG-SG 2.03Å; C795-C811 PolarHBondContact SG-SG 3.42Å; E799-C811 WeakPolarHBondContact OE2-CB 3.38Å
812	T	87	Confident	75.6	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152.4	-170.4	67.7	0	0	0	0	110.4	E799 Q800 C802 T810 N814 S816 Y826	E799-T812 CarbonylContact C-O 3.59Å; E799-T812 WeakPolarHBondContact CA-O 3.38Å; E799-T812 VanDerWaalsContact CB-O 3.27Å; E799-T812 WeakPolarHBondContact CB-O 3.33Å; Q800-T812 WeakPolarHBondContact CG-OG1 3.02Å; Q800-T812 PolarHBondContact N-O 3.28Å; Q800-T812 PolarHBondContact NE2-OG1 3.44Å; Q800-T812 PolarHBondContact O-N 3.1Å; Q800-T812 PolarHBondContact O-OG1 2.04Å; C802-T812 HydrophobicContact CB-CG2 4Å; C802-T812 VanDerWaalsContact SG-CG2 3.53Å; C802-T812 PolarHBondContact SG-OG1 2.73Å; T810-T812 HydrophobicContact CG2-CG2 4.21Å; T812-N814 PolarHBondContact O-N 3.37Å; T812-S816 WeakPolarHBondContact CB-OG 3.32Å; T812-S816 PolarHBondContact OG1-OG 3.17Å; T812-S816 VanDerWaalsContact OG1-OG 3.07Å; T812-Y826 HydrophobicContact CG2-CD1 3.42Å; T812-Y826 VanDerWaalsContact CG2-CD1 3.42Å; T812-Y826 HydrophobicContact CG2-CD2 4.04Å; T812-Y826 HydrophobicContact CG2-CE1 4.02Å; T812-Y826 HydrophobicContact CG2-CG 3.43Å; T812-Y826 VanDerWaalsContact CG2-CG 3.43Å
813	P	84.7	Confident	74.2	Confident	73 Å²	73	63.5 Å²	63.5	47%	0.474	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	135.5	179.2	-25.4	35	0	0	0	111.3	K815 S816 Y826	P813-K815 PolarHBondContact O-N 2.04Å; P813-S816 VanDerWaalsContact O-CB 3.29Å; P813-S816 WeakPolarHBondContact O-CB 3.38Å; P813-S816 PolarHBondContact O-N 3.06Å; P813-S816 PolarHBondContact O-OG 3.16Å; P813-Y826 HydrophobicContact CG-CE2 4.43Å
814	N	78.1	Confident	73.7	Confident	92 Å²	92	63.2 Å²	63.2	49%	0.492	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	135.2	179.6	-170.8	-21.6	0	0	0	110.1	S798 T812	S798-N814 VanDerWaalsContact O-CB 3.28Å; S798-N814 WeakPolarHBondContact O-CB 3.02Å; S798-N814 PolarHBondContact O-N 2.86Å; T812-N814 PolarHBondContact O-N 3.37Å
815	K	81.5	Confident	73.8	Confident	153 Å²	153	64.7 Å²	64.7	67%	0.665	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	14	-168.9	-42.1	178.6	-177.5	-179.1	0	116.8	P813 I829	P813-K815 PolarHBondContact O-N 2.04Å; K815-I829 HydrophobicContact CB-CD1 4.16Å; K815-I829 HydrophobicContact CD-CD1 4.5Å; K815-I829 WeakPolarHBondContact O-CB 3.47Å
816	S	85.3	Confident	74.9	Confident	16 Å²	16	64.5 Å²	64.5	11%	0.112	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75	165.8	162.6	55.9	0	0	0	0	111.4	Q800 T812 P813 C827	Q800-S816 PolarHBondContact NE2-O 3.12Å; Q800-S816 PolarHBondContact NE2-OG 2.95Å; T812-S816 WeakPolarHBondContact CB-OG 3.32Å; T812-S816 PolarHBondContact OG1-OG 3.17Å; T812-S816 VanDerWaalsContact OG1-OG 3.07Å; P813-S816 VanDerWaalsContact O-CB 3.29Å; P813-S816 WeakPolarHBondContact O-CB 3.38Å; P813-S816 PolarHBondContact O-N 3.06Å; P813-S816 PolarHBondContact O-OG 3.16Å; S816-C827 CarbonylContact C-O 3.55Å; S816-C827 VanDerWaalsContact CA-O 3.31Å; S816-C827 WeakPolarHBondContact CA-O 3.39Å; S816-C827 WeakPolarHBondContact CB-O 3.26Å
817	I	86.8	Confident	76.3	Confident	52 Å²	52	57.2 Å²	57.2	27%	0.267	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.7	176.2	-54.3	-176.4	0	0	0	108.7	Y826 C827 K831 D832	I817-Y826 CarbonylContact O-C 3.27Å; I817-Y826 WeakPolarHBondContact O-CA 3.32Å; I817-C827 HydrophobicContact CB-CB 4.44Å; I817-C827 PolarHBondContact N-O 2.88Å; I817-C827 PolarHBondContact O-N 2.03Å; I817-K831 WeakPolarHBondContact CD1-O 3.38Å; I817-D832 VanDerWaalsContact CD1-OD1 3.31Å; I817-D832 WeakPolarHBondContact CD1-OD1 3.02Å
818	C	87.2	Confident	77.3	Confident	53 Å²	53	55 Å²	55	36%	0.358	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	122.2	173.8	-55.8	0	0	0	0	110.4	C802 G820	C802-C818 WeakPolarHBondContact CA-SG 3.34Å; C802-C818 HydrophobicContact CB-CB 3.68Å; C802-C818 WeakPolarHBondContact CB-SG 2.96Å; C802-C818 VanDerWaalsContact SG-CA 3.54Å; C802-C818 WeakPolarHBondContact SG-CB 3.44Å; C802-C818 CovalentContact SG-SG 2.03Å; C802-C818 PolarHBondContact SG-SG 3.16Å; C818-G820 VanDerWaalsContact C-N 3.35Å; C818-G820 PolarHBondContact O-N 2.83Å
819	C	79.6	Confident	77.7	Confident	6 Å²	6	58.3 Å²	58.3	4%	0.041	33%	0.327	C	S	.	.			trans	-85.6	70.2	-172.5	-62.9	0	0	0	0	114.2	T825 C827 C833 G837	C819-T825 HydrophobicContact CB-CG2 4.24Å; C819-T825 WeakPolarHBondContact CB-O 3.08Å; C819-T825 PolarHBondContact N-O 3.24Å; C819-C827 PolarHBondContact SG-SG 2.85Å; C819-C833 WeakPolarHBondContact CA-SG 3.39Å; C819-C833 HydrophobicContact CB-CB 3.77Å; C819-C833 WeakPolarHBondContact CB-SG 3.33Å; C819-C833 WeakPolarHBondContact SG-CB 3.24Å; C819-C833 CovalentContact SG-SG 2.04Å; C819-C833 PolarHBondContact SG-SG 2.92Å; C819-G837 WeakPolarHBondContact CB-O 3.35Å
820	G	67.1	Low	78.1	Confident	52 Å²	52	63.4 Å²	63.4	54%	0.536	35%	0.347	S	S	.	.			trans	76.2	175.1	170.1	0	0	0	0	0	114.8	C818 N822	C818-G820 VanDerWaalsContact C-N 3.35Å; C818-G820 PolarHBondContact O-N 2.83Å; G820-N822 PolarHBondContact O-N 2.81Å; G820-N822 VanDerWaalsContact O-N 3.16Å
821	S	56.5	Low	78.4	Confident	83 Å²	83	63.9 Å²	63.9	58%	0.58	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	8.2	-171.2	50.3	0	0	0	0	115.4
822	N	52.4	Low	78.4	Confident	95 Å²	95	65 Å²	65	51%	0.508	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.2	-4.1	-167.4	-95.2	-37.4	0	0	0	116.3	N805 G820	N805-N822 VanDerWaalsContact ND2-CA 3.31Å; N805-N822 WeakPolarHBondContact ND2-CA 3.33Å; N805-N822 PolarHBondContact ND2-O 3.11Å; N805-N822 PolarHBondContact ND2-OD1 2.88Å; G820-N822 PolarHBondContact O-N 2.81Å; G820-N822 VanDerWaalsContact O-N 3.16Å
823	M	58.5	Low	78.4	Confident	64 Å²	64	66.5 Å²	66.5	32%	0.315	36%	0.36	S	S	.	.			trans	-127.5	145.2	-170.1	-57.9	-60.2	167.7	0	0	111.9	T825 K838	M823-T825 PolarHBondContact O-N 3.01Å; M823-T825 VanDerWaalsContact O-N 3.11Å; M823-K838 HydrophobicContact SD-CG 4.41Å
824	D	65.2	Low	78.3	Confident	67 Å²	67	63.8 Å²	63.8	36%	0.358	34%	0.343	S	S	.	.	S	Bend	trans	-76.5	15.9	172.9	-64.5	-23.8	0	0	0	112.5	S804 N805 K806	S804-D824 WeakPolarHBondContact CA-OD1 3.25Å; S804-D824 VanDerWaalsContact CB-OD1 3.29Å; S804-D824 WeakPolarHBondContact CB-OD1 3.37Å; S804-D824 PolarHBondContact OG-OD1 2.83Å; N805-D824 PolarHBondContact N-OD1 2.84Å; K806-D824 VanDerWaalsContact CB-OD2 3.28Å; K806-D824 WeakPolarHBondContact CB-OD2 3.08Å
825	T	73.9	Confident	78.3	Confident	36 Å²	36	68.6 Å²	68.6	22%	0.221	37%	0.367	C	S	.	.			trans	-97.7	138.7	-169.8	-54.6	0	0	0	0	112.1	C819 M823 G837 K838	C819-T825 HydrophobicContact CB-CG2 4.24Å; C819-T825 WeakPolarHBondContact CB-O 3.08Å; C819-T825 PolarHBondContact N-O 3.24Å; M823-T825 PolarHBondContact O-N 3.01Å; M823-T825 VanDerWaalsContact O-N 3.11Å; T825-G837 WeakPolarHBondContact CB-O 3.44Å; T825-G837 WeakPolarHBondContact CG2-O 3.46Å; T825-G837 PolarHBondContact OG1-O 3.43Å; T825-K838 PolarHBondContact OG1-O 3.06Å
826	Y	85.7	Confident	77.8	Confident	106 Å²	106	64 Å²	64	42%	0.416	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.4	171.7	63.7	-84	0	0	0	110.9	T812 P813 I817	T812-Y826 HydrophobicContact CG2-CD1 3.42Å; T812-Y826 VanDerWaalsContact CG2-CD1 3.42Å; T812-Y826 HydrophobicContact CG2-CD2 4.04Å; T812-Y826 HydrophobicContact CG2-CE1 4.02Å; T812-Y826 HydrophobicContact CG2-CG 3.43Å; T812-Y826 VanDerWaalsContact CG2-CG 3.43Å; P813-Y826 HydrophobicContact CG-CE2 4.43Å; I817-Y826 CarbonylContact O-C 3.27Å; I817-Y826 WeakPolarHBondContact O-CA 3.32Å
827	C	88	Confident	77.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.3	-177.5	-61.2	0	0	0	0	112.5	S816 I817 C819 K831 C840	S816-C827 CarbonylContact C-O 3.55Å; S816-C827 VanDerWaalsContact CA-O 3.31Å; S816-C827 WeakPolarHBondContact CA-O 3.39Å; S816-C827 WeakPolarHBondContact CB-O 3.26Å; I817-C827 HydrophobicContact CB-CB 4.44Å; I817-C827 PolarHBondContact N-O 2.88Å; I817-C827 PolarHBondContact O-N 2.03Å; C819-C827 PolarHBondContact SG-SG 2.85Å; C827-K831 HydrophobicContact CB-CB 4.25Å; C827-C840 WeakPolarHBondContact CA-SG 3.42Å; C827-C840 HydrophobicContact CB-CB 3.79Å; C827-C840 WeakPolarHBondContact CB-SG 3.48Å; C827-C840 WeakPolarHBondContact SG-CA 3.27Å; C827-C840 WeakPolarHBondContact SG-CB 3.41Å; C827-C840 CovalentContact SG-SG 2.03Å; C827-C840 PolarHBondContact SG-SG 3.15Å
828	P	83.7	Confident	76.4	Confident	47 Å²	47	67.2 Å²	67.2	31%	0.305	36%	0.363	S	S	.	.			trans	-57.6	152.8	168.3	-21.8	32.8	0	0	0	111.5	Y830 K831	P828-Y830 HydrophobicContact CB-CD1 3.87Å; P828-Y830 HydrophobicContact CB-CD2 4.28Å; P828-Y830 HydrophobicContact CB-CE1 3.39Å; P828-Y830 HydrophobicContact CB-CE2 3.84Å; P828-Y830 HydrophobicContact CB-CG 4.28Å; P828-Y830 HydrophobicContact CG-CE1 4.29Å; P828-Y830 HydrophobicContact CG-CE2 4.17Å; P828-Y830 PolarHBondContact O-N 3.16Å; P828-K831 PolarHBondContact O-N 3.49Å
829	I	83.9	Confident	76	Confident	103 Å²	103	70 Å²	70	53%	0.528	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-29.8	-177.5	-169.3	164	0	0	0	114.8	K815 K843	K815-I829 HydrophobicContact CB-CD1 4.16Å; K815-I829 HydrophobicContact CD-CD1 4.5Å; K815-I829 WeakPolarHBondContact O-CB 3.47Å; I829-K843 PolarHBondContact O-NZ 3.21Å
830	Y	86.3	Confident	76.4	Confident	153 Å²	153	71.5 Å²	71.5	60%	0.6	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.6	-178.9	55.5	-100.1	0	0	0	114.8	P828	P828-Y830 HydrophobicContact CB-CD1 3.87Å; P828-Y830 HydrophobicContact CB-CD2 4.28Å; P828-Y830 HydrophobicContact CB-CE1 3.39Å; P828-Y830 HydrophobicContact CB-CE2 3.84Å; P828-Y830 HydrophobicContact CB-CG 4.28Å; P828-Y830 HydrophobicContact CG-CE1 4.29Å; P828-Y830 HydrophobicContact CG-CE2 4.17Å; P828-Y830 PolarHBondContact O-N 3.16Å
831	K	89.1	Confident	77.4	Confident	45 Å²	45	72.6 Å²	72.6	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	163.6	171.4	-77.6	-177.1	172.7	-70.9	0	109.9	I817 C827 P828 C840 I841 D842 K843	I817-K831 WeakPolarHBondContact CD1-O 3.38Å; C827-K831 HydrophobicContact CB-CB 4.25Å; P828-K831 PolarHBondContact O-N 3.49Å; K831-C840 HydrophobicContact CB-CB 4.05Å; K831-C840 HydrophobicContact CD-CB 3.64Å; K831-C840 HydrophobicContact CG-CB 4.44Å; K831-C840 PolarHBondContact NZ-O 3.14Å; K831-I841 CarbonylContact C-O 3.12Å; K831-I841 VanDerWaalsContact CA-O 3.24Å; K831-I841 WeakPolarHBondContact CA-O 3.42Å; K831-I841 WeakPolarHBondContact CB-O 3Å; K831-I841 WeakPolarHBondContact CG-O 3.46Å; K831-D842 WeakPolarHBondContact CE-OD1 3.05Å; K831-D842 WeakPolarHBondContact CG-OD1 3.45Å; K831-D842 IonicContact NZ-OD1 3.3Å; K831-D842 PolarHBondContact NZ-OD1 3.21Å; K831-D842 IonicContact NZ-OD2 2.96Å; K831-D842 PolarHBondContact NZ-OD2 2.69Å; K831-K843 WeakPolarHBondContact O-CE 3.44Å; K831-K843 PolarHBondContact O-NZ 3.35Å
832	D	86.3	Confident	78.7	Confident	67 Å²	67	73.3 Å²	73.3	36%	0.358	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	167.8	166.2	-86.8	-31.2	0	0	0	110.9	I817 C840 I841 K843	I817-D832 VanDerWaalsContact CD1-OD1 3.31Å; I817-D832 WeakPolarHBondContact CD1-OD1 3.02Å; D832-C840 CarbonylContact O-C 3.4Å; D832-C840 VanDerWaalsContact O-CA 3.29Å; D832-C840 WeakPolarHBondContact O-CA 3.39Å; D832-I841 HydrophobicContact CB-CD1 4.44Å; D832-I841 HydrophobicContact CB-CG1 4.08Å; D832-I841 PolarHBondContact N-O 2.04Å; D832-I841 WeakPolarHBondContact O-CG1 3.4Å; D832-I841 PolarHBondContact O-N 2.86Å; D832-K843 HydrophobicContact CB-CG 4.42Å; D832-K843 WeakPolarHBondContact OD1-CE 3.03Å; D832-K843 IonicContact OD1-NZ 2.85Å; D832-K843 PolarHBondContact OD1-NZ 3.35Å; D832-K843 VanDerWaalsContact OD1-NZ 3.16Å; D832-K843 WeakPolarHBondContact OD2-CE 3.21Å
833	C	85.7	Confident	79.7	Confident	34 Å²	34	72.7 Å²	72.7	23%	0.23	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.1	174.1	-58.3	0	0	0	0	110.7	C819	C819-C833 WeakPolarHBondContact CA-SG 3.39Å; C819-C833 HydrophobicContact CB-CB 3.77Å; C819-C833 WeakPolarHBondContact CB-SG 3.33Å; C819-C833 WeakPolarHBondContact SG-CB 3.24Å; C819-C833 CovalentContact SG-SG 2.04Å; C819-C833 PolarHBondContact SG-SG 2.92Å
834	S	84	Confident	79.9	Confident	16 Å²	16	83.6 Å²	83.6	11%	0.112	40%	0.402	C	S	.	.			trans	-52	153.2	162.9	169.9	0	0	0	0	111.7	D836 G837 F839	S834-D836 VanDerWaalsContact CB-OD1 3.23Å; S834-D836 WeakPolarHBondContact CB-OD1 3.39Å; S834-D836 PolarHBondContact O-N 2.99Å; S834-D836 VanDerWaalsContact O-N 3.09Å; S834-D836 PolarHBondContact OG-N 2.76Å; S834-D836 PolarHBondContact OG-OD1 2.79Å; S834-G837 WeakPolarHBondContact O-CA 3.5Å; S834-G837 PolarHBondContact O-N 2.87Å; S834-F839 VanDerWaalsContact CB-O 3.26Å; S834-F839 WeakPolarHBondContact CB-O 3.03Å; S834-F839 PolarHBondContact N-O 2.9Å; S834-F839 WeakPolarHBondContact OG-CE1 3.3Å; S834-F839 VanDerWaalsContact OG-CZ 3.22Å; S834-F839 WeakPolarHBondContact OG-CZ 3.39Å
835	L	77.6	Confident	80.7	Confident	193 Å²	193	84.5 Å²	84.5	100%	1.01	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-25.6	171.6	-69.9	170	0	0	0	113.4
836	D	70.6	Confident	81	Confident	57 Å²	57	87 Å²	87	31%	0.305	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.1	176.4	80.7	-19	0	0	0	114.2	S834 K838 F839	S834-D836 VanDerWaalsContact CB-OD1 3.23Å; S834-D836 WeakPolarHBondContact CB-OD1 3.39Å; S834-D836 PolarHBondContact O-N 2.99Å; S834-D836 VanDerWaalsContact O-N 3.09Å; S834-D836 PolarHBondContact OG-N 2.76Å; S834-D836 PolarHBondContact OG-OD1 2.79Å; D836-K838 PolarHBondContact O-N 2.85Å; D836-K838 PolarHBondContact OD1-N 2.97Å; D836-K838 WeakPolarHBondContact OD2-CD 3.01Å; D836-K838 WeakPolarHBondContact OD2-CE 3.09Å; D836-K838 WeakPolarHBondContact OD2-CG 3.38Å; D836-K838 IonicContact OD2-NZ 3.67Å; D836-K838 PolarHBondContact OD2-NZ 3.01Å; D836-F839 WeakPolarHBondContact OD1-CE1 3.36Å
837	G	70.4	Confident	80.8	Confident	9 Å²	9	85.9 Å²	85.9	9%	0.093	41%	0.413	C	S	.	.	S	Bend	trans	68.6	1.4	-179.1	0	0	0	0	0	115.9	C819 T825 S834	C819-G837 WeakPolarHBondContact CB-O 3.35Å; T825-G837 WeakPolarHBondContact CB-O 3.44Å; T825-G837 WeakPolarHBondContact CG2-O 3.46Å; T825-G837 PolarHBondContact OG1-O 3.43Å; S834-G837 WeakPolarHBondContact O-CA 3.5Å; S834-G837 PolarHBondContact O-N 2.87Å
838	K	72.1	Confident	80.4	Confident	126 Å²	126	91 Å²	91	55%	0.548	44%	0.438	S	S	.	.	S	Bend	trans	-86	-26.7	-170.2	-60.9	-166.3	-157.5	95.4	0	114.7	M823 T825 D836	M823-K838 HydrophobicContact SD-CG 4.41Å; T825-K838 PolarHBondContact OG1-O 3.06Å; D836-K838 PolarHBondContact O-N 2.85Å; D836-K838 PolarHBondContact OD1-N 2.97Å; D836-K838 WeakPolarHBondContact OD2-CD 3.01Å; D836-K838 WeakPolarHBondContact OD2-CE 3.09Å; D836-K838 WeakPolarHBondContact OD2-CG 3.38Å; D836-K838 IonicContact OD2-NZ 3.67Å; D836-K838 PolarHBondContact OD2-NZ 3.01Å
839	F	80.1	Confident	80.1	Confident	112 Å²	112	93.8 Å²	93.8	49%	0.491	45%	0.446	S	S	.	.	S	Bend	trans	-143.8	167	-175.6	57.5	-88.1	0	0	0	112	S834 D836 I841	S834-F839 VanDerWaalsContact CB-O 3.26Å; S834-F839 WeakPolarHBondContact CB-O 3.03Å; S834-F839 PolarHBondContact N-O 2.9Å; S834-F839 WeakPolarHBondContact OG-CE1 3.3Å; S834-F839 VanDerWaalsContact OG-CZ 3.22Å; S834-F839 WeakPolarHBondContact OG-CZ 3.39Å; D836-F839 WeakPolarHBondContact OD1-CE1 3.36Å; F839-I841 HydrophobicContact CD2-CG2 4.08Å; F839-I841 HydrophobicContact CE2-CG2 3.79Å
840	C	86.6	Confident	79.9	Confident	37 Å²	37	93.1 Å²	93.1	25%	0.25	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.3	-172.8	-58.6	0	0	0	0	112.1	C827 K831 D832	C827-C840 WeakPolarHBondContact CA-SG 3.42Å; C827-C840 HydrophobicContact CB-CB 3.79Å; C827-C840 WeakPolarHBondContact CB-SG 3.48Å; C827-C840 WeakPolarHBondContact SG-CA 3.27Å; C827-C840 WeakPolarHBondContact SG-CB 3.41Å; C827-C840 CovalentContact SG-SG 2.03Å; C827-C840 PolarHBondContact SG-SG 3.15Å; K831-C840 HydrophobicContact CB-CB 4.05Å; K831-C840 HydrophobicContact CD-CB 3.64Å; K831-C840 HydrophobicContact CG-CB 4.44Å; K831-C840 PolarHBondContact NZ-O 3.14Å; D832-C840 CarbonylContact O-C 3.4Å; D832-C840 VanDerWaalsContact O-CA 3.29Å; D832-C840 WeakPolarHBondContact O-CA 3.39Å
841	I	88.4	Confident	79.4	Confident	75 Å²	75	88.9 Å²	88.9	39%	0.385	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	153.4	176.8	56.8	173.9	0	0	0	110.7	K831 D832 F839	K831-I841 CarbonylContact C-O 3.12Å; K831-I841 VanDerWaalsContact CA-O 3.24Å; K831-I841 WeakPolarHBondContact CA-O 3.42Å; K831-I841 WeakPolarHBondContact CB-O 3Å; K831-I841 WeakPolarHBondContact CG-O 3.46Å; D832-I841 HydrophobicContact CB-CD1 4.44Å; D832-I841 HydrophobicContact CB-CG1 4.08Å; D832-I841 PolarHBondContact N-O 2.04Å; D832-I841 WeakPolarHBondContact O-CG1 3.4Å; D832-I841 PolarHBondContact O-N 2.86Å; F839-I841 HydrophobicContact CD2-CG2 4.08Å; F839-I841 HydrophobicContact CE2-CG2 3.79Å
842	D	84.6	Confident	78.7	Confident	98 Å²	98	92.2 Å²	92.2	52%	0.524	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	156.1	173.6	-70.3	-61.7	0	0	0	111.5	K831 Y844	K831-D842 WeakPolarHBondContact CE-OD1 3.05Å; K831-D842 WeakPolarHBondContact CG-OD1 3.45Å; K831-D842 IonicContact NZ-OD1 3.3Å; K831-D842 PolarHBondContact NZ-OD1 3.21Å; K831-D842 IonicContact NZ-OD2 2.96Å; K831-D842 PolarHBondContact NZ-OD2 2.69Å; D842-Y844 PolarHBondContact O-N 3.17Å
843	K	73.9	Confident	78.1	Confident	81 Å²	81	94.3 Å²	94.3	35%	0.352	45%	0.454	S	S	.	.			trans	-86.2	36.1	-173.4	-77.3	-176.5	162.2	163.4	0	114.3	I829 K831 D832	I829-K843 PolarHBondContact O-NZ 3.21Å; K831-K843 WeakPolarHBondContact O-CE 3.44Å; K831-K843 PolarHBondContact O-NZ 3.35Å; D832-K843 HydrophobicContact CB-CG 4.42Å; D832-K843 WeakPolarHBondContact OD1-CE 3.03Å; D832-K843 IonicContact OD1-NZ 2.85Å; D832-K843 PolarHBondContact OD1-NZ 3.35Å; D832-K843 VanDerWaalsContact OD1-NZ 3.16Å; D832-K843 WeakPolarHBondContact OD2-CE 3.21Å
844	Y	62.7	Low	77.4	Confident	294 Å²	294	99.8 Å²	99.8	100%	1.153	48%	0.475	S	S	*	.			trans	-148.1	0	-176.4	-68.2	-72.3	0	0	0	111.7	D842	D842-Y844 PolarHBondContact O-N 3.17Å

Retrieved 844 of 844 residues in 430.3 ms (Link to these results)

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