PARD3_MOUSE Loading...

Partitioning defective 3 homolog

Adapter protein involved in asymmetrical cell division and cell polarization processes (By similarity). Seems to play a central role in the formation of epithelial tight junctions (By similarity). Targets the phosphatase PTEN to cell junctions (By similarity). Association with PARD6B may prevent the interaction of PARD3 with F11R/JAM1, thereby preventing tight junction assembly¹. The PARD6-PARD3 complex links GTP-bound Rho small GTPases to atypical protein kinase C proteins (By similarity). Required for establishment of neuronal polarity and normal axon formation in cultured hippocampal neurons (By similarity). Involved in Schwann cell peripheral myelination².

AlphaFold DB , UniProt , Accession Q99NH2, Species MOUSE (Mus musculus, Mouse), Gene Pard3, Length 1,333 aa.

						>PARD3_MOUSE|Q99NH2|Pard3
MKVTVCFGRTRVVVPCGDGRMKVFSLIQQAVTRYRKAVAKDPNYWIQVHRLEHGDGGILDLDDILCDVADDKDRLVAVFDEQDPHHGGDGTSASFTGTQSPEIFGSELGTNNVSAFQPYQATSEIEVTPSVLRANMPLHVRRSSDPALTGLSTSVSDNNFSSEEPSRKNPTRWSTTAGFLKQNTAGSPKTCDRKKDENYRSLPRDPSSWSNQFQRDNARSSLSASHPMVDRWLEKQEQDEEGTEEDSSRVEPVGHADTGLENMPNFSLDDMVKLVQVPNDGGPLGIHVVPFSARGGRTLGLLVKRLEKGGKAEQENLFHENDCIVRINDGDLRNRRFEQAQHMFRQAMRARVIWFHVVPAANKEQYEQLSQREKNNYSPGRFSPDSHCVANRSVANNAPQALPRAPRLSQPPEQLDAHPRLPHSAHASTKPPAAPALAPPSVLSTNVGSVYNTKKVGKRLNIQLKKGTEGLGFSITSRDVTIGGSAPIYVKNILPRGAAIQDGRLKAGDRLIEVNGVDLAGKSQEEVVSLLRSTKMEGTVSLLVFRQEEAFHPREMNAEPSQMQTPKETKAEDEDVVLTPDGTREFLTFEVPLNDSGSAGLGVSVKGNRSKENHADLGIFVKSIINGGAASKDGRLRVNDQLIAVNGESLLGKANQEAMETLRRSMSTEGNKRGMIQLIVARRISRCNELRSPGSPAAPELPIETELDDRERRISHSLYSGIEGLDESPTRNAALSRIMGKCQLSPTVNMPHDDTVMIEDDRLPVLPPHLSDQSSSSSHDDVGFIMTEAGTWAKATISDSADCSLSPDVDPVLAFQREGFGRQSMSEKRTKQFSDASQLDFVKTRKSKSMDLVADETKLNTVDDQRAGSPSRDVGPSLGLKKSSSLESLQTAVAEVTLNGNIPFHRPRPRIIRGRGCNESFRAAIDKSYDKPMVDDDDEGMETLEEDTEESSRSGRESVSTSSDQPSYSLERQMNGDPEKRDKTERKKDKAGKDKKKDREKEKDKLKAKKGMLKGLGDMFRFGKHRKDDKMEKMGRIKIQDSFTSEEDRVRMKEEQERIQAKTREFRERQARERDYAEIQDFHRTFGCDDELLYGGMSSYEGCLALNARPQSPREGHLMDTLYAQVKKPRSSKPGDSNRSTPSNHDRIQRLRQEFQQAKQDEDVEDRRRTYSFEQSWSSSRPASQSGRHSVSVEVQVQRQRQEERESFQQAQRQYSSLPRQSRKNASSISQDSWEQNYAPGEGFQSAKENPRYSSYQGSRNGYLGGHGFNARVMLETQELLRQEQRRKEQQLKKQPPADGVRGPFRQDVPPSPSQVARLNRLQTPEKGRPFYS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	89.5	Confident	93.2	Very high	47 Å²	47	66.6 Å²	66.6	23%	0.232	31%	0.314	C	S	.	.				0	133.2	0	-131.8	165.7	86.6	0	0	111.9	V3 C16 G17 L65 C66 A69 D71	M1-V3 HydrophobicContact CE-CG2 4.21Å; M1-C16 HydrophobicContact CB-CB 4.3Å; M1-C16 HydrophobicContact CE-CB 4.4Å; M1-C16 PolarHBondContact O-N 2.98Å; M1-G17 PolarHBondContact N-O 3.39Å; M1-L65 HydrophobicContact CE-CB 3.89Å; M1-L65 HydrophobicContact CE-CD2 3.58Å; M1-L65 HydrophobicContact CE-CG 3.46Å; M1-L65 VanDerWaalsContact CE-CG 3.46Å; M1-C66 HydrophobicContact CE-CB 4.48Å; M1-C66 HydrophobicContact SD-CB 3.98Å; M1-A69 WeakPolarHBondContact CE-O 3.44Å; M1-D71 WeakPolarHBondContact CA-OD1 3.28Å; M1-D71 HydrophobicContact CG-CB 4.17Å
2	K	93.5	Very high	93.4	Very high	127 Å²	127	61.8 Å²	61.8	55%	0.552	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	122	172.2	-64.3	169	-175.8	164.7	0	108.3	V13 V14 D71 K72	K2-V13 HydrophobicContact CB-CG1 4.43Å; K2-V14 CarbonylContact C-O 3.5Å; K2-V14 WeakPolarHBondContact CA-O 3.31Å; K2-D71 PolarHBondContact N-OD1 3.44Å; K2-K72 WeakPolarHBondContact O-CA 3.46Å; K2-K72 PolarHBondContact O-N 2.88Å
3	V	94.5	Very high	93.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	146	-178	-179.4	0	0	0	0	110.1	M1 V14 L26 L65 L75	M1-V3 HydrophobicContact CE-CG2 4.21Å; V3-V14 PolarHBondContact N-O 3.18Å; V3-V14 PolarHBondContact O-N 3.14Å; V3-L26 HydrophobicContact CG1-CD2 4.39Å; V3-L65 HydrophobicContact CG2-CD2 3.95Å; V3-L75 HydrophobicContact CG1-CD1 3.64Å; V3-L75 HydrophobicContact CG1-CG 3.8Å
4	T	96	Very high	93.7	Very high	22 Å²	22	58.3 Å²	58.3	14%	0.135	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.7	178.5	-51.4	0	0	0	0	110	R11 V13 D73 R74 L75	T4-R11 HydrophobicContact CG2-CB 4.14Å; T4-V13 HydrophobicContact CG2-CG2 4.29Å; T4-D73 WeakPolarHBondContact CB-O 3.32Å; T4-D73 PolarHBondContact N-O 3.4Å; T4-R74 WeakPolarHBondContact O-CA 3.46Å; T4-L75 PolarHBondContact O-N 3.06Å
5	V	96.4	Very high	93.7	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126.5	174.4	-178.7	0	0	0	0	109.7	F7 V12 L26 A30 L51 L75 A77	V5-F7 HydrophobicContact CB-CE2 4.13Å; V5-F7 HydrophobicContact CG1-CD2 3.91Å; V5-F7 HydrophobicContact CG1-CE2 3.51Å; V5-F7 HydrophobicContact CG1-CZ 4.06Å; V5-V12 PolarHBondContact N-O 3.44Å; V5-V12 PolarHBondContact O-N 3.11Å; V5-L26 HydrophobicContact CG2-CD1 4.06Å; V5-L26 HydrophobicContact CG2-CD2 4.28Å; V5-L26 HydrophobicContact CG2-CG 4.24Å; V5-A30 HydrophobicContact CB-CB 3.98Å; V5-A30 HydrophobicContact CG1-CB 4.07Å; V5-A30 HydrophobicContact CG2-CB 3.87Å; V5-L51 HydrophobicContact CG1-CD2 3.61Å; V5-L51 HydrophobicContact CG2-CD2 4.25Å; V5-L75 CarbonylContact C-O 3.54Å; V5-L75 WeakPolarHBondContact CA-O 2.93Å; V5-A77 HydrophobicContact CG1-CB 3.88Å
6	C	95	Very high	93.5	Very high	13 Å²	13	54.6 Å²	54.6	9%	0.088	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	104.9	-177.8	-56.1	0	0	0	0	109.8	G8 R11 L75 A77	C6-G8 PolarHBondContact O-N 2.73Å; C6-R11 HydrophobicContact CB-CG 4.35Å; C6-L75 WeakPolarHBondContact CB-O 3.43Å; C6-L75 PolarHBondContact N-O 3.01Å; C6-L75 PolarHBondContact SG-O 3.43Å; C6-A77 PolarHBondContact O-N 3.44Å
7	F	94	Very high	93.3	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	85	171.8	-67.5	-99.5	0	0	0	108.2	V5 R9 T10 V12 A30 V31 Y34 V48 A77 F79	V5-F7 HydrophobicContact CB-CE2 4.13Å; V5-F7 HydrophobicContact CG1-CD2 3.91Å; V5-F7 HydrophobicContact CG1-CE2 3.51Å; V5-F7 HydrophobicContact CG1-CZ 4.06Å; F7-R9 PolarHBondContact O-N 2.74Å; F7-R9 VanDerWaalsContact O-N 3.1Å; F7-T10 PolarHBondContact N-O 2.76Å; F7-T10 PolarHBondContact O-N 2.75Å; F7-V12 HydrophobicContact CD2-CB 4.39Å; F7-V12 HydrophobicContact CD2-CG2 3.98Å; F7-V12 HydrophobicContact CE2-CB 4.33Å; F7-V12 HydrophobicContact CE2-CG2 4.21Å; F7-A30 HydrophobicContact CE2-CB 3.84Å; F7-A30 HydrophobicContact CZ-CB 3.83Å; F7-V31 HydrophobicContact CE1-CG2 4.07Å; F7-V31 HydrophobicContact CZ-CG2 4.03Å; F7-Y34 HydrophobicContact CB-CD2 3.31Å; F7-Y34 HydrophobicContact CB-CE2 3.24Å; F7-Y34 HydrophobicContact CB-CG 4.35Å; F7-Y34 AromaticContact CD1-CD2 3.92Å; F7-Y34 HydrophobicContact CD1-CD2 3.92Å; F7-Y34 HydrophobicContact CD1-CE2 4.28Å; F7-Y34 HydrophobicContact CD1-CG 4.18Å; F7-Y34 AromaticContact CD2-CD2 3.59Å; F7-Y34 HydrophobicContact CD2-CD2 3.59Å; F7-Y34 HydrophobicContact CD2-CE2 4.43Å; F7-Y34 HydrophobicContact CD2-CG 4.12Å; F7-Y34 HydrophobicContact CE1-CG 4.48Å; F7-Y34 HydrophobicContact CE2-CD2 4.33Å; F7-Y34 HydrophobicContact CE2-CG 4.42Å; F7-Y34 AromaticContact CG-CD2 3.35Å; F7-Y34 HydrophobicContact CG-CD2 3.35Å; F7-Y34 AromaticContact CG-CE2 3.8Å; F7-Y34 HydrophobicContact CG-CE2 3.8Å; F7-Y34 AromaticContact CG-CG 3.99Å; F7-Y34 HydrophobicContact CG-CG 3.99Å; F7-V48 HydrophobicContact CE1-CG2 3.64Å; F7-V48 HydrophobicContact CZ-CG2 4.28Å; F7-A77 HydrophobicContact CD1-CB 3.82Å; F7-A77 HydrophobicContact CE1-CB 3.95Å; F7-A77 HydrophobicContact CG-CB 4.14Å; F7-A77 HydrophobicContact CZ-CB 4.37Å; F7-F79 VanDerWaalsContact C-CE1 3.48Å; F7-F79 VanDerWaalsContact CA-CE1 3.44Å; F7-F79 HydrophobicContact CB-CD1 4.37Å; F7-F79 HydrophobicContact CB-CE1 3.74Å; F7-F79 HydrophobicContact CB-CE2 4.25Å; F7-F79 HydrophobicContact CB-CZ 3.66Å; F7-F79 AromaticContact CD1-CD1 3.89Å; F7-F79 HydrophobicContact CD1-CD1 3.89Å; F7-F79 HydrophobicContact CD1-CD2 4.03Å; F7-F79 HydrophobicContact CD1-CE1 4.1Å; F7-F79 HydrophobicContact CD1-CE2 4.17Å; F7-F79 AromaticContact CD1-CG 3.88Å; F7-F79 HydrophobicContact CD1-CG 3.88Å; F7-F79 HydrophobicContact CD1-CZ 4.24Å; F7-F79 HydrophobicContact CG-CE1 4.38Å; F7-F79 HydrophobicContact CG-CZ 4.48Å
8	G	90.1	Very high	93.1	Very high	55 Å²	55	57.3 Å²	57.3	57%	0.567	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	-114.6	-173.2	0	0	0	0	0	111.6	C6	C6-G8 PolarHBondContact O-N 2.73Å
9	R	90.8	Very high	92.9	Very high	254 Å²	254	54.3 Å²	54.3	96%	0.958	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-18.6	177.9	-63.4	-177.4	-178.9	-178.4	0.4	113.5	F7	F7-R9 PolarHBondContact O-N 2.74Å; F7-R9 VanDerWaalsContact O-N 3.1Å
10	T	91.2	Very high	92.8	Very high	44 Å²	44	61.3 Å²	61.3	27%	0.27	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.4	-176.4	-57.1	0	0	0	0	111.1	F7 V12 Y34 A37 V38	F7-T10 PolarHBondContact N-O 2.76Å; F7-T10 PolarHBondContact O-N 2.75Å; T10-V12 HydrophobicContact CG2-CG2 4.22Å; T10-Y34 HydrophobicContact CG2-CD2 3.76Å; T10-Y34 HydrophobicContact CG2-CE2 3.84Å; T10-A37 HydrophobicContact CG2-CB 4.38Å; T10-V38 HydrophobicContact CG2-CG2 4.26Å
11	R	94.6	Very high	92.7	Very high	167 Å²	167	60 Å²	60	63%	0.63	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.9	179.6	-62.9	-169.9	174.1	138.1	2.1	111.7	T4 C6	T4-R11 HydrophobicContact CG2-CB 4.14Å; C6-R11 HydrophobicContact CB-CG 4.35Å
12	V	95	Very high	93	Very high	8 Å²	8	61.9 Å²	61.9	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	110.1	-170.3	178.5	0	0	0	0	109.8	V5 F7 T10 V14 R33 Y34	V5-V12 PolarHBondContact N-O 3.44Å; V5-V12 PolarHBondContact O-N 3.11Å; F7-V12 HydrophobicContact CD2-CB 4.39Å; F7-V12 HydrophobicContact CD2-CG2 3.98Å; F7-V12 HydrophobicContact CE2-CB 4.33Å; F7-V12 HydrophobicContact CE2-CG2 4.21Å; T10-V12 HydrophobicContact CG2-CG2 4.22Å; V12-V14 HydrophobicContact CG1-CG2 4.39Å; V12-R33 HydrophobicContact CG1-CB 3.31Å; V12-R33 HydrophobicContact CG1-CG 4.38Å; V12-Y34 HydrophobicContact CG2-CD2 4.31Å
13	V	95.6	Very high	93	Very high	75 Å²	75	55.9 Å²	55.9	46%	0.455	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.2	175.8	-175.8	0	0	0	0	109.8	K2 T4 R33	K2-V13 HydrophobicContact CB-CG1 4.43Å; T4-V13 HydrophobicContact CG2-CG2 4.29Å; V13-R33 WeakPolarHBondContact O-CD 3.38Å; V13-R33 PolarHBondContact O-NH1 2.86Å
14	V	95.2	Very high	93	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.8	176.2	-174.1	0	0	0	0	109.3	K2 V3 V12 C16 L26 Q29 A30	K2-V14 CarbonylContact C-O 3.5Å; K2-V14 WeakPolarHBondContact CA-O 3.31Å; V3-V14 PolarHBondContact N-O 3.18Å; V3-V14 PolarHBondContact O-N 3.14Å; V12-V14 HydrophobicContact CG1-CG2 4.39Å; V14-C16 PolarHBondContact O-N 3.43Å; V14-C16 PolarHBondContact O-SG 3.25Å; V14-C16 VanDerWaalsContact O-SG 3.34Å; V14-L26 HydrophobicContact CB-CD1 3.63Å; V14-L26 HydrophobicContact CG1-CD1 3.73Å; V14-L26 HydrophobicContact CG2-CD1 3.81Å; V14-Q29 HydrophobicContact CG1-CB 3.66Å; V14-A30 HydrophobicContact CG2-CB 3.96Å
15	P	93.5	Very high	92.9	Very high	57 Å²	57	61.8 Å²	61.8	37%	0.37	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	107	173.2	31.6	-31.1	0	0	0	109.6	G17	P15-G17 VanDerWaalsContact C-N 3.29Å; P15-G17 PolarHBondContact O-N 2.88Å
16	C	91.7	Very high	92.9	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.007	31%	0.312	C	S	.	.			trans	-90.5	15.2	-170.4	-51.4	0	0	0	0	113.8	M1 V14 D18 G19 M21 L65	M1-C16 HydrophobicContact CB-CB 4.3Å; M1-C16 HydrophobicContact CE-CB 4.4Å; M1-C16 PolarHBondContact O-N 2.98Å; V14-C16 PolarHBondContact O-N 3.43Å; V14-C16 PolarHBondContact O-SG 3.25Å; V14-C16 VanDerWaalsContact O-SG 3.34Å; C16-D18 PolarHBondContact O-N 2.98Å; C16-G19 PolarHBondContact O-N 3.22Å; C16-M21 HydrophobicContact CB-CE 4.12Å; C16-M21 HydrophobicContact CB-CG 4.29Å; C16-M21 HydrophobicContact CB-SD 3.82Å; C16-L65 HydrophobicContact CB-CD2 3.8Å; C16-L65 WeakPolarHBondContact SG-CD2 3.3Å
17	G	90.1	Very high	92.9	Very high	55 Å²	55	62 Å²	62	57%	0.567	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	-125.3	-177	0	0	0	0	0	112	M1 P15 G19	M1-G17 PolarHBondContact N-O 3.39Å; P15-G17 VanDerWaalsContact C-N 3.29Å; P15-G17 PolarHBondContact O-N 2.88Å; G17-G19 VanDerWaalsContact C-N 3.34Å
18	D	88.8	Confident	92.8	Very high	103 Å²	103	67 Å²	67	55%	0.551	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.9	172.7	65.6	-12.4	0	0	0	113.5	C16 R20	C16-D18 PolarHBondContact O-N 2.98Å; D18-R20 PolarHBondContact OD1-N 3.17Å; D18-R20 WeakPolarHBondContact OD2-CD 3.41Å; D18-R20 WeakPolarHBondContact OD2-CG 3.43Å; D18-R20 IonicContact OD2-CZ 3.59Å; D18-R20 IonicContact OD2-NE 3.52Å; D18-R20 PolarHBondContact OD2-NE 2.9Å
19	G	89.1	Confident	93	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.324	C	S	.	.	S	Bend	trans	96.9	-5.8	179	0	0	0	0	0	115.1	C16 G17 M21 L65 C66	C16-G19 PolarHBondContact O-N 3.22Å; G17-G19 VanDerWaalsContact C-N 3.34Å; G19-M21 PolarHBondContact O-N 3.49Å; G19-L65 PolarHBondContact O-N 3.37Å; G19-C66 PolarHBondContact O-N 2.94Å; G19-C66 VanDerWaalsContact O-N 3.15Å
20	R	90.6	Very high	93.2	Very high	193 Å²	193	55.6 Å²	55.6	73%	0.728	28%	0.279	S	S	*	.			trans	-69	6.9	-179.3	-64	-177.5	-158.1	-103.4	-4.9	115.8	D18	D18-R20 PolarHBondContact OD1-N 3.17Å; D18-R20 WeakPolarHBondContact OD2-CD 3.41Å; D18-R20 WeakPolarHBondContact OD2-CG 3.43Å; D18-R20 IonicContact OD2-CZ 3.59Å; D18-R20 IonicContact OD2-NE 3.52Å; D18-R20 PolarHBondContact OD2-NE 2.9Å
21	M	92.5	Very high	93.3	Very high	36 Å²	36	54.3 Å²	54.3	18%	0.177	27%	0.271	C	S	.	.	S	Bend	trans	-83.5	145.5	176.6	66.1	176.7	55.9	0	0	110.6	C16 G19 L26 Q29 L65	C16-M21 HydrophobicContact CB-CE 4.12Å; C16-M21 HydrophobicContact CB-CG 4.29Å; C16-M21 HydrophobicContact CB-SD 3.82Å; G19-M21 PolarHBondContact O-N 3.49Å; M21-L26 HydrophobicContact SD-CB 4.49Å; M21-Q29 VanDerWaalsContact CE-NE2 3.3Å; M21-L65 HydrophobicContact CG-CB 4.47Å; M21-L65 HydrophobicContact CG-CD2 4.36Å; M21-L65 VanDerWaalsContact O-CB 3.28Å; M21-L65 WeakPolarHBondContact O-CB 3.49Å; M21-L65 PolarHBondContact O-N 3.01Å
22	K	94.4	Very high	93.1	Very high	86 Å²	86	50 Å²	50	37%	0.374	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-66.9	153.5	173.3	-73.2	-170.8	162.1	-159.4	0	111.8	F24 S25 L26 D62 D63	K22-F24 HydrophobicContact CB-CB 4.46Å; K22-F24 PolarHBondContact O-N 2.9Å; K22-S25 WeakPolarHBondContact O-CA 3.48Å; K22-S25 WeakPolarHBondContact O-CB 3.4Å; K22-S25 PolarHBondContact O-N 3.3Å; K22-L26 PolarHBondContact O-N 2.92Å; K22-D62 WeakPolarHBondContact CD-O 3.37Å; K22-D62 WeakPolarHBondContact CE-O 3.33Å; K22-D62 PolarHBondContact NZ-O 3.1Å; K22-D62 IonicContact NZ-OD1 2.64Å; K22-D62 PolarHBondContact NZ-OD1 2.88Å; K22-D63 CarbonylContact C-O 3.53Å; K22-D63 WeakPolarHBondContact CA-O 3.41Å
23	V	94.6	Very high	93	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-52.6	-39.2	170.9	174.7	0	0	0	0	111.1	S25 L26 I27 L51 L59 D60 D63 L65 V68	V23-S25 VanDerWaalsContact C-N 3.34Å; V23-S25 PolarHBondContact O-N 3.28Å; V23-L26 WeakPolarHBondContact O-CB 3.42Å; V23-L26 PolarHBondContact O-N 3.33Å; V23-L26 VanDerWaalsContact O-N 3.15Å; V23-I27 HydrophobicContact CG1-CD1 4.35Å; V23-I27 WeakPolarHBondContact O-CG1 3.49Å; V23-I27 PolarHBondContact O-N 2.79Å; V23-L51 HydrophobicContact CG1-CD1 3.92Å; V23-L59 HydrophobicContact CG1-CB 3.94Å; V23-L59 HydrophobicContact CG1-CD1 4.49Å; V23-L59 HydrophobicContact CG2-CB 4.26Å; V23-L59 HydrophobicContact CG2-CD1 4.44Å; V23-D60 VanDerWaalsContact CB-O 3.27Å; V23-D60 WeakPolarHBondContact CB-O 3.35Å; V23-D60 WeakPolarHBondContact CG2-O 3.48Å; V23-D63 HydrophobicContact CG2-CB 4.01Å; V23-D63 PolarHBondContact N-O 3.45Å; V23-L65 HydrophobicContact CG2-CD1 4.13Å; V23-V68 HydrophobicContact CG2-CG2 4.18Å
24	F	94.8	Very high	92.9	Very high	105 Å²	105	51.9 Å²	51.9	46%	0.461	26%	0.262	S	S	.	.	H	α-helix	trans	-54.3	-43.6	170.6	178.8	-100.7	0	0	0	113.7	K22 I27 Q28 L61	K22-F24 HydrophobicContact CB-CB 4.46Å; K22-F24 PolarHBondContact O-N 2.9Å; F24-I27 PolarHBondContact O-N 3.45Å; F24-Q28 HydrophobicContact CE1-CG 4.48Å; F24-Q28 VanDerWaalsContact CZ-NE2 3.33Å; F24-Q28 PolarHBondContact O-N 3.5Å; F24-Q28 VanDerWaalsContact O-N 3.14Å; F24-L61 HydrophobicContact CB-CB 4.38Å; F24-L61 VanDerWaalsContact CB-O 3.26Å; F24-L61 WeakPolarHBondContact CB-O 3.27Å; F24-L61 PolarHBondContact N-O 3.22Å
25	S	94	Very high	92.6	Very high	41 Å²	41	55.5 Å²	55.5	29%	0.287	28%	0.275	S	S	.	.	H	α-helix	trans	-71	-33.5	177.4	-58.2	0	0	0	0	112.5	K22 V23 Q28 Q29	K22-S25 WeakPolarHBondContact O-CA 3.48Å; K22-S25 WeakPolarHBondContact O-CB 3.4Å; K22-S25 PolarHBondContact O-N 3.3Å; V23-S25 VanDerWaalsContact C-N 3.34Å; V23-S25 PolarHBondContact O-N 3.28Å; S25-Q28 PolarHBondContact O-N 2.94Å; S25-Q29 WeakPolarHBondContact O-CG 3.41Å; S25-Q29 PolarHBondContact O-N 2.72Å
26	L	95.1	Very high	92.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-47.5	169.3	169	63.8	0	0	0	110.6	V3 V5 V14 M21 K22 V23 Q28 Q29 A30 L51 L65 L75	V3-L26 HydrophobicContact CG1-CD2 4.39Å; V5-L26 HydrophobicContact CG2-CD1 4.06Å; V5-L26 HydrophobicContact CG2-CD2 4.28Å; V5-L26 HydrophobicContact CG2-CG 4.24Å; V14-L26 HydrophobicContact CB-CD1 3.63Å; V14-L26 HydrophobicContact CG1-CD1 3.73Å; V14-L26 HydrophobicContact CG2-CD1 3.81Å; M21-L26 HydrophobicContact SD-CB 4.49Å; K22-L26 PolarHBondContact O-N 2.92Å; V23-L26 WeakPolarHBondContact O-CB 3.42Å; V23-L26 PolarHBondContact O-N 3.33Å; V23-L26 VanDerWaalsContact O-N 3.15Å; L26-Q28 PolarHBondContact O-N 3.48Å; L26-Q29 PolarHBondContact O-N 3.44Å; L26-A30 VanDerWaalsContact O-CB 3.25Å; L26-A30 WeakPolarHBondContact O-CB 3.38Å; L26-A30 PolarHBondContact O-N 3.15Å; L26-L51 HydrophobicContact CD2-CD1 3.78Å; L26-L51 HydrophobicContact CG-CD1 4.16Å; L26-L65 HydrophobicContact CB-CD2 4.26Å; L26-L65 HydrophobicContact CD1-CD2 4.43Å; L26-L65 HydrophobicContact CD2-CD1 3.56Å; L26-L65 HydrophobicContact CD2-CD2 3.79Å; L26-L65 HydrophobicContact CD2-CG 4.34Å; L26-L65 HydrophobicContact CG-CD2 4.38Å; L26-L75 HydrophobicContact CD2-CD1 3.68Å
27	I	94.7	Very high	92.2	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.097	32%	0.317	C	S	.	.	H	α-helix	trans	-57.3	-47.1	178.6	-70.3	169.2	0	0	0	111	V23 F24 Q29 A30 V31 V48 L51 L61	V23-I27 HydrophobicContact CG1-CD1 4.35Å; V23-I27 WeakPolarHBondContact O-CG1 3.49Å; V23-I27 PolarHBondContact O-N 2.79Å; F24-I27 PolarHBondContact O-N 3.45Å; I27-Q29 VanDerWaalsContact C-N 3.33Å; I27-Q29 PolarHBondContact O-N 3.02Å; I27-A30 PolarHBondContact O-N 2.88Å; I27-V31 HydrophobicContact CG2-CG2 4.29Å; I27-V31 WeakPolarHBondContact O-CG2 3.49Å; I27-V31 PolarHBondContact O-N 2.88Å; I27-V48 HydrophobicContact CD1-CG1 4.19Å; I27-V48 HydrophobicContact CG1-CG1 4.3Å; I27-V48 HydrophobicContact CG2-CB 3.75Å; I27-V48 HydrophobicContact CG2-CG1 4.06Å; I27-V48 HydrophobicContact CG2-CG2 4.04Å; I27-L51 HydrophobicContact CD1-CD1 4.02Å; I27-L51 HydrophobicContact CD1-CG 4.1Å; I27-L51 HydrophobicContact CG1-CD1 3.44Å; I27-L51 VanDerWaalsContact CG1-CD1 3.44Å; I27-L51 HydrophobicContact CG1-CG 3.81Å; I27-L61 HydrophobicContact CD1-CD2 3.43Å; I27-L61 VanDerWaalsContact CD1-CD2 3.43Å
28	Q	93	Very high	92	Very high	107 Å²	107	63.6 Å²	63.6	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-43	177.9	-70.5	-174.2	-15.7	0	0	112.6	F24 S25 L26 T32	F24-Q28 HydrophobicContact CE1-CG 4.48Å; F24-Q28 VanDerWaalsContact CZ-NE2 3.33Å; F24-Q28 PolarHBondContact O-N 3.5Å; F24-Q28 VanDerWaalsContact O-N 3.14Å; S25-Q28 PolarHBondContact O-N 2.94Å; L26-Q28 PolarHBondContact O-N 3.48Å; Q28-T32 VanDerWaalsContact O-CB 3.31Å; Q28-T32 WeakPolarHBondContact O-CB 3.17Å; Q28-T32 PolarHBondContact O-N 3.47Å; Q28-T32 PolarHBondContact O-OG1 2.95Å
29	Q	93.7	Very high	91.6	Very high	70 Å²	70	63 Å²	63	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-70.5	-36.9	176.9	-67.8	-172.6	41.8	0	0	112.6	V14 M21 S25 L26 I27 T32 R33	V14-Q29 HydrophobicContact CG1-CB 3.66Å; M21-Q29 VanDerWaalsContact CE-NE2 3.3Å; S25-Q29 WeakPolarHBondContact O-CG 3.41Å; S25-Q29 PolarHBondContact O-N 2.72Å; L26-Q29 PolarHBondContact O-N 3.44Å; I27-Q29 VanDerWaalsContact C-N 3.33Å; I27-Q29 PolarHBondContact O-N 3.02Å; Q29-T32 PolarHBondContact O-N 3.31Å; Q29-R33 WeakPolarHBondContact O-CB 3.25Å; Q29-R33 WeakPolarHBondContact O-CG 3.33Å; Q29-R33 PolarHBondContact O-N 3.21Å
30	A	94.7	Very high	91	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-50.2	177.1	0	0	0	0	0	111.1	V5 F7 V14 L26 I27 T32 R33 Y34	V5-A30 HydrophobicContact CB-CB 3.98Å; V5-A30 HydrophobicContact CG1-CB 4.07Å; V5-A30 HydrophobicContact CG2-CB 3.87Å; F7-A30 HydrophobicContact CE2-CB 3.84Å; F7-A30 HydrophobicContact CZ-CB 3.83Å; V14-A30 HydrophobicContact CG2-CB 3.96Å; L26-A30 VanDerWaalsContact O-CB 3.25Å; L26-A30 WeakPolarHBondContact O-CB 3.38Å; L26-A30 PolarHBondContact O-N 3.15Å; I27-A30 PolarHBondContact O-N 2.88Å; A30-T32 PolarHBondContact O-N 2.83Å; A30-R33 PolarHBondContact O-N 3.07Å; A30-Y34 WeakPolarHBondContact O-CB 3.23Å; A30-Y34 PolarHBondContact O-N 3.45Å
31	V	92.8	Very high	90.1	Very high	17 Å²	17	62.6 Å²	62.6	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-44.1	175.4	172.5	0	0	0	0	111.1	F7 I27 R33 Y34 R35 I46 V48	F7-V31 HydrophobicContact CE1-CG2 4.07Å; F7-V31 HydrophobicContact CZ-CG2 4.03Å; I27-V31 HydrophobicContact CG2-CG2 4.29Å; I27-V31 WeakPolarHBondContact O-CG2 3.49Å; I27-V31 PolarHBondContact O-N 2.88Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 2.83Å; V31-Y34 PolarHBondContact O-N 2.91Å; V31-R35 PolarHBondContact O-N 3.42Å; V31-I46 HydrophobicContact CG1-CB 4.28Å; V31-V48 HydrophobicContact CG2-CG2 3.5Å
32	T	90.5	Very high	88.9	Confident	77 Å²	77	66.1 Å²	66.1	47%	0.472	35%	0.348	S	S	.	.	H	α-helix	trans	-60.3	-36.7	177.7	-61.3	0	0	0	0	112.3	Q28 Q29 A30 K36	Q28-T32 VanDerWaalsContact O-CB 3.31Å; Q28-T32 WeakPolarHBondContact O-CB 3.17Å; Q28-T32 PolarHBondContact O-N 3.47Å; Q28-T32 PolarHBondContact O-OG1 2.95Å; Q29-T32 PolarHBondContact O-N 3.31Å; A30-T32 PolarHBondContact O-N 2.83Å; T32-K36 WeakPolarHBondContact O-CG 3.43Å
33	R	93.1	Very high	87.9	Confident	112 Å²	112	68 Å²	68	42%	0.423	36%	0.363	S	S	.	.	H	α-helix	trans	-80.1	-32.5	175.8	-74.6	179.7	173.7	-122.7	-12.3	112.8	V12 V13 Q29 A30 V31 K36 A37	V12-R33 HydrophobicContact CG1-CB 3.31Å; V12-R33 HydrophobicContact CG1-CG 4.38Å; V13-R33 WeakPolarHBondContact O-CD 3.38Å; V13-R33 PolarHBondContact O-NH1 2.86Å; Q29-R33 WeakPolarHBondContact O-CB 3.25Å; Q29-R33 WeakPolarHBondContact O-CG 3.33Å; Q29-R33 PolarHBondContact O-N 3.21Å; A30-R33 PolarHBondContact O-N 3.07Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 2.83Å; R33-K36 PolarHBondContact O-N 3.32Å; R33-A37 WeakPolarHBondContact O-CB 3.29Å; R33-A37 PolarHBondContact O-N 3.22Å
34	Y	93.3	Very high	87.2	Confident	10 Å²	10	68.2 Å²	68.2	4%	0.039	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-49.1	174.6	177	-83.2	0	0	0	111.7	F7 T10 V12 A30 V31 K36 A37 V38 Y44 I46 E81	F7-Y34 HydrophobicContact CB-CD2 3.31Å; F7-Y34 HydrophobicContact CB-CE2 3.24Å; F7-Y34 HydrophobicContact CB-CG 4.35Å; F7-Y34 AromaticContact CD1-CD2 3.92Å; F7-Y34 HydrophobicContact CD1-CD2 3.92Å; F7-Y34 HydrophobicContact CD1-CE2 4.28Å; F7-Y34 HydrophobicContact CD1-CG 4.18Å; F7-Y34 AromaticContact CD2-CD2 3.59Å; F7-Y34 HydrophobicContact CD2-CD2 3.59Å; F7-Y34 HydrophobicContact CD2-CE2 4.43Å; F7-Y34 HydrophobicContact CD2-CG 4.12Å; F7-Y34 HydrophobicContact CE1-CG 4.48Å; F7-Y34 HydrophobicContact CE2-CD2 4.33Å; F7-Y34 HydrophobicContact CE2-CG 4.42Å; F7-Y34 AromaticContact CG-CD2 3.35Å; F7-Y34 HydrophobicContact CG-CD2 3.35Å; F7-Y34 AromaticContact CG-CE2 3.8Å; F7-Y34 HydrophobicContact CG-CE2 3.8Å; F7-Y34 AromaticContact CG-CG 3.99Å; F7-Y34 HydrophobicContact CG-CG 3.99Å; T10-Y34 HydrophobicContact CG2-CD2 3.76Å; T10-Y34 HydrophobicContact CG2-CE2 3.84Å; V12-Y34 HydrophobicContact CG2-CD2 4.31Å; A30-Y34 WeakPolarHBondContact O-CB 3.23Å; A30-Y34 PolarHBondContact O-N 3.45Å; V31-Y34 PolarHBondContact O-N 2.91Å; Y34-K36 PolarHBondContact O-N 2.86Å; Y34-A37 WeakPolarHBondContact O-CA 3.36Å; Y34-A37 WeakPolarHBondContact O-CB 3.35Å; Y34-A37 PolarHBondContact O-N 3.42Å; Y34-V38 HydrophobicContact CD1-CG2 4.04Å; Y34-V38 HydrophobicContact CD2-CG2 4.14Å; Y34-V38 HydrophobicContact CE1-CB 4.29Å; Y34-V38 HydrophobicContact CE1-CG2 3.62Å; Y34-V38 HydrophobicContact CE2-CG2 3.71Å; Y34-V38 HydrophobicContact CG-CG2 4.32Å; Y34-V38 VanDerWaalsContact CZ-CG2 3.47Å; Y34-V38 PolarHBondContact O-N 2.82Å; Y34-Y44 HydrophobicContact CE1-CE1 4.36Å; Y34-I46 HydrophobicContact CD1-CD1 3.19Å; Y34-I46 HydrophobicContact CE1-CD1 3.38Å; Y34-I46 HydrophobicContact CG-CD1 4.33Å; Y34-E81 WeakPolarHBondContact CE1-OE1 3.47Å; Y34-E81 VanDerWaalsContact CZ-OE1 3.3Å; Y34-E81 VanDerWaalsContact OH-CD 3.29Å; Y34-E81 PolarHBondContact OH-OE1 3.13Å; Y34-E81 PolarHBondContact OH-OE2 2.92Å
35	R	89.8	Confident	86.5	Confident	76 Å²	76	68.2 Å²	68.2	29%	0.287	36%	0.361	S	S	.	.	H	α-helix	trans	-55.4	-40.3	177.3	-66.3	-173.5	-165.1	-171.2	5.9	111.3	V31 A39 Y44 I46	V31-R35 PolarHBondContact O-N 3.42Å; R35-A39 PolarHBondContact O-N 3.41Å; R35-A39 VanDerWaalsContact O-N 3.15Å; R35-Y44 WeakPolarHBondContact CD-O 3.48Å; R35-Y44 PolarHBondContact NE-O 2.81Å; R35-Y44 PolarHBondContact NH1-O 3.16Å; R35-I46 HydrophobicContact CG-CD1 3.66Å
36	K	88.2	Confident	86.3	Confident	166 Å²	166	67 Å²	67	72%	0.722	35%	0.351	S	S	*	.	H	α-helix	trans	-69.1	-26.3	173.9	-68.8	179	-179.1	-175.8	0	114.5	T32 R33 Y34	T32-K36 WeakPolarHBondContact O-CG 3.43Å; R33-K36 PolarHBondContact O-N 3.32Å; Y34-K36 PolarHBondContact O-N 2.86Å
37	A	88.2	Confident	86	Confident	65 Å²	65	71.7 Å²	71.7	54%	0.537	37%	0.373	S	S	.	.	H	α-helix	trans	-83.7	-35.8	179.5	0	0	0	0	0	113	T10 R33 Y34	T10-A37 HydrophobicContact CG2-CB 4.38Å; R33-A37 WeakPolarHBondContact O-CB 3.29Å; R33-A37 PolarHBondContact O-N 3.22Å; Y34-A37 WeakPolarHBondContact O-CA 3.36Å; Y34-A37 WeakPolarHBondContact O-CB 3.35Å; Y34-A37 PolarHBondContact O-N 3.42Å
38	V	86.6	Confident	85.9	Confident	52 Å²	52	72 Å²	72	32%	0.315	38%	0.376	S	S	.	.	H	α-helix	trans	-85.8	-11.8	177.9	-174.1	0	0	0	0	112.2	T10 Y34 K40	T10-V38 HydrophobicContact CG2-CG2 4.26Å; Y34-V38 HydrophobicContact CD1-CG2 4.04Å; Y34-V38 HydrophobicContact CD2-CG2 4.14Å; Y34-V38 HydrophobicContact CE1-CB 4.29Å; Y34-V38 HydrophobicContact CE1-CG2 3.62Å; Y34-V38 HydrophobicContact CE2-CG2 3.71Å; Y34-V38 HydrophobicContact CG-CG2 4.32Å; Y34-V38 VanDerWaalsContact CZ-CG2 3.47Å; Y34-V38 PolarHBondContact O-N 2.82Å; V38-K40 HydrophobicContact CG1-CD 4.46Å; V38-K40 HydrophobicContact CG1-CG 4.25Å; V38-K40 PolarHBondContact O-N 3.43Å
39	A	79.6	Confident	85.8	Confident	89 Å²	89	70.7 Å²	70.7	74%	0.736	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	26	175.4	0	0	0	0	0	115.1	R35	R35-A39 PolarHBondContact O-N 3.41Å; R35-A39 VanDerWaalsContact O-N 3.15Å
40	K	76.2	Confident	85.8	Confident	72 Å²	72	72 Å²	72	31%	0.313	37%	0.371	S	S	.	.			trans	-78.3	161.2	166.9	-76	-173.6	170	-163.5	0	111.3	V38 Y44 D83	V38-K40 HydrophobicContact CG1-CD 4.46Å; V38-K40 HydrophobicContact CG1-CG 4.25Å; V38-K40 PolarHBondContact O-N 3.43Å; K40-Y44 HydrophobicContact CB-CD1 3.84Å; K40-Y44 HydrophobicContact CB-CD2 4.44Å; K40-Y44 HydrophobicContact CB-CE1 4.41Å; K40-Y44 HydrophobicContact CB-CG 3.81Å; K40-Y44 HydrophobicContact CD-CD1 3.72Å; K40-Y44 HydrophobicContact CD-CD2 3.6Å; K40-Y44 HydrophobicContact CD-CE1 3.52Å; K40-Y44 HydrophobicContact CD-CE2 3.41Å; K40-Y44 VanDerWaalsContact CD-CE2 3.41Å; K40-Y44 HydrophobicContact CD-CG 3.7Å; K40-Y44 HydrophobicContact CG-CD1 4.41Å; K40-Y44 HydrophobicContact CG-CG 4.41Å; K40-Y44 VanDerWaalsContact NZ-CZ 3.28Å; K40-Y44 PolarHBondContact NZ-OH 3.15Å; K40-D83 WeakPolarHBondContact CE-OD1 3.43Å; K40-D83 IonicContact NZ-OD1 3.96Å; K40-D83 PolarHBondContact NZ-OD1 2.92Å; K40-D83 IonicContact NZ-OD2 2.71Å; K40-D83 PolarHBondContact NZ-OD2 3.18Å
41	D	72.2	Confident	85.8	Confident	114 Å²	114	72 Å²	72	61%	0.61	37%	0.371	S	S	*	.			trans	-58.5	158.9	-175.2	-82.4	-69.8	0	0	0	114.8	N43 Y44	D41-N43 PolarHBondContact O-N 3.3Å; D41-N43 VanDerWaalsContact O-N 3.13Å; D41-Y44 WeakPolarHBondContact O-CB 3.44Å; D41-Y44 PolarHBondContact O-N 3.47Å
42	P	68.5	Low	85.8	Confident	109 Å²	109	73 Å²	73	71%	0.708	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.3	173.7	-24.9	34.7	0	0	0	113.7	Y44	P42-Y44 VanDerWaalsContact C-N 3.27Å; P42-Y44 PolarHBondContact O-N 2.97Å
43	N	72.7	Confident	85.8	Confident	125 Å²	125	71.1 Å²	71.1	67%	0.668	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.4	178.5	-64.9	-0.5	0	0	0	113.3	D41 W45 P84	D41-N43 PolarHBondContact O-N 3.3Å; D41-N43 VanDerWaalsContact O-N 3.13Å; N43-W45 PolarHBondContact O-N 2.94Å; N43-P84 HydrophobicContact CB-CB 4.2Å; N43-P84 HydrophobicContact CB-CG 4.49Å
44	Y	79.2	Confident	85.2	Confident	5 Å²	5	69.3 Å²	69.3	2%	0.02	38%	0.377	C	S	.	.			trans	-65.3	125	174.8	-176.3	-120.5	0	0	0	110.2	Y34 R35 K40 D41 P42 I46 E81 Q82 D83	Y34-Y44 HydrophobicContact CE1-CE1 4.36Å; R35-Y44 WeakPolarHBondContact CD-O 3.48Å; R35-Y44 PolarHBondContact NE-O 2.81Å; R35-Y44 PolarHBondContact NH1-O 3.16Å; K40-Y44 HydrophobicContact CB-CD1 3.84Å; K40-Y44 HydrophobicContact CB-CD2 4.44Å; K40-Y44 HydrophobicContact CB-CE1 4.41Å; K40-Y44 HydrophobicContact CB-CG 3.81Å; K40-Y44 HydrophobicContact CD-CD1 3.72Å; K40-Y44 HydrophobicContact CD-CD2 3.6Å; K40-Y44 HydrophobicContact CD-CE1 3.52Å; K40-Y44 HydrophobicContact CD-CE2 3.41Å; K40-Y44 VanDerWaalsContact CD-CE2 3.41Å; K40-Y44 HydrophobicContact CD-CG 3.7Å; K40-Y44 HydrophobicContact CG-CD1 4.41Å; K40-Y44 HydrophobicContact CG-CG 4.41Å; K40-Y44 VanDerWaalsContact NZ-CZ 3.28Å; K40-Y44 PolarHBondContact NZ-OH 3.15Å; D41-Y44 WeakPolarHBondContact O-CB 3.44Å; D41-Y44 PolarHBondContact O-N 3.47Å; P42-Y44 VanDerWaalsContact C-N 3.27Å; P42-Y44 PolarHBondContact O-N 2.97Å; Y44-I46 HydrophobicContact CD1-CD1 3.91Å; Y44-I46 HydrophobicContact CD1-CG1 3.85Å; Y44-I46 HydrophobicContact CE1-CD1 3.73Å; Y44-I46 HydrophobicContact CE1-CG1 3.67Å; Y44-E81 VanDerWaalsContact CE1-OE1 3.26Å; Y44-E81 WeakPolarHBondContact CE1-OE1 3.28Å; Y44-E81 HydrophobicContact CE2-CB 4.44Å; Y44-E81 VanDerWaalsContact CZ-OE1 3.28Å; Y44-E81 WeakPolarHBondContact OH-CB 3.22Å; Y44-E81 PolarHBondContact OH-OE1 3.47Å; Y44-E81 PolarHBondContact OH-OE2 2.94Å; Y44-Q82 WeakPolarHBondContact CD2-O 3.39Å; Y44-Q82 WeakPolarHBondContact CE2-O 3.41Å; Y44-D83 WeakPolarHBondContact CD2-OD1 3.37Å; Y44-D83 WeakPolarHBondContact CE2-OD1 3.44Å
45	W	80.9	Confident	84.7	Confident	106 Å²	106	75.6 Å²	75.6	40%	0.402	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.8	-174.6	63.6	-79	0	0	0	112.1	N43 Q82	N43-W45 PolarHBondContact O-N 2.94Å; W45-Q82 HydrophobicContact CD2-CB 4.04Å; W45-Q82 VanDerWaalsContact CE2-CB 3.47Å; W45-Q82 HydrophobicContact CH2-CB 4.15Å; W45-Q82 VanDerWaalsContact CH2-CD 3.43Å; W45-Q82 HydrophobicContact CH2-CG 4.06Å; W45-Q82 HydrophobicContact CZ2-CB 3.57Å; W45-Q82 HydrophobicContact CZ2-CG 3.88Å; W45-Q82 PolarHBondContact O-N 2.7Å
46	I	88.6	Confident	84.3	Confident	15 Å²	15	74.1 Å²	74.1	8%	0.077	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	125.1	-169.6	-55.3	174.2	0	0	0	105.8	V31 Y34 R35 Y44 F79 D80	V31-I46 HydrophobicContact CG1-CB 4.28Å; Y34-I46 HydrophobicContact CD1-CD1 3.19Å; Y34-I46 HydrophobicContact CE1-CD1 3.38Å; Y34-I46 HydrophobicContact CG-CD1 4.33Å; R35-I46 HydrophobicContact CG-CD1 3.66Å; Y44-I46 HydrophobicContact CD1-CD1 3.91Å; Y44-I46 HydrophobicContact CD1-CG1 3.85Å; Y44-I46 HydrophobicContact CE1-CD1 3.73Å; Y44-I46 HydrophobicContact CE1-CG1 3.67Å; I46-F79 HydrophobicContact CG2-CB 4.29Å; I46-F79 HydrophobicContact CG2-CD2 3.9Å; I46-F79 HydrophobicContact CG2-CG 4.48Å; I46-D80 WeakPolarHBondContact CA-O 3.37Å
47	Q	89.6	Confident	84.3	Confident	99 Å²	99	67.6 Å²	67.6	46%	0.463	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.8	177.3	175.9	169.6	-31.1	0	0	108.2	H49 F79 D80	Q47-H49 PolarHBondContact NE2-CE1 3.27Å; Q47-H49 VanDerWaalsContact NE2-CE1 3.3Å; Q47-H49 PolarHBondContact NE2-ND1 2.77Å; Q47-F79 CarbonylContact O-C 3.59Å; Q47-F79 WeakPolarHBondContact O-CA 3.27Å; Q47-F79 WeakPolarHBondContact O-CB 3.29Å; Q47-D80 PolarHBondContact N-O 3.01Å; Q47-D80 PolarHBondContact O-N 3.33Å
48	V	92.3	Very high	84.5	Confident	26 Å²	26	69.4 Å²	69.4	16%	0.158	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.8	170.4	178.9	0	0	0	0	107.6	F7 I27 V31 R50 A77 V78 F79	F7-V48 HydrophobicContact CE1-CG2 3.64Å; F7-V48 HydrophobicContact CZ-CG2 4.28Å; I27-V48 HydrophobicContact CD1-CG1 4.19Å; I27-V48 HydrophobicContact CG1-CG1 4.3Å; I27-V48 HydrophobicContact CG2-CB 3.75Å; I27-V48 HydrophobicContact CG2-CG1 4.06Å; I27-V48 HydrophobicContact CG2-CG2 4.04Å; V31-V48 HydrophobicContact CG2-CG2 3.5Å; V48-R50 WeakPolarHBondContact CG1-O 3.47Å; V48-A77 HydrophobicContact CG1-CB 4.31Å; V48-V78 CarbonylContact C-O 3.6Å; V48-F79 HydrophobicContact CB-CB 4.49Å; V48-F79 HydrophobicContact CG2-CB 4.03Å
49	H	91.7	Very high	84.9	Confident	79 Å²	79	67.3 Å²	67.3	37%	0.366	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-40.4	178.1	-64	-62.6	0	0	0	111.7	Q47 V78 D80	Q47-H49 PolarHBondContact NE2-CE1 3.27Å; Q47-H49 VanDerWaalsContact NE2-CE1 3.3Å; Q47-H49 PolarHBondContact NE2-ND1 2.77Å; H49-V78 PolarHBondContact N-O 3.34Å; H49-D80 IonicContact CD2-OD1 2.72Å; H49-D80 IonicContact CD2-OD2 3.18Å; H49-D80 IonicContact CE1-OD2 3.44Å; H49-D80 PolarHBondContact CE1-OD2 3.06Å; H49-D80 IonicContact NE2-OD1 2.69Å; H49-D80 PolarHBondContact NE2-OD1 3.28Å; H49-D80 IonicContact NE2-OD2 3.25Å; H49-D80 PolarHBondContact NE2-OD2 2.79Å
50	R	92.2	Very high	85.6	Confident	96 Å²	96	68.4 Å²	68.4	36%	0.362	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	164.5	177.7	59.9	-173.4	-171.3	-92.6	-7.8	112	V48 E52 I58 V78	V48-R50 WeakPolarHBondContact CG1-O 3.47Å; R50-E52 HydrophobicContact CG-CG 4.45Å; R50-E52 IonicContact CZ-OE1 3.55Å; R50-E52 IonicContact NE-OE1 3.73Å; R50-E52 PolarHBondContact NE-OE1 3.26Å; R50-E52 IonicContact NH2-OE1 3.86Å; R50-E52 PolarHBondContact NH2-OE1 3.43Å; R50-I58 HydrophobicContact CB-CG2 4.22Å; R50-V78 HydrophobicContact CG-CB 4Å; R50-V78 HydrophobicContact CG-CG2 4.12Å; R50-V78 PolarHBondContact O-N 3.49Å
51	L	95.2	Very high	86.3	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.3	164.2	-75.4	169.5	0	0	0	109.6	V5 V23 L26 I27 L59 L75 V76 A77	V5-L51 HydrophobicContact CG1-CD2 3.61Å; V5-L51 HydrophobicContact CG2-CD2 4.25Å; V23-L51 HydrophobicContact CG1-CD1 3.92Å; L26-L51 HydrophobicContact CD2-CD1 3.78Å; L26-L51 HydrophobicContact CG-CD1 4.16Å; I27-L51 HydrophobicContact CD1-CD1 4.02Å; I27-L51 HydrophobicContact CD1-CG 4.1Å; I27-L51 HydrophobicContact CG1-CD1 3.44Å; I27-L51 VanDerWaalsContact CG1-CD1 3.44Å; I27-L51 HydrophobicContact CG1-CG 3.81Å; L51-L59 HydrophobicContact CB-CB 4.27Å; L51-L59 HydrophobicContact CB-CD1 4.17Å; L51-L59 PolarHBondContact O-N 2.97Å; L51-L75 HydrophobicContact CD1-CD1 4.16Å; L51-L75 HydrophobicContact CD2-CB 4.19Å; L51-V76 CarbonylContact C-O 3.6Å; L51-V76 WeakPolarHBondContact CA-O 3.28Å; L51-A77 HydrophobicContact CD2-CB 4.06Å
52	E	94	Very high	87.3	Confident	39 Å²	39	68.5 Å²	68.5	18%	0.182	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.3	177.9	-66.4	175.3	171	0	0	109.8	R50 G57 I58 L75 V76 V78	R50-E52 HydrophobicContact CG-CG 4.45Å; R50-E52 IonicContact CZ-OE1 3.55Å; R50-E52 IonicContact NE-OE1 3.73Å; R50-E52 PolarHBondContact NE-OE1 3.26Å; R50-E52 IonicContact NH2-OE1 3.86Å; R50-E52 PolarHBondContact NH2-OE1 3.43Å; E52-G57 CarbonylContact C-O 3.51Å; E52-G57 WeakPolarHBondContact CA-O 3.46Å; E52-I58 HydrophobicContact CG-CG1 4.06Å; E52-L75 CarbonylContact O-C 3.5Å; E52-L75 VanDerWaalsContact O-CA 3.25Å; E52-L75 WeakPolarHBondContact O-CA 3.42Å; E52-V76 HydrophobicContact CB-CB 4.46Å; E52-V76 PolarHBondContact N-O 3.06Å; E52-V76 PolarHBondContact O-N 3.21Å; E52-V78 HydrophobicContact CG-CG2 4.28Å
53	H	90.9	Very high	88.6	Confident	38 Å²	38	66.2 Å²	66.2	18%	0.176	37%	0.365	C	S	.	.			trans	-73.8	166.3	168.3	-80.9	111.2	0	0	0	112	D55 G56 G57 L59 V68 L75	H53-D55 WeakPolarHBondContact CB-OD1 3.43Å; H53-D55 PolarHBondContact O-N 2.91Å; H53-D55 VanDerWaalsContact O-N 3.09Å; H53-G56 PolarHBondContact O-N 2.67Å; H53-G57 PolarHBondContact N-O 2.94Å; H53-L59 VanDerWaalsContact CE1-CD2 3.43Å; H53-L59 WeakPolarHBondContact CE1-CD2 3.37Å; H53-V68 PolarHBondContact CE1-O 2.83Å; H53-V68 PolarHBondContact NE2-O 3.45Å; H53-L75 WeakPolarHBondContact CD2-CD2 3.38Å
54	G	79.9	Confident	89.6	Confident	74 Å²	74	63.6 Å²	63.6	76%	0.763	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.4	177.1	0	0	0	0	0	115.5
55	D	82.3	Confident	90.3	Very high	141 Å²	141	63.3 Å²	63.3	75%	0.754	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-5.6	173.3	70.1	-16.9	0	0	0	113.7	H53 G57	H53-D55 WeakPolarHBondContact CB-OD1 3.43Å; H53-D55 PolarHBondContact O-N 2.91Å; H53-D55 VanDerWaalsContact O-N 3.09Å; D55-G57 PolarHBondContact OD1-N 2.75Å
56	G	81.7	Confident	90.8	Very high	46 Å²	46	61 Å²	61	47%	0.474	35%	0.348	S	S	.	.	S	Bend	trans	98.2	1.8	-176.5	0	0	0	0	0	115.8	H53 I58	H53-G56 PolarHBondContact O-N 2.67Å; G56-I58 PolarHBondContact O-N 3.19Å
57	G	88.8	Confident	91	Very high	29 Å²	29	66 Å²	66	30%	0.299	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-67.3	116.5	176.4	0	0	0	0	0	112.6	E52 H53 D55	E52-G57 CarbonylContact C-O 3.51Å; E52-G57 WeakPolarHBondContact CA-O 3.46Å; H53-G57 PolarHBondContact N-O 2.94Å; D55-G57 PolarHBondContact OD1-N 2.75Å
58	I	92.4	Very high	91.2	Very high	102 Å²	102	63.4 Å²	63.4	52%	0.523	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	138.3	176.4	-61.3	168.5	0	0	0	109.7	R50 E52 G56	R50-I58 HydrophobicContact CB-CG2 4.22Å; E52-I58 HydrophobicContact CG-CG1 4.06Å; G56-I58 PolarHBondContact O-N 3.19Å
59	L	93.6	Very high	91.1	Very high	8 Å²	8	62.5 Å²	62.5	4%	0.042	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.5	173	-74.9	176	0	0	0	111.2	V23 L51 H53 V68 L75	V23-L59 HydrophobicContact CG1-CB 3.94Å; V23-L59 HydrophobicContact CG1-CD1 4.49Å; V23-L59 HydrophobicContact CG2-CB 4.26Å; V23-L59 HydrophobicContact CG2-CD1 4.44Å; L51-L59 HydrophobicContact CB-CB 4.27Å; L51-L59 HydrophobicContact CB-CD1 4.17Å; L51-L59 PolarHBondContact O-N 2.97Å; H53-L59 VanDerWaalsContact CE1-CD2 3.43Å; H53-L59 WeakPolarHBondContact CE1-CD2 3.37Å; L59-V68 HydrophobicContact CD2-CB 3.6Å; L59-V68 HydrophobicContact CD2-CG1 4.4Å; L59-V68 HydrophobicContact CD2-CG2 3.52Å; L59-L75 HydrophobicContact CD1-CD1 3.51Å; L59-L75 HydrophobicContact CD1-CD2 3.69Å; L59-L75 HydrophobicContact CD1-CG 4.22Å
60	D	94.3	Very high	91.1	Very high	112 Å²	112	64.5 Å²	64.5	60%	0.599	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-75.1	142.8	175.4	-83.7	-39.7	0	0	0	111.4	V23 D62 D63	V23-D60 VanDerWaalsContact CB-O 3.27Å; V23-D60 WeakPolarHBondContact CB-O 3.35Å; V23-D60 WeakPolarHBondContact CG2-O 3.48Å; D60-D62 PolarHBondContact O-N 3.06Å; D60-D63 PolarHBondContact O-N 3.21Å
61	L	91.7	Very high	91.1	Very high	77 Å²	77	62.8 Å²	62.8	40%	0.403	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.7	-170.5	-63.5	178.5	0	0	0	113.4	F24 I27	F24-L61 HydrophobicContact CB-CB 4.38Å; F24-L61 VanDerWaalsContact CB-O 3.26Å; F24-L61 WeakPolarHBondContact CB-O 3.27Å; F24-L61 PolarHBondContact N-O 3.22Å; I27-L61 HydrophobicContact CD1-CD2 3.43Å; I27-L61 VanDerWaalsContact CD1-CD2 3.43Å
62	D	93.9	Very high	90.7	Very high	112 Å²	112	69.8 Å²	69.8	60%	0.599	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-10.7	-176	-85.4	-58.8	0	0	0	114.5	K22 D60	K22-D62 WeakPolarHBondContact CD-O 3.37Å; K22-D62 WeakPolarHBondContact CE-O 3.33Å; K22-D62 PolarHBondContact NZ-O 3.1Å; K22-D62 IonicContact NZ-OD1 2.64Å; K22-D62 PolarHBondContact NZ-OD1 2.88Å; D60-D62 PolarHBondContact O-N 3.06Å
63	D	94.6	Very high	90.7	Very high	60 Å²	60	70.6 Å²	70.6	32%	0.321	41%	0.409	S	S	.	.	S	Bend	trans	-65.4	147.3	-179.9	-70.8	-22.8	0	0	0	112.2	K22 V23 D60 V68	K22-D63 CarbonylContact C-O 3.53Å; K22-D63 WeakPolarHBondContact CA-O 3.41Å; V23-D63 HydrophobicContact CG2-CB 4.01Å; V23-D63 PolarHBondContact N-O 3.45Å; D60-D63 PolarHBondContact O-N 3.21Å; D63-V68 HydrophobicContact CB-CG1 3.94Å; D63-V68 HydrophobicContact CB-CG2 4.25Å
64	I	93.8	Very high	90.8	Very high	70 Å²	70	75.8 Å²	75.8	36%	0.359	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-82.3	125	173.1	-49.5	-178.5	0	0	0	108	C66 D67	I64-C66 VanDerWaalsContact C-N 3.27Å; I64-C66 VanDerWaalsContact CG2-SG 3.58Å; I64-C66 PolarHBondContact O-N 3.25Å; I64-C66 VanDerWaalsContact O-N 3.12Å; I64-D67 WeakPolarHBondContact O-CB 3.4Å; I64-D67 PolarHBondContact O-N 3.2Å
65	L	93.6	Very high	91.5	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-61.5	-30.8	-165.9	-169.8	69	0	0	0	114	M1 V3 C16 G19 M21 V23 L26 D67 V68 A69	M1-L65 HydrophobicContact CE-CB 3.89Å; M1-L65 HydrophobicContact CE-CD2 3.58Å; M1-L65 HydrophobicContact CE-CG 3.46Å; M1-L65 VanDerWaalsContact CE-CG 3.46Å; V3-L65 HydrophobicContact CG2-CD2 3.95Å; C16-L65 HydrophobicContact CB-CD2 3.8Å; C16-L65 WeakPolarHBondContact SG-CD2 3.3Å; G19-L65 PolarHBondContact O-N 3.37Å; M21-L65 HydrophobicContact CG-CB 4.47Å; M21-L65 HydrophobicContact CG-CD2 4.36Å; M21-L65 VanDerWaalsContact O-CB 3.28Å; M21-L65 WeakPolarHBondContact O-CB 3.49Å; M21-L65 PolarHBondContact O-N 3.01Å; V23-L65 HydrophobicContact CG2-CD1 4.13Å; L26-L65 HydrophobicContact CB-CD2 4.26Å; L26-L65 HydrophobicContact CD1-CD2 4.43Å; L26-L65 HydrophobicContact CD2-CD1 3.56Å; L26-L65 HydrophobicContact CD2-CD2 3.79Å; L26-L65 HydrophobicContact CD2-CG 4.34Å; L26-L65 HydrophobicContact CG-CD2 4.38Å; L65-D67 PolarHBondContact O-N 3.35Å; L65-V68 HydrophobicContact CD1-CG2 4.42Å; L65-V68 PolarHBondContact O-N 2.96Å; L65-A69 HydrophobicContact CD1-CB 3.99Å; L65-A69 HydrophobicContact CG-CB 4.45Å; L65-A69 PolarHBondContact O-N 3.44Å; L65-A69 VanDerWaalsContact O-O 3.14Å
66	C	92.3	Very high	92.1	Very high	56 Å²	56	68.5 Å²	68.5	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-16.6	176	53.1	0	0	0	0	114.7	M1 G19 I64	M1-C66 HydrophobicContact CE-CB 4.48Å; M1-C66 HydrophobicContact SD-CB 3.98Å; G19-C66 PolarHBondContact O-N 2.94Å; G19-C66 VanDerWaalsContact O-N 3.15Å; I64-C66 VanDerWaalsContact C-N 3.27Å; I64-C66 VanDerWaalsContact CG2-SG 3.58Å; I64-C66 PolarHBondContact O-N 3.25Å; I64-C66 VanDerWaalsContact O-N 3.12Å
67	D	93.4	Very high	92.8	Very high	120 Å²	120	66.5 Å²	66.5	64%	0.642	35%	0.351	S	S	*	.	H	α-helix	trans	-90.8	-10.9	-178.4	-54.3	-8.5	0	0	0	110.8	I64 L65	I64-D67 WeakPolarHBondContact O-CB 3.4Å; I64-D67 PolarHBondContact O-N 3.2Å; L65-D67 PolarHBondContact O-N 3.35Å
68	V	91.9	Very high	93	Very high	45 Å²	45	67 Å²	67	27%	0.273	35%	0.349	S	S	.	.	H	α-helix	trans	-132.3	-18.7	-171	-61.2	0	0	0	0	115.5	V23 H53 L59 D63 L65	V23-V68 HydrophobicContact CG2-CG2 4.18Å; H53-V68 PolarHBondContact CE1-O 2.83Å; H53-V68 PolarHBondContact NE2-O 3.45Å; L59-V68 HydrophobicContact CD2-CB 3.6Å; L59-V68 HydrophobicContact CD2-CG1 4.4Å; L59-V68 HydrophobicContact CD2-CG2 3.52Å; D63-V68 HydrophobicContact CB-CG1 3.94Å; D63-V68 HydrophobicContact CB-CG2 4.25Å; L65-V68 HydrophobicContact CD1-CG2 4.42Å; L65-V68 PolarHBondContact O-N 2.96Å
69	A	91.5	Very high	93	Very high	8 Å²	8	64.1 Å²	64.1	7%	0.066	33%	0.332	C	S	.	.			trans	-147.9	142	-178.4	0	0	0	0	0	113.5	M1 L65	M1-A69 WeakPolarHBondContact CE-O 3.44Å; L65-A69 HydrophobicContact CD1-CB 3.99Å; L65-A69 HydrophobicContact CG-CB 4.45Å; L65-A69 PolarHBondContact O-N 3.44Å; L65-A69 VanDerWaalsContact O-O 3.14Å
70	D	91.6	Very high	92.9	Very high	120 Å²	120	67.8 Å²	67.8	64%	0.642	35%	0.352	S	S	*	.			trans	-92.6	170.9	-165.6	-129.4	-31.3	0	0	0	114.7	K72 D73	D70-K72 PolarHBondContact O-N 2.69Å; D70-D73 WeakPolarHBondContact CB-OD2 3.4Å; D70-D73 PolarHBondContact N-OD2 3.25Å; D70-D73 WeakPolarHBondContact O-CB 3.44Å; D70-D73 PolarHBondContact O-N 3.12Å
71	D	91.3	Very high	92.4	Very high	61 Å²	61	66 Å²	66	33%	0.326	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	115.3	175.1	-172.5	70.5	0	0	0	112.1	M1 K2	M1-D71 WeakPolarHBondContact CA-OD1 3.28Å; M1-D71 HydrophobicContact CG-CB 4.17Å; K2-D71 PolarHBondContact N-OD1 3.44Å
72	K	88.3	Confident	91.3	Very high	147 Å²	147	67 Å²	67	64%	0.639	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	10.6	-175.6	-48.8	158.7	-151.5	73.8	0	114.8	K2 D70	K2-K72 WeakPolarHBondContact O-CA 3.46Å; K2-K72 PolarHBondContact O-N 2.88Å; D70-K72 PolarHBondContact O-N 2.69Å
73	D	92.5	Very high	89.9	Confident	57 Å²	57	65.5 Å²	65.5	31%	0.305	33%	0.334	S	S	.	.			trans	-60.7	161.9	-178.3	-116.2	-28.9	0	0	0	114.7	T4 D70	T4-D73 WeakPolarHBondContact CB-O 3.32Å; T4-D73 PolarHBondContact N-O 3.4Å; D70-D73 WeakPolarHBondContact CB-OD2 3.4Å; D70-D73 PolarHBondContact N-OD2 3.25Å; D70-D73 WeakPolarHBondContact O-CB 3.44Å; D70-D73 PolarHBondContact O-N 3.12Å
74	R	93.6	Very high	88	Confident	147 Å²	147	65.6 Å²	65.6	56%	0.555	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	100	-176.5	-66.9	-172.1	178	-174.8	3.3	111.7	T4	T4-R74 WeakPolarHBondContact O-CA 3.46Å
75	L	95.4	Very high	86.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	148.4	174.3	-54.3	177.6	0	0	0	110.2	V3 T4 V5 C6 L26 L51 E52 H53 L59	V3-L75 HydrophobicContact CG1-CD1 3.64Å; V3-L75 HydrophobicContact CG1-CG 3.8Å; T4-L75 PolarHBondContact O-N 3.06Å; V5-L75 CarbonylContact C-O 3.54Å; V5-L75 WeakPolarHBondContact CA-O 2.93Å; C6-L75 WeakPolarHBondContact CB-O 3.43Å; C6-L75 PolarHBondContact N-O 3.01Å; C6-L75 PolarHBondContact SG-O 3.43Å; L26-L75 HydrophobicContact CD2-CD1 3.68Å; L51-L75 HydrophobicContact CD1-CD1 4.16Å; L51-L75 HydrophobicContact CD2-CB 4.19Å; E52-L75 CarbonylContact O-C 3.5Å; E52-L75 VanDerWaalsContact O-CA 3.25Å; E52-L75 WeakPolarHBondContact O-CA 3.42Å; H53-L75 WeakPolarHBondContact CD2-CD2 3.38Å; L59-L75 HydrophobicContact CD1-CD1 3.51Å; L59-L75 HydrophobicContact CD1-CD2 3.69Å; L59-L75 HydrophobicContact CD1-CG 4.22Å
76	V	95.2	Very high	84	Confident	61 Å²	61	79.1 Å²	79.1	37%	0.37	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.7	171.3	-177.3	0	0	0	0	107.8	L51 E52	L51-V76 CarbonylContact C-O 3.6Å; L51-V76 WeakPolarHBondContact CA-O 3.28Å; E52-V76 HydrophobicContact CB-CB 4.46Å; E52-V76 PolarHBondContact N-O 3.06Å; E52-V76 PolarHBondContact O-N 3.21Å
77	A	95.2	Very high	81.3	Confident	5 Å²	5	80.2 Å²	80.2	4%	0.041	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.6	168.6	0	0	0	0	0	109.1	V5 C6 F7 V48 L51 F79	V5-A77 HydrophobicContact CG1-CB 3.88Å; C6-A77 PolarHBondContact O-N 3.44Å; F7-A77 HydrophobicContact CD1-CB 3.82Å; F7-A77 HydrophobicContact CE1-CB 3.95Å; F7-A77 HydrophobicContact CG-CB 4.14Å; F7-A77 HydrophobicContact CZ-CB 4.37Å; V48-A77 HydrophobicContact CG1-CB 4.31Å; L51-A77 HydrophobicContact CD2-CB 4.06Å; A77-F79 HydrophobicContact CB-CD1 4.08Å; A77-F79 VanDerWaalsContact O-CD1 3.32Å; A77-F79 WeakPolarHBondContact O-CD1 3.49Å
78	V	93.4	Very high	78.7	Confident	39 Å²	39	77.1 Å²	77.1	24%	0.236	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.2	163.5	-179	0	0	0	0	106.5	V48 H49 R50 E52	V48-V78 CarbonylContact C-O 3.6Å; H49-V78 PolarHBondContact N-O 3.34Å; R50-V78 HydrophobicContact CG-CB 4Å; R50-V78 HydrophobicContact CG-CG2 4.12Å; R50-V78 PolarHBondContact O-N 3.49Å; E52-V78 HydrophobicContact CG-CG2 4.28Å
79	F	92.9	Very high	76.1	Confident	41 Å²	41	83 Å²	83	18%	0.18	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	146.1	-167.6	66.5	-71.5	0	0	0	112.7	F7 I46 Q47 V48 A77 E81	F7-F79 VanDerWaalsContact C-CE1 3.48Å; F7-F79 VanDerWaalsContact CA-CE1 3.44Å; F7-F79 HydrophobicContact CB-CD1 4.37Å; F7-F79 HydrophobicContact CB-CE1 3.74Å; F7-F79 HydrophobicContact CB-CE2 4.25Å; F7-F79 HydrophobicContact CB-CZ 3.66Å; F7-F79 AromaticContact CD1-CD1 3.89Å; F7-F79 HydrophobicContact CD1-CD1 3.89Å; F7-F79 HydrophobicContact CD1-CD2 4.03Å; F7-F79 HydrophobicContact CD1-CE1 4.1Å; F7-F79 HydrophobicContact CD1-CE2 4.17Å; F7-F79 AromaticContact CD1-CG 3.88Å; F7-F79 HydrophobicContact CD1-CG 3.88Å; F7-F79 HydrophobicContact CD1-CZ 4.24Å; F7-F79 HydrophobicContact CG-CE1 4.38Å; F7-F79 HydrophobicContact CG-CZ 4.48Å; I46-F79 HydrophobicContact CG2-CB 4.29Å; I46-F79 HydrophobicContact CG2-CD2 3.9Å; I46-F79 HydrophobicContact CG2-CG 4.48Å; Q47-F79 CarbonylContact O-C 3.59Å; Q47-F79 WeakPolarHBondContact O-CA 3.27Å; Q47-F79 WeakPolarHBondContact O-CB 3.29Å; V48-F79 HydrophobicContact CB-CB 4.49Å; V48-F79 HydrophobicContact CG2-CB 4.03Å; A77-F79 HydrophobicContact CB-CD1 4.08Å; A77-F79 VanDerWaalsContact O-CD1 3.32Å; A77-F79 WeakPolarHBondContact O-CD1 3.49Å; F79-E81 HydrophobicContact CD2-CG 3.66Å; F79-E81 HydrophobicContact CE2-CG 3.56Å
80	D	90	Very high	73.7	Confident	85 Å²	85	85.6 Å²	85.6	46%	0.455	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.5	166.4	-63.4	-19.4	0	0	0	110.1	I46 Q47 H49	I46-D80 WeakPolarHBondContact CA-O 3.37Å; Q47-D80 PolarHBondContact N-O 3.01Å; Q47-D80 PolarHBondContact O-N 3.33Å; H49-D80 IonicContact CD2-OD1 2.72Å; H49-D80 IonicContact CD2-OD2 3.18Å; H49-D80 IonicContact CE1-OD2 3.44Å; H49-D80 PolarHBondContact CE1-OD2 3.06Å; H49-D80 IonicContact NE2-OD1 2.69Å; H49-D80 PolarHBondContact NE2-OD1 3.28Å; H49-D80 IonicContact NE2-OD2 3.25Å; H49-D80 PolarHBondContact NE2-OD2 2.79Å
81	E	85.1	Confident	71.5	Confident	75 Å²	75	86.2 Å²	86.2	35%	0.35	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.5	172.6	-60.1	-167.7	103.7	0	0	109.6	Y34 Y44 F79	Y34-E81 WeakPolarHBondContact CE1-OE1 3.47Å; Y34-E81 VanDerWaalsContact CZ-OE1 3.3Å; Y34-E81 VanDerWaalsContact OH-CD 3.29Å; Y34-E81 PolarHBondContact OH-OE1 3.13Å; Y34-E81 PolarHBondContact OH-OE2 2.92Å; Y44-E81 VanDerWaalsContact CE1-OE1 3.26Å; Y44-E81 WeakPolarHBondContact CE1-OE1 3.28Å; Y44-E81 HydrophobicContact CE2-CB 4.44Å; Y44-E81 VanDerWaalsContact CZ-OE1 3.28Å; Y44-E81 WeakPolarHBondContact OH-CB 3.22Å; Y44-E81 PolarHBondContact OH-OE1 3.47Å; Y44-E81 PolarHBondContact OH-OE2 2.94Å; F79-E81 HydrophobicContact CD2-CG 3.66Å; F79-E81 HydrophobicContact CE2-CG 3.56Å
82	Q	69	Low	69.1	Low	97 Å²	97	88.9 Å²	88.9	45%	0.453	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	131.3	167.6	-73.6	-167.8	35.5	0	0	110.5	Y44 W45	Y44-Q82 WeakPolarHBondContact CD2-O 3.39Å; Y44-Q82 WeakPolarHBondContact CE2-O 3.41Å; W45-Q82 HydrophobicContact CD2-CB 4.04Å; W45-Q82 VanDerWaalsContact CE2-CB 3.47Å; W45-Q82 HydrophobicContact CH2-CB 4.15Å; W45-Q82 VanDerWaalsContact CH2-CD 3.43Å; W45-Q82 HydrophobicContact CH2-CG 4.06Å; W45-Q82 HydrophobicContact CZ2-CB 3.57Å; W45-Q82 HydrophobicContact CZ2-CG 3.88Å; W45-Q82 PolarHBondContact O-N 2.7Å
83	D	63.1	Low	66.9	Low	81 Å²	81	85.7 Å²	85.7	43%	0.433	51%	0.507	S	S	.	.			trans	-72.1	149.3	171.5	-81.8	-51.7	0	0	0	110.7	K40 Y44 H85	K40-D83 WeakPolarHBondContact CE-OD1 3.43Å; K40-D83 IonicContact NZ-OD1 3.96Å; K40-D83 PolarHBondContact NZ-OD1 2.92Å; K40-D83 IonicContact NZ-OD2 2.71Å; K40-D83 PolarHBondContact NZ-OD2 3.18Å; Y44-D83 WeakPolarHBondContact CD2-OD1 3.37Å; Y44-D83 WeakPolarHBondContact CE2-OD1 3.44Å; D83-H85 VanDerWaalsContact C-N 3.32Å; D83-H85 PolarHBondContact O-CD2 3.36Å; D83-H85 PolarHBondContact O-N 2.88Å
84	P	55.8	Low	64.3	Low	62 Å²	62	88.2 Å²	88.2	40%	0.403	53%	0.529	S	S	.	.			trans	-73.8	82.4	-173.6	30.1	-35.7	0	0	0	111.4	N43 H86	N43-P84 HydrophobicContact CB-CB 4.2Å; N43-P84 HydrophobicContact CB-CG 4.49Å; P84-H86 PolarHBondContact O-N 3.44Å
85	H	52.2	Low	62	Low	166 Å²	166	90.4 Å²	90.4	77%	0.769	54%	0.543	S	S	*	.			trans	-59.4	134	174.5	-79.2	-82.7	0	0	0	111.7	D83 G87	D83-H85 VanDerWaalsContact C-N 3.32Å; D83-H85 PolarHBondContact O-CD2 3.36Å; D83-H85 PolarHBondContact O-N 2.88Å; H85-G87 PolarHBondContact O-N 2.99Å
86	H	49.7	Very low	59.4	Low	189 Å²	189	96.5 Å²	96.5	88%	0.875	58%	0.58	S	S	*	*			trans	-64.4	114.6	174.7	-74.7	-77.6	0	0	0	111	P84	P84-H86 PolarHBondContact O-N 3.44Å
87	G	37	Very low	56.7	Low	79 Å²	79	96.5 Å²	96.5	81%	0.814	59%	0.592	S	S	*	*			trans	-87.7	127.9	161.6	0	0	0	0	0	110.5	H85	H85-G87 PolarHBondContact O-N 2.99Å
88	G	37.6	Very low	54.4	Low	54 Å²	54	101.8 Å²	101.8	56%	0.557	63%	0.625	S	S	*	*			trans	77.3	156.1	176.4	0	0	0	0	0	115.3
89	D	37.4	Very low	51.8	Low	169 Å²	169	108.3 Å²	108.3	90%	0.904	65%	0.652	S	S	*	*			cis	-159.7	146	-10.5	-99.6	-37	0	0	0	110.5
90	G	41.4	Very low	49.1	Very low	63 Å²	63	111.8 Å²	111.8	65%	0.649	68%	0.682	S	S	*	*			trans	94.3	154.7	142.5	0	0	0	0	0	121.1
91	T	44.7	Very low	47	Very low	132 Å²	132	113.5 Å²	113.5	81%	0.81	70%	0.697	S	S	*	*			trans	76.6	101.3	157.3	63.8	0	0	0	0	120.5
92	S	42.7	Very low	44.8	Very low	118 Å²	118	117.7 Å²	117.7	83%	0.825	72%	0.717	S	S	*	*				75.5	146.1	123.6	-55.5	0	0	0	0	121.1
93	A	40.4	Very low	43.6	Very low	80 Å²	80	118.4 Å²	118.4	66%	0.661	72%	0.723	S	S	*	*			cis	-172.2	157.9	-19.8	0	0	0	0	0	110.3
94	S	38.8	Very low	42.5	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	75%	0.745	S	S	*	*			trans	66.8	162.9	152.7	-57	0	0	0	0	118.6
95	F	45.6	Very low	41.6	Very low	193 Å²	193	124.4 Å²	124.4	85%	0.846	76%	0.757	S	S	*	*			cis	-158.9	167.6	-32.4	-119.9	-101	0	0	0	104
96	T	40.8	Very low	40.9	Very low	127 Å²	127	121.4 Å²	121.4	78%	0.779	76%	0.755	S	S	*	*			cis	-114.4	-146	8.6	64.5	0	0	0	0	110.1
97	G	38.5	Very low	40.4	Very low	61 Å²	61	119.5 Å²	119.5	63%	0.629	75%	0.747	S	S	*	*			cis	140.9	140	0.6	0	0	0	0	0	110.1
98	T	46	Very low	40.5	Very low	117 Å²	117	124 Å²	124	72%	0.718	75%	0.751	S	S	*	*			cis	-159.1	149.2	4.1	44.4	0	0	0	0	112
99	Q	39.5	Very low	40.5	Very low	176 Å²	176	124.4 Å²	124.4	82%	0.822	76%	0.755	S	S	*	*			trans	65.8	116.6	157.7	-64.5	163.1	29.4	0	0	116.4
100	S	35.6	Very low	40.4	Very low	113 Å²	113	122.4 Å²	122.4	79%	0.79	75%	0.749	S	S	*	*			cis	88.8	157.7	28.1	-38.1	0	0	0	0	113.6
101	P	45.8	Very low	40.1	Very low	121 Å²	121	126.1 Å²	126.1	79%	0.786	75%	0.754	S	S	*	*				-126.5	-157.7	-104.2	33.5	-11.1	0	0	0	112.7
102	E	39.6	Very low	39.7	Very low	164 Å²	164	126.1 Å²	126.1	77%	0.766	75%	0.749	S	S	*	*				178.2	121.7	127	-89	-165.4	164.8	0	0	111.7
103	I	42.8	Very low	39.5	Very low	111 Å²	111	125.9 Å²	125.9	57%	0.569	74%	0.743	S	S	*	*				86.5	143.7	101.8	-52.9	167.9	0	0	0	115.4
104	F	41	Very low	39.3	Very low	204 Å²	204	127 Å²	127	90%	0.895	75%	0.746	S	S	*	*			trans	75.8	121.4	176	-48.6	-70.3	0	0	0	116.5
105	G	37.1	Very low	39.3	Very low	65 Å²	65	125.9 Å²	125.9	67%	0.67	74%	0.744	S	S	*	*			cis	170.5	176.7	-6.7	0	0	0	0	0	112.2
106	S	37.2	Very low	38.8	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	74%	0.737	S	S	*	*			trans	63.2	127.8	153.3	-63.5	0	0	0	0	119.5
107	E	38.4	Very low	38.4	Very low	150 Å²	150	125.5 Å²	125.5	70%	0.701	73%	0.733	S	S	*	*			cis	-151.5	156	-6.9	-64.6	-57.7	155.3	0	0	108.7
108	L	40.7	Very low	38.4	Very low	172 Å²	172	128.3 Å²	128.3	90%	0.901	74%	0.74	S	S	*	*			trans	55.6	132.5	165.5	-80.6	71.4	0	0	0	118.9
109	G	36.1	Very low	37.8	Very low	63 Å²	63	131.3 Å²	131.3	65%	0.649	74%	0.74	S	S	*	*			cis	175.9	149	-5.6	0	0	0	0	0	114.9
110	T	34.9	Very low	37.8	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	73%	0.732	S	S	*	*			trans	63.5	113.7	159.9	56.6	0	0	0	0	120.9
111	N	36.2	Very low	38	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	74%	0.738	S	S	*	*			trans	82.6	148.1	133.9	-64.9	-21.1	0	0	0	121.1
112	N	35.3	Very low	37.7	Very low	132 Å²	132	129.4 Å²	129.4	71%	0.706	74%	0.735	S	S	*	*			cis	-175.1	164.7	-37	-127.9	-39.5	0	0	0	109.2
113	V	39.8	Very low	37.9	Very low	113 Å²	113	126.3 Å²	126.3	69%	0.685	73%	0.732	S	S	*	*			trans	55	109.7	153	176.6	0	0	0	0	116.2
114	S	36.4	Very low	37.9	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	75%	0.748	S	S	*	*			cis	60.8	59.9	48	-153.8	0	0	0	0	115.2
115	A	37.3	Very low	38.2	Very low	88 Å²	88	128 Å²	128	73%	0.727	74%	0.743	S	S	*	*			trans	-130	108.9	158.4	0	0	0	0	0	108
116	F	34.9	Very low	38.9	Very low	163 Å²	163	132.7 Å²	132.7	72%	0.715	75%	0.747	S	S	*	*				64.4	113.4	67	-80.8	-89.2	0	0	0	115.6
117	Q	33.9	Very low	39.3	Very low	149 Å²	149	132.7 Å²	132.7	70%	0.696	74%	0.743	S	S	*	*			trans	67.6	141.8	145.4	-72.4	170.8	-34.8	0	0	120.4	Y119	Q117-Y119 HydrophobicContact CB-CE2 4.41Å
118	P	37.1	Very low	40.1	Very low	120 Å²	120	128.4 Å²	128.4	78%	0.779	73%	0.727	S	S	*	*			trans	-93.5	126.5	-179.2	35.3	-31.4	0	0	0	112.2
119	Y	33.7	Very low	40.8	Very low	179 Å²	179	123.9 Å²	123.9	70%	0.702	71%	0.708	S	S	*	*			trans	-136.1	115.2	171.5	-84.8	-79.7	0	0	0	114.6	Q117	Q117-Y119 HydrophobicContact CB-CE2 4.41Å
120	Q	40.1	Very low	42	Very low	143 Å²	143	124.4 Å²	124.4	67%	0.668	70%	0.702	S	S	*	*			trans	48.1	112.7	137.6	-66.1	173	-11.3	0	0	119.1	T122	Q120-T122 PolarHBondContact O-N 2.85Å
121	A	39.4	Very low	43.2	Very low	110 Å²	110	123.4 Å²	123.4	91%	0.909	70%	0.695	S	S	*	*	S	Bend	trans	-71.4	63.9	158	0	0	0	0	0	112
122	T	40.7	Very low	44.1	Very low	118 Å²	118	123.2 Å²	123.2	72%	0.724	69%	0.694	S	S	*	*			trans	-133.7	42.5	161.2	57.2	0	0	0	0	110.4	Q120	Q120-T122 PolarHBondContact O-N 2.85Å
123	S	42.6	Very low	45.2	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	69%	0.692	S	S	*	*	S	Bend	trans	-134.7	133.7	168	-70	0	0	0	0	108.1	I125	S123-I125 PolarHBondContact O-N 3.21Å
124	E	42.8	Very low	45.9	Very low	197 Å²	197	123.4 Å²	123.4	92%	0.921	69%	0.687	S	S	*	*			trans	-73.1	108.9	179.1	-66.2	169.5	126.3	0	0	109.4	E126	E124-E126 PolarHBondContact O-N 3.15Å; E124-E126 VanDerWaalsContact O-N 3.12Å
125	I	48.3	Very low	46.4	Very low	152 Å²	152	125.8 Å²	125.8	78%	0.779	69%	0.692	S	S	*	*			trans	-79.7	93.2	166.6	-60.5	-179.5	0	0	0	106.9	S123 V127	S123-I125 PolarHBondContact O-N 3.21Å; I125-V127 WeakPolarHBondContact O-CG2 3.48Å; I125-V127 PolarHBondContact O-N 2.99Å
126	E	50.6	Low	46.7	Very low	164 Å²	164	129.4 Å²	129.4	77%	0.766	70%	0.696	S	S	*	*			trans	-58.3	106.9	171.9	-173.5	173.7	-145.5	0	0	109	E124 T128	E124-E126 PolarHBondContact O-N 3.15Å; E124-E126 VanDerWaalsContact O-N 3.12Å; E126-T128 PolarHBondContact O-N 3.34Å; E126-T128 PolarHBondContact O-OG1 2.76Å
127	V	46.9	Very low	47.6	Very low	104 Å²	104	126 Å²	126	63%	0.63	69%	0.69	S	S	*	*			trans	-73.8	69.6	-176.1	-171.6	0	0	0	0	109.9	I125 L132	I125-V127 WeakPolarHBondContact O-CG2 3.48Å; I125-V127 PolarHBondContact O-N 2.99Å; V127-L132 HydrophobicContact CG1-CD1 3.86Å; V127-L132 HydrophobicContact CG1-CG 4.26Å
128	T	55.1	Low	48.1	Very low	59 Å²	59	126.3 Å²	126.3	36%	0.362	70%	0.696	S	S	.	*			trans	-61.6	124.7	174.9	-62	0	0	0	0	107.7	E126 S130 V131	E126-T128 PolarHBondContact O-N 3.34Å; E126-T128 PolarHBondContact O-OG1 2.76Å; T128-S130 PolarHBondContact O-N 3.14Å; T128-V131 PolarHBondContact O-N 3.37Å
129	P	55.6	Low	48.6	Very low	78 Å²	78	128.8 Å²	128.8	51%	0.506	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-1.4	-172	26	-35.3	0	0	0	114.1	R133	P129-R133 WeakPolarHBondContact O-CG 3.24Å; P129-R133 PolarHBondContact O-NE 2.99Å; P129-R133 PolarHBondContact O-NH1 3.41Å; P129-R133 VanDerWaalsContact O-NH1 3.16Å; P129-R133 PolarHBondContact O-NH2 2.8Å
130	S	60.4	Low	49.1	Very low	73 Å²	73	126 Å²	126	51%	0.51	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.6	-38.8	165.5	-52.6	0	0	0	0	113.1	T128 L132 R133	T128-S130 PolarHBondContact O-N 3.14Å; S130-L132 PolarHBondContact O-N 3.19Å; S130-R133 PolarHBondContact O-N 3.04Å
131	V	59.9	Low	49.2	Very low	107 Å²	107	131.3 Å²	131.3	65%	0.648	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-69	-37.3	-174.4	-176.5	0	0	0	0	111.1	T128 R133	T128-V131 PolarHBondContact O-N 3.37Å; V131-R133 PolarHBondContact O-N 3.37Å
132	L	55.9	Low	49.6	Very low	137 Å²	137	136.3 Å²	136.3	72%	0.717	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-73.5	1.8	178	-66.2	175.9	0	0	0	114.8	V127 S130	V127-L132 HydrophobicContact CG1-CD1 3.86Å; V127-L132 HydrophobicContact CG1-CG 4.26Å; S130-L132 PolarHBondContact O-N 3.19Å
133	R	57.6	Low	49.6	Very low	176 Å²	176	135.7 Å²	135.7	66%	0.664	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-111.7	-2.6	178.6	-61.4	-170.2	-145.2	100.7	-2.3	114.5	P129 S130 V131	P129-R133 WeakPolarHBondContact O-CG 3.24Å; P129-R133 PolarHBondContact O-NE 2.99Å; P129-R133 PolarHBondContact O-NH1 3.41Å; P129-R133 VanDerWaalsContact O-NH1 3.16Å; P129-R133 PolarHBondContact O-NH2 2.8Å; S130-R133 PolarHBondContact O-N 3.04Å; V131-R133 PolarHBondContact O-N 3.37Å
134	A	54.9	Low	49.5	Very low	72 Å²	72	136 Å²	136	60%	0.595	71%	0.71	S	S	*	*	S	Bend	trans	-96.8	-19.8	-162.5	0	0	0	0	0	115.9
135	N	46	Very low	49.4	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	71%	0.705	S	S	*	*	S	Bend	trans	-145	137.4	176.6	-90.6	-55.8	0	0	0	111.4
136	M	44.3	Very low	49.2	Very low	164 Å²	164	131.9 Å²	131.9	81%	0.808	70%	0.702	S	S	*	*			trans	62.4	69.4	-169.7	-62.4	-161.2	72.3	0	0	117.6	L138	M136-L138 PolarHBondContact O-N 2.83Å
137	P	54.4	Low	48.6	Very low	92 Å²	92	128.2 Å²	128.2	60%	0.597	70%	0.7	S	S	*	*			trans	-70.9	113.3	157.3	-2.8	20.2	0	0	0	109.9	H139	P137-H139 PolarHBondContact O-N 3.45Å; P137-H139 VanDerWaalsContact O-N 3.08Å; P137-H139 PolarHBondContact O-ND1 3.49Å
138	L	43.9	Very low	48.3	Very low	155 Å²	155	131.1 Å²	131.1	81%	0.812	71%	0.711	S	S	*	*			trans	-66.4	104.4	173	-73	171.7	0	0	0	110.4	M136 V140	M136-L138 PolarHBondContact O-N 2.83Å; L138-V140 PolarHBondContact O-N 3.21Å
139	H	47.6	Very low	47.5	Very low	171 Å²	171	135.6 Å²	135.6	79%	0.792	74%	0.738	S	S	*	*			trans	-79.8	103	176.8	-75.7	70.5	0	0	0	110.4	P137 R141	P137-H139 PolarHBondContact O-N 3.45Å; P137-H139 VanDerWaalsContact O-N 3.08Å; P137-H139 PolarHBondContact O-ND1 3.49Å; H139-R141 PolarHBondContact O-N 2.96Å; H139-R141 VanDerWaalsContact O-N 3.13Å
140	V	44.1	Very low	46.8	Very low	122 Å²	122	135.3 Å²	135.3	74%	0.739	75%	0.749	S	S	*	*			trans	-70.1	106.1	175.1	-175.1	0	0	0	0	109.5	L138 R142	L138-V140 PolarHBondContact O-N 3.21Å; V140-R142 HydrophobicContact CG1-CG 4.02Å; V140-R142 PolarHBondContact O-N 2.86Å
141	R	43.2	Very low	45.7	Very low	254 Å²	254	140.4 Å²	140.4	96%	0.958	77%	0.77	S	S	*	*			trans	-67.8	92.8	168.1	-94.6	-177.9	158	167.5	-6.4	110.1	H139	H139-R141 PolarHBondContact O-N 2.96Å; H139-R141 VanDerWaalsContact O-N 3.13Å
142	R	47.5	Very low	44.4	Very low	214 Å²	214	140.7 Å²	140.7	81%	0.808	78%	0.777	S	S	*	*			trans	-94.9	133.3	157.2	-60.1	-175.8	72.7	-169.8	2	108.2	V140	V140-R142 HydrophobicContact CG1-CG 4.02Å; V140-R142 PolarHBondContact O-N 2.86Å
143	S	39.9	Very low	43.5	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	78%	0.777	S	S	*	*	S	Bend	trans	52.8	131	157.9	50.2	0	0	0	0	120.2
144	S	41.1	Very low	42.5	Very low	106 Å²	106	136.3 Å²	136.3	74%	0.741	78%	0.779	S	S	*	*			trans	54.1	114.4	151.1	55.5	0	0	0	0	120.4
145	D	40.3	Very low	41.9	Very low	153 Å²	153	138.9 Å²	138.9	82%	0.818	79%	0.787	S	S	*	*				32.7	151.1	112	-91.3	25.5	0	0	0	121.9
146	P	44.1	Very low	41.6	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	78%	0.781	S	S	*	*			cis	-145.2	-172	-34.8	36.8	-16.6	0	0	0	114.9
147	A	38.2	Very low	41.3	Very low	87 Å²	87	135 Å²	135	72%	0.719	78%	0.778	S	S	*	*			trans	91.8	160.4	137.5	0	0	0	0	0	123.7
148	L	39.5	Very low	40.7	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	79%	0.79	S	S	*	*			trans	77.9	86.8	160.4	-54.9	-172	0	0	0	121.7
149	T	38.9	Very low	40.4	Very low	153 Å²	153	136.9 Å²	136.9	94%	0.939	78%	0.784	S	S	*	*				-158.6	134.2	119	45.7	0	0	0	0	109
150	G	40.6	Very low	39.9	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	79%	0.786	S	S	*	*			cis	151.3	92.2	-9.5	0	0	0	0	0	113.4
151	L	38.1	Very low	39.5	Very low	180 Å²	180	137 Å²	137	94%	0.942	79%	0.786	S	S	*	*			trans	-142.6	148.8	167.3	-73.2	178.6	0	0	0	110.5
152	S	32.8	Very low	39.3	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	77%	0.772	S	S	*	*			trans	-80.1	165.4	-171.3	-51.8	0	0	0	0	112.9
153	T	37.1	Very low	39	Very low	120 Å²	120	128.4 Å²	128.4	74%	0.736	78%	0.776	S	S	*	*				-164.3	146	51.4	48.7	0	0	0	0	114.7
154	S	36.7	Very low	38.9	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	78%	0.775	S	S	*	*			trans	45.1	140.2	146.5	57	0	0	0	0	121.5
155	V	42.4	Very low	39	Very low	126 Å²	126	130.6 Å²	130.6	76%	0.764	77%	0.772	S	S	*	*			cis	-162.3	154.7	13.7	-107.2	0	0	0	0	110.2
156	S	38.9	Very low	38.8	Very low	98 Å²	98	126.6 Å²	126.6	69%	0.685	76%	0.756	S	S	*	*			trans	56.9	149.4	152.4	-67.5	0	0	0	0	121.3
157	D	38.6	Very low	38.6	Very low	138 Å²	138	131.1 Å²	131.1	74%	0.738	76%	0.759	S	S	*	*			cis	-166.3	126.2	-19.7	-97.8	-43.7	0	0	0	108.9
158	N	40.6	Very low	38.7	Very low	160 Å²	160	135.9 Å²	135.9	86%	0.856	76%	0.763	S	S	*	*			trans	-178.1	146.7	145.9	-108.2	-47.7	0	0	0	115.9
159	N	39.5	Very low	38.5	Very low	128 Å²	128	135.4 Å²	135.4	68%	0.684	76%	0.761	S	S	*	*			trans	-71.3	141.9	-168.6	-50	-73.4	0	0	0	116.9
160	F	36.3	Very low	38.7	Very low	192 Å²	192	133.2 Å²	133.2	84%	0.842	75%	0.75	S	S	*	*				167.1	130.2	103.9	-102.8	-79.9	0	0	0	113.9
161	S	35.4	Very low	38.7	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	75%	0.746	S	S	*	*			trans	41.7	143.2	153.4	-67.4	0	0	0	0	123.1
162	S	39.8	Very low	38.5	Very low	97 Å²	97	136.1 Å²	136.1	68%	0.678	74%	0.738	S	S	*	*			cis	-167.4	136.4	-6.8	-97.5	0	0	0	0	113.3
163	E	40.1	Very low	38.5	Very low	189 Å²	189	141 Å²	141	88%	0.883	74%	0.739	S	S	*	*			trans	72	158.1	139	-133.4	165.1	146.3	0	0	123.8
164	E	39.1	Very low	38.5	Very low	155 Å²	155	140.5 Å²	140.5	72%	0.724	74%	0.741	S	S	*	*			trans	-131.8	-110.2	-173.8	-145.5	-99.1	112	0	0	112.5	S166	E164-S166 VanDerWaalsContact CD-N 3.29Å; E164-S166 WeakPolarHBondContact OE1-CA 3.39Å; E164-S166 PolarHBondContact OE1-N 2.65Å; E164-S166 WeakPolarHBondContact OE2-CB 3.48Å; E164-S166 PolarHBondContact OE2-N 2.97Å
165	P	41.7	Very low	38.3	Very low	103 Å²	103	142.2 Å²	142.2	67%	0.669	75%	0.747	S	S	*	*			cis	-129.2	75.3	-17	40.9	-19.8	0	0	0	116
166	S	36	Very low	38	Very low	68 Å²	68	143.2 Å²	143.2	48%	0.476	75%	0.754	S	S	.	*			trans	75.5	169.7	147.1	83.9	0	0	0	0	122.7	E164	E164-S166 VanDerWaalsContact CD-N 3.29Å; E164-S166 WeakPolarHBondContact OE1-CA 3.39Å; E164-S166 PolarHBondContact OE1-N 2.65Å; E164-S166 WeakPolarHBondContact OE2-CB 3.48Å; E164-S166 PolarHBondContact OE2-N 2.97Å
167	R	39.9	Very low	38.1	Very low	205 Å²	205	143.1 Å²	143.1	77%	0.774	76%	0.759	S	S	*	*			trans	71.9	110.9	145.6	-74.4	168.8	-163.9	-116.2	3.1	122.1
168	K	40.1	Very low	38.1	Very low	187 Å²	187	139.5 Å²	139.5	81%	0.813	75%	0.754	S	S	*	*				134.8	123.3	120.2	-74.6	143.3	-173.6	168.9	0	117.7
169	N	35.3	Very low	38.1	Very low	155 Å²	155	141.8 Å²	141.8	83%	0.829	76%	0.757	S	S	*	*			trans	-15.5	160.7	136.2	-100.2	-33.6	0	0	0	118.3
170	P	44.7	Very low	38.2	Very low	108 Å²	108	143.4 Å²	143.4	70%	0.701	77%	0.765	S	S	*	*			cis	-134.8	-171	40.3	30.3	-5.1	0	0	0	114.2
171	T	40.1	Very low	38.3	Very low	105 Å²	105	142.7 Å²	142.7	64%	0.644	76%	0.761	S	S	*	*				-179.1	162	52.1	-36	0	0	0	0	113.3
172	R	34.4	Very low	38.5	Very low	207 Å²	207	146 Å²	146	78%	0.781	77%	0.765	S	S	*	*			trans	94.8	74.3	139.8	-144.9	166.2	-171.8	-110.1	-0	121.7
173	W	32.6	Very low	38.2	Very low	215 Å²	215	147.9 Å²	147.9	81%	0.814	77%	0.768	S	S	*	*			trans	24.1	117.9	133.4	-43.5	-61.3	0	0	0	122.3
174	S	36.2	Very low	38.1	Very low	110 Å²	110	144.4 Å²	144.4	77%	0.769	76%	0.759	S	S	*	*				22.1	137.2	118.7	-44.8	0	0	0	0	122.8
175	T	32.9	Very low	38	Very low	137 Å²	137	142.1 Å²	142.1	84%	0.84	77%	0.767	S	S	*	*			trans	-8.4	130.6	149.4	50.8	0	0	0	0	120.2
176	T	36.6	Very low	37.8	Very low	147 Å²	147	141.1 Å²	141.1	90%	0.902	78%	0.776	S	S	*	*				-166	-177.2	104.6	-163.5	0	0	0	0	110.9
177	A	39.2	Very low	37.9	Very low	95 Å²	95	143.4 Å²	143.4	79%	0.785	79%	0.791	S	S	*	*			trans	-91.8	163.7	-167.4	0	0	0	0	0	115.6
178	G	39.5	Very low	38.3	Very low	63 Å²	63	138.5 Å²	138.5	65%	0.649	79%	0.786	S	S	*	*			trans	131.3	90.6	141.3	0	0	0	0	0	120.1
179	F	39.5	Very low	38.3	Very low	208 Å²	208	138.4 Å²	138.4	91%	0.912	79%	0.786	S	S	*	*			trans	63.6	170.5	147.1	-67.3	-83.5	0	0	0	120.9
180	L	42.1	Very low	38.4	Very low	162 Å²	162	137 Å²	137	85%	0.848	78%	0.783	S	S	*	*			trans	65.8	101	178	-59.7	166.1	0	0	0	114.8
181	K	39.2	Very low	38.1	Very low	176 Å²	176	137 Å²	137	77%	0.765	78%	0.784	S	S	*	*			cis	94.3	130.1	32.2	-161.6	-159.5	179.9	-177.5	0	112.9
182	Q	38.7	Very low	38.1	Very low	174 Å²	174	137.7 Å²	137.7	81%	0.813	78%	0.784	S	S	*	*			trans	75.4	155.9	177.4	-55.1	-179.1	-75.3	0	0	116.9
183	N	33.6	Very low	38.6	Very low	136 Å²	136	138.2 Å²	138.2	73%	0.727	79%	0.786	S	S	*	*			cis	-166.4	168.9	-41.7	-161.9	16.5	0	0	0	110.2
184	T	38.2	Very low	39.1	Very low	116 Å²	116	136.4 Å²	136.4	71%	0.712	78%	0.784	S	S	*	*			trans	70.4	106.1	155.3	16.2	0	0	0	0	121.8
185	A	37.2	Very low	39.3	Very low	107 Å²	107	138.6 Å²	138.6	88%	0.884	78%	0.78	S	S	*	*			trans	26.8	140.6	132.5	0	0	0	0	0	123.9
186	G	37.2	Very low	39.9	Very low	82 Å²	82	137 Å²	137	85%	0.845	77%	0.766	S	S	*	*			trans	179.5	95.1	165	0	0	0	0	0	117.6
187	S	37.8	Very low	40.1	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	76%	0.759	S	S	*	*			trans	-77.8	-173.3	175.8	-159.5	0	0	0	0	113.5
188	P	49	Very low	40.2	Very low	103 Å²	103	137.3 Å²	137.3	67%	0.669	74%	0.744	S	S	*	*				-130.8	-169.4	-61.4	38.2	-21.9	0	0	0	113.6
189	K	39.2	Very low	40.1	Very low	184 Å²	184	144.1 Å²	144.1	80%	0.8	75%	0.752	S	S	*	*			trans	177.8	119.1	139.4	-97.7	153.5	-171.4	176.5	0	112.6
190	T	38.5	Very low	40	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	75%	0.747	S	S	*	*				63.5	139.6	97.8	62.4	0	0	0	0	115.9
191	C	38.1	Very low	39.9	Very low	108 Å²	108	141.5 Å²	141.5	73%	0.73	74%	0.739	S	S	*	*			cis	-156.3	168.5	28	-129.1	0	0	0	0	113.8
192	D	39.8	Very low	39.9	Very low	120 Å²	120	141.1 Å²	141.1	64%	0.642	75%	0.745	S	S	*	*			trans	27.7	146.2	152.1	-77.2	-100.7	0	0	0	123.2
193	R	45.9	Very low	40	Very low	219 Å²	219	139.1 Å²	139.1	83%	0.826	75%	0.747	S	S	*	*			cis	-159.2	141.7	32.6	-137.6	168.9	-154	-175.5	4.3	112.9
194	K	43.8	Very low	40.4	Very low	176 Å²	176	143.1 Å²	143.1	77%	0.765	75%	0.752	S	S	*	*			trans	18.3	148.3	141.8	-59.2	-178.1	-175.3	-178.2	0	120.4
195	K	40.2	Very low	40.3	Very low	157 Å²	157	144.3 Å²	144.3	68%	0.683	75%	0.753	S	S	*	*			cis	-162	165.2	11.7	-133.8	-176.4	154.3	-76.9	0	110.3
196	D	44.1	Very low	40.5	Very low	104 Å²	104	144.3 Å²	144.3	56%	0.556	74%	0.744	S	S	*	*			trans	51.2	125.3	156.7	-46.8	-28.8	0	0	0	120
197	E	40.9	Very low	40.4	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	74%	0.742	S	S	*	*			cis	-165.9	168.6	-6.9	-126.1	-169.2	-132.9	0	0	108.1
198	N	41.3	Very low	40.2	Very low	88 Å²	88	144.4 Å²	144.4	47%	0.471	73%	0.732	S	S	.	*			cis	-148.1	-79.1	-2.5	-169.1	-31.4	0	0	0	111.6
199	Y	37	Very low	39.5	Very low	206 Å²	206	150.8 Å²	150.8	81%	0.808	74%	0.743	S	S	*	*			trans	-81.2	125.2	-174.2	-69.7	-87.1	0	0	0	110.8
200	R	39.3	Very low	39.2	Very low	217 Å²	217	146.9 Å²	146.9	82%	0.819	74%	0.739	S	S	*	*			cis	62.5	137.2	34.1	-68.6	-158.8	168.2	-146.2	1.5	115.4
201	S	38	Very low	39	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	74%	0.74	S	S	*	*			cis	-168.2	158.7	-11.5	-97.3	0	0	0	0	110.8
202	L	40.9	Very low	38.8	Very low	167 Å²	167	150.6 Å²	150.6	87%	0.874	74%	0.742	S	S	*	*			trans	-66.9	162.9	163.8	-53.1	170	0	0	0	111.4
203	P	40	Very low	38.5	Very low	132 Å²	132	154.2 Å²	154.2	86%	0.857	75%	0.752	S	S	*	*				-153.3	-166	94.5	40.9	-21.2	0	0	0	116.1
204	R	43.1	Very low	38	Very low	221 Å²	221	150.5 Å²	150.5	83%	0.834	74%	0.744	S	S	*	*			trans	-103.9	159.3	-171.9	-68.6	-179.7	168	117.7	-6.1	115.1
205	D	34.6	Very low	37.7	Very low	140 Å²	140	151 Å²	151	75%	0.749	74%	0.741	S	S	*	*			trans	59.6	160.8	140.1	-69	-34.6	0	0	0	121.1
206	P	42.4	Very low	37.5	Very low	107 Å²	107	150.1 Å²	150.1	70%	0.695	74%	0.744	S	S	*	*			cis	-138.1	171.5	-36.7	38.1	-22.4	0	0	0	114.9
207	S	34.1	Very low	37	Very low	115 Å²	115	152 Å²	152	80%	0.804	75%	0.754	S	S	*	*			trans	77.8	156.5	154.4	82.5	0	0	0	0	121
208	S	33.6	Very low	36.8	Very low	85 Å²	85	148.9 Å²	148.9	59%	0.594	76%	0.756	S	S	*	*			trans	84	151.3	171.9	-154.7	0	0	0	0	119.3
209	W	34.9	Very low	36.6	Very low	238 Å²	238	155 Å²	155	90%	0.902	77%	0.772	S	S	*	*			trans	71.2	152.8	172.2	-57.4	-55.5	0	0	0	120.3
210	S	33.1	Very low	36.7	Very low	102 Å²	102	149 Å²	149	71%	0.713	76%	0.76	S	S	*	*			trans	-142.5	154.8	-167.9	-41.5	0	0	0	0	109.9
211	N	34.6	Very low	36.6	Very low	146 Å²	146	144.2 Å²	144.2	78%	0.781	76%	0.76	S	S	*	*			trans	78.8	114.6	169.1	-51.9	-64.4	0	0	0	117.9
212	Q	33.4	Very low	36.7	Very low	165 Å²	165	145.6 Å²	145.6	77%	0.771	76%	0.759	S	S	*	*				71	73.6	115	-162.7	-168.7	6	0	0	118.7
213	F	33	Very low	37	Very low	196 Å²	196	140.3 Å²	140.3	86%	0.86	74%	0.736	S	S	*	*				-141.9	113.5	123.6	-74.7	-72.1	0	0	0	106.1
214	Q	35.9	Very low	37.9	Very low	141 Å²	141	138.3 Å²	138.3	66%	0.659	73%	0.731	S	S	*	*				80.8	118.4	70.5	-179.4	169.6	93.1	0	0	112.5
215	R	37.7	Very low	38.8	Very low	185 Å²	185	131.6 Å²	131.6	70%	0.698	72%	0.718	S	S	*	*			trans	84.1	128.7	166.1	-83.4	-171.9	-164.3	88.6	6.2	119.7
216	D	35.2	Very low	40.3	Very low	139 Å²	139	128.4 Å²	128.4	74%	0.743	70%	0.698	S	S	*	*			trans	82.8	104.5	135.7	-52.8	-13.8	0	0	0	121.6
217	N	34.2	Very low	41.8	Very low	143 Å²	143	127.7 Å²	127.7	77%	0.765	69%	0.694	S	S	*	*				82.4	67.7	122.3	-157.3	69.1	0	0	0	119.7
218	A	36.7	Very low	43.5	Very low	95 Å²	95	129.2 Å²	129.2	79%	0.785	69%	0.69	S	S	*	*				-155.7	131.2	126.9	0	0	0	0	0	111.5
219	R	37.8	Very low	45.5	Very low	218 Å²	218	126.4 Å²	126.4	82%	0.823	67%	0.669	S	S	*	*			cis	54.5	136.7	-2.8	-77.1	-162	154.2	-166.5	-7.6	116.9
220	S	38.2	Very low	47.3	Very low	79 Å²	79	118 Å²	118	55%	0.552	64%	0.642	S	S	*	*			cis	-168.4	146.3	-3.6	-110	0	0	0	0	106.5
221	S	37.7	Very low	49.4	Very low	116 Å²	116	122.1 Å²	122.1	81%	0.811	64%	0.641	S	S	*	*	S	Bend	trans	64.2	167	177.8	-45.3	0	0	0	0	114.3
222	L	39.9	Very low	51.1	Low	127 Å²	127	122.9 Å²	122.9	67%	0.665	63%	0.633	S	S	*	*			trans	-73.4	116.4	142.6	-67.9	172.2	0	0	0	105.5	V229	L222-V229 HydrophobicContact CB-CG2 3.87Å; L222-V229 HydrophobicContact CD1-CG2 4.22Å; L222-V229 HydrophobicContact CG-CG2 4.47Å
223	S	47.8	Very low	53.2	Low	56 Å²	56	118.4 Å²	118.4	39%	0.392	62%	0.615	S	S	.	*			trans	-73.3	155.9	173	56.9	0	0	0	0	110.1	S225 H226	S223-S225 WeakPolarHBondContact CB-OG 3.34Å; S223-S225 PolarHBondContact O-N 2.97Å; S223-S225 PolarHBondContact OG-OG 2.87Å; S223-H226 PolarHBondContact O-N 3.17Å
224	A	58.3	Low	55.1	Low	91 Å²	91	114.1 Å²	114.1	75%	0.752	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	53.7	170.8	0	0	0	0	0	111.1
225	S	62.5	Low	56.9	Low	80 Å²	80	113.6 Å²	113.6	56%	0.559	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.3	24.7	-173.2	43.6	0	0	0	0	111.4	S223 D230	S223-S225 WeakPolarHBondContact CB-OG 3.34Å; S223-S225 PolarHBondContact O-N 2.97Å; S223-S225 PolarHBondContact OG-OG 2.87Å; S225-D230 VanDerWaalsContact CA-OD1 3.28Å; S225-D230 WeakPolarHBondContact CA-OD1 3.47Å; S225-D230 PolarHBondContact N-OD1 2.94Å
226	H	66.5	Low	57.9	Low	73 Å²	73	109.1 Å²	109.1	34%	0.338	58%	0.58	S	S	.	*			trans	-107.2	129.6	179.1	-178.2	-95.7	0	0	0	106.9	S223 M228 V229 D230	S223-H226 PolarHBondContact O-N 3.17Å; H226-M228 PolarHBondContact O-N 2.97Å; H226-V229 HydrophobicContact CB-CB 4.34Å; H226-V229 HydrophobicContact CB-CG2 4.13Å; H226-V229 CarbonylContact O-C 3.1Å; H226-V229 WeakPolarHBondContact O-CA 3.44Å; H226-V229 WeakPolarHBondContact O-CB 3.49Å; H226-V229 PolarHBondContact O-N 2.92Å; H226-D230 PolarHBondContact N-OD1 3.41Å; H226-D230 PolarHBondContact N-OD2 3.26Å; H226-D230 VanDerWaalsContact O-CG 3.24Å; H226-D230 PolarHBondContact O-N 3.5Å
227	P	73.7	Confident	59.1	Low	92 Å²	92	107.4 Å²	107.4	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-7.5	-166.1	23.3	-34.7	0	0	0	115.8	D230 R231	P227-D230 WeakPolarHBondContact CA-OD2 3.43Å; P227-R231 VanDerWaalsContact O-CB 3.28Å; P227-R231 WeakPolarHBondContact O-CB 3.3Å; P227-R231 PolarHBondContact O-N 3.34Å
228	M	69.8	Low	59.9	Low	147 Å²	147	106.9 Å²	106.9	72%	0.724	56%	0.56	S	S	*	*	H	α-helix	trans	-91.4	-25.9	166.8	-68	174.8	57.4	0	0	114	H226 W232	H226-M228 PolarHBondContact O-N 2.97Å; M228-W232 VanDerWaalsContact O-CB 3.31Å; M228-W232 WeakPolarHBondContact O-CB 3.45Å; M228-W232 PolarHBondContact O-N 3.28Å
229	V	74.8	Confident	60.8	Low	25 Å²	25	108.5 Å²	108.5	15%	0.152	56%	0.556	C	S	.	*	H	α-helix	trans	-75.6	-44.3	166.8	176.7	0	0	0	0	108.9	L222 H226 R231 W232 L233	L222-V229 HydrophobicContact CB-CG2 3.87Å; L222-V229 HydrophobicContact CD1-CG2 4.22Å; L222-V229 HydrophobicContact CG-CG2 4.47Å; H226-V229 HydrophobicContact CB-CB 4.34Å; H226-V229 HydrophobicContact CB-CG2 4.13Å; H226-V229 CarbonylContact O-C 3.1Å; H226-V229 WeakPolarHBondContact O-CA 3.44Å; H226-V229 WeakPolarHBondContact O-CB 3.49Å; H226-V229 PolarHBondContact O-N 2.92Å; V229-R231 PolarHBondContact O-N 2.9Å; V229-W232 CarbonylContact O-C 3.53Å; V229-W232 WeakPolarHBondContact O-CA 3.46Å; V229-W232 WeakPolarHBondContact O-CB 3.43Å; V229-W232 PolarHBondContact O-N 3.09Å; V229-L233 HydrophobicContact CG1-CD1 4.39Å; V229-L233 PolarHBondContact O-N 3.03Å
230	D	73.5	Confident	61.2	Low	62 Å²	62	105.8 Å²	105.8	33%	0.332	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-47.5	179.6	-47.3	-28.2	0	0	0	109.8	S225 H226 P227 W232 L233 E234	S225-D230 VanDerWaalsContact CA-OD1 3.28Å; S225-D230 WeakPolarHBondContact CA-OD1 3.47Å; S225-D230 PolarHBondContact N-OD1 2.94Å; H226-D230 PolarHBondContact N-OD1 3.41Å; H226-D230 PolarHBondContact N-OD2 3.26Å; H226-D230 VanDerWaalsContact O-CG 3.24Å; H226-D230 PolarHBondContact O-N 3.5Å; P227-D230 WeakPolarHBondContact CA-OD2 3.43Å; D230-W232 PolarHBondContact O-N 3.16Å; D230-W232 VanDerWaalsContact O-N 3.08Å; D230-L233 PolarHBondContact O-N 2.87Å; D230-E234 WeakPolarHBondContact O-CB 3.26Å; D230-E234 PolarHBondContact O-N 3.27Å
231	R	76.5	Confident	61.1	Low	188 Å²	188	109.3 Å²	109.3	71%	0.709	56%	0.56	S	S	*	*	H	α-helix	trans	-64	-11.5	172.3	-172.3	177.4	-65.4	-170.8	-0.9	114.6	P227 V229 K235	P227-R231 VanDerWaalsContact O-CB 3.28Å; P227-R231 WeakPolarHBondContact O-CB 3.3Å; P227-R231 PolarHBondContact O-N 3.34Å; V229-R231 PolarHBondContact O-N 2.9Å; R231-K235 VanDerWaalsContact O-CB 3.26Å; R231-K235 WeakPolarHBondContact O-CB 3.01Å
232	W	71.1	Confident	61	Low	162 Å²	162	106.9 Å²	106.9	61%	0.614	55%	0.553	S	S	*	*	H	α-helix	trans	-99.4	-34.9	176.7	-173.3	83.8	0	0	0	111.5	M228 V229 D230 K235 Q236	M228-W232 VanDerWaalsContact O-CB 3.31Å; M228-W232 WeakPolarHBondContact O-CB 3.45Å; M228-W232 PolarHBondContact O-N 3.28Å; V229-W232 CarbonylContact O-C 3.53Å; V229-W232 WeakPolarHBondContact O-CA 3.46Å; V229-W232 WeakPolarHBondContact O-CB 3.43Å; V229-W232 PolarHBondContact O-N 3.09Å; D230-W232 PolarHBondContact O-N 3.16Å; D230-W232 VanDerWaalsContact O-N 3.08Å; W232-K235 PolarHBondContact O-N 2.98Å; W232-Q236 PolarHBondContact O-N 3.32Å; W232-Q236 VanDerWaalsContact O-N 3.11Å
233	L	76	Confident	60.8	Low	72 Å²	72	107.8 Å²	107.8	38%	0.377	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-52.6	168.5	-121.3	75.3	0	0	0	110.7	V229 D230 K235 Q236 E237	V229-L233 HydrophobicContact CG1-CD1 4.39Å; V229-L233 PolarHBondContact O-N 3.03Å; D230-L233 PolarHBondContact O-N 2.87Å; L233-K235 PolarHBondContact O-N 3.22Å; L233-Q236 CarbonylContact O-C 3.58Å; L233-Q236 WeakPolarHBondContact O-CA 3.31Å; L233-Q236 PolarHBondContact O-N 3.07Å; L233-E237 WeakPolarHBondContact O-CB 3.44Å; L233-E237 WeakPolarHBondContact O-CG 3.39Å; L233-E237 PolarHBondContact O-N 3.33Å
234	E	73.3	Confident	60.1	Low	105 Å²	105	113.6 Å²	113.6	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-55.6	-25.1	174.4	-177.7	-178	-145.8	0	0	111.7	D230 Q238	D230-E234 WeakPolarHBondContact O-CB 3.26Å; D230-E234 PolarHBondContact O-N 3.27Å; E234-Q238 WeakPolarHBondContact O-CB 3.5Å; E234-Q238 WeakPolarHBondContact O-CG 3.44Å; E234-Q238 PolarHBondContact O-N 3.26Å
235	K	74.7	Confident	58.9	Low	131 Å²	131	118.8 Å²	118.8	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-94.5	-7.7	175.1	-168.7	164.5	-177.8	79.2	0	114.6	R231 W232 L233	R231-K235 VanDerWaalsContact O-CB 3.26Å; R231-K235 WeakPolarHBondContact O-CB 3.01Å; W232-K235 PolarHBondContact O-N 2.98Å; L233-K235 PolarHBondContact O-N 3.22Å
236	Q	57.4	Low	57.8	Low	91 Å²	91	122.2 Å²	122.2	43%	0.425	61%	0.606	S	S	.	*	H	α-helix	trans	-88.6	-41.3	157.9	-90	-153.9	-110.9	0	0	111.1	W232 L233 Q238 D239 E240	W232-Q236 PolarHBondContact O-N 3.32Å; W232-Q236 VanDerWaalsContact O-N 3.11Å; L233-Q236 CarbonylContact O-C 3.58Å; L233-Q236 WeakPolarHBondContact O-CA 3.31Å; L233-Q236 PolarHBondContact O-N 3.07Å; Q236-Q238 PolarHBondContact O-N 3.17Å; Q236-D239 CarbonylContact O-C 3.51Å; Q236-D239 WeakPolarHBondContact O-CA 3.21Å; Q236-D239 PolarHBondContact O-N 3.38Å; Q236-E240 PolarHBondContact O-N 3.04Å
237	E	60.8	Low	56.2	Low	103 Å²	103	123.1 Å²	123.1	48%	0.481	62%	0.621	S	S	.	*	H	α-helix	trans	-65.2	-38	178.3	-69.4	167.4	148.2	0	0	110.7	L233 D239 E240 E241	L233-E237 WeakPolarHBondContact O-CB 3.44Å; L233-E237 WeakPolarHBondContact O-CG 3.39Å; L233-E237 PolarHBondContact O-N 3.33Å; E237-D239 PolarHBondContact O-N 2.99Å; E237-E240 PolarHBondContact O-N 3.41Å; E237-E241 PolarHBondContact O-N 2.99Å
238	Q	52	Low	54.3	Low	131 Å²	131	123.8 Å²	123.8	61%	0.612	63%	0.627	S	S	*	*	H	α-helix	trans	-66.3	-14.2	168.8	-77.6	172.3	17.2	0	0	114.8	E234 Q236	E234-Q238 WeakPolarHBondContact O-CB 3.5Å; E234-Q238 WeakPolarHBondContact O-CG 3.44Å; E234-Q238 PolarHBondContact O-N 3.26Å; Q236-Q238 PolarHBondContact O-N 3.17Å
239	D	53.8	Low	52.5	Low	130 Å²	130	127.9 Å²	127.9	70%	0.695	64%	0.635	S	S	*	*	H	α-helix	trans	-101.6	-6.3	174.6	-76.5	-12.6	0	0	0	112.5	Q236 E237	Q236-D239 CarbonylContact O-C 3.51Å; Q236-D239 WeakPolarHBondContact O-CA 3.21Å; Q236-D239 PolarHBondContact O-N 3.38Å; E237-D239 PolarHBondContact O-N 2.99Å
240	E	46.8	Very low	50.7	Low	161 Å²	161	133 Å²	133	75%	0.752	67%	0.666	S	S	*	*	H	α-helix	trans	-127.9	-23.3	179.7	-73.5	-166.6	94.8	0	0	116.1	Q236 E237	Q236-E240 PolarHBondContact O-N 3.04Å; E237-E240 PolarHBondContact O-N 3.41Å
241	E	36.3	Very low	48.8	Very low	153 Å²	153	138.2 Å²	138.2	72%	0.715	69%	0.688	S	S	*	*	S	Bend	trans	-124.9	82.9	-178.1	-166.8	170.3	-172	0	0	111.3	E237	E237-E241 PolarHBondContact O-N 2.99Å
242	G	34.9	Very low	47.3	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	68%	0.684	S	S	*	*			trans	-165.2	58.7	-170.3	0	0	0	0	0	116.7
243	T	37.4	Very low	45.7	Very low	145 Å²	145	132.8 Å²	132.8	89%	0.89	70%	0.695	S	S	*	*			trans	175.4	83	135.4	-64.7	0	0	0	0	109.2
244	E	31.2	Very low	43.5	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	71%	0.707	S	S	*	*			trans	-136.4	100.1	162.1	59.8	-179.7	102.9	0	0	111.5
245	E	34.7	Very low	41.8	Very low	200 Å²	200	137 Å²	137	94%	0.935	73%	0.729	S	S	*	*			trans	-177.6	91.4	152.5	-108.6	-171.8	177.9	0	0	109.5
246	D	38.5	Very low	39.8	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	73%	0.733	S	S	*	*			trans	-150	126.1	146	-159.7	10.2	0	0	0	113.3
247	S	33.4	Very low	38.6	Very low	92 Å²	92	137.5 Å²	137.5	64%	0.643	75%	0.752	S	S	*	*			trans	32.5	100.4	153.2	-58.4	0	0	0	0	121.8
248	S	32.7	Very low	37.4	Very low	106 Å²	106	140 Å²	140	74%	0.741	77%	0.774	S	S	*	*				83.1	103.3	120	73.7	0	0	0	0	121.8
249	R	33.1	Very low	36.7	Very low	232 Å²	232	137.1 Å²	137.1	88%	0.875	78%	0.78	S	S	*	*				55.8	95.7	111.8	-169.7	-151.3	-175.6	102.7	0.1	118.6
250	V	36.7	Very low	35.8	Very low	133 Å²	133	138.9 Å²	138.9	81%	0.806	79%	0.788	S	S	*	*				178.3	138.3	120.3	148.3	0	0	0	0	110.5
251	E	33.8	Very low	35.5	Very low	172 Å²	172	139.4 Å²	139.4	80%	0.804	79%	0.791	S	S	*	*			trans	-116.7	156.5	167.6	-102.7	-98.2	129	0	0	108
252	P	45.6	Very low	35.3	Very low	96 Å²	96	138.4 Å²	138.4	62%	0.623	79%	0.79	S	S	*	*			cis	-124.1	-145.7	-31.2	35.9	-18.2	0	0	0	110.1
253	V	35.7	Very low	35.3	Very low	140 Å²	140	143.2 Å²	143.2	85%	0.848	80%	0.797	S	S	*	*			trans	93.8	110.9	169.8	-174	0	0	0	0	116.9
254	G	31.3	Very low	35.7	Very low	60 Å²	60	140.6 Å²	140.6	62%	0.619	78%	0.783	S	S	*	*				117.1	142.2	129.9	0	0	0	0	0	118.5
255	H	37.3	Very low	36.3	Very low	205 Å²	205	139.9 Å²	139.9	95%	0.949	79%	0.785	S	S	*	*			trans	72.5	160.2	163.1	-64.3	-81.5	0	0	0	118.7
256	A	32.6	Very low	37.4	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	77%	0.765	S	S	*	*			trans	-138.5	-177.2	-161.2	0	0	0	0	0	111.1
257	D	32.8	Very low	39	Very low	153 Å²	153	131.3 Å²	131.3	82%	0.818	74%	0.744	S	S	*	*			trans	65.4	80.5	161.8	-53	-30.2	0	0	0	118
258	T	35.6	Very low	41.2	Very low	154 Å²	154	128.9 Å²	128.9	95%	0.945	72%	0.724	S	S	*	*			trans	178.6	147.7	132.4	22.2	0	0	0	0	109.7
259	G	36.4	Very low	43.5	Very low	71 Å²	71	128.5 Å²	128.5	73%	0.732	71%	0.713	S	S	*	*			cis	-155	159	-7.4	0	0	0	0	0	110.1
260	L	35.4	Very low	46	Very low	167 Å²	167	122.9 Å²	122.9	87%	0.874	70%	0.7	S	S	*	*			trans	-96	108	-171.3	-173.6	75	0	0	0	111.7
261	E	39	Very low	48.2	Very low	172 Å²	172	117 Å²	117	80%	0.804	66%	0.664	S	S	*	*			trans	-107.5	143.7	170.8	-87.3	-73.6	118.1	0	0	111
262	N	32.9	Very low	50.9	Low	133 Å²	133	109.9 Å²	109.9	71%	0.711	63%	0.632	S	S	*	*			trans	-72.5	131.5	-160.5	-63.2	-62.8	0	0	0	114.5
263	M	35.3	Very low	53.1	Low	165 Å²	165	110 Å²	110	81%	0.813	62%	0.623	S	S	*	*			trans	-119.3	128.3	153.9	-75.9	-75.6	113.4	0	0	108.5	N265	M263-N265 PolarHBondContact O-N 3.31Å
264	P	45.9	Very low	55.8	Low	91 Å²	91	107.6 Å²	107.6	59%	0.591	61%	0.605	S	S	*	*			trans	-69.9	122.9	-174.8	26.8	-33.9	0	0	0	111.9	F266	P264-F266 VanDerWaalsContact C-N 3.33Å; P264-F266 HydrophobicContact CB-CE2 4.2Å; P264-F266 HydrophobicContact CG-CD2 4.31Å; P264-F266 HydrophobicContact CG-CE2 3.69Å; P264-F266 HydrophobicContact CG-CZ 4.17Å; P264-F266 PolarHBondContact O-N 3.31Å
265	N	43.1	Very low	58.7	Low	163 Å²	163	105 Å²	105	87%	0.872	58%	0.577	S	S	*	*			trans	-75.6	82.3	171.2	-76.2	-38.4	0	0	0	110.2	M263 S267	M263-N265 PolarHBondContact O-N 3.31Å; N265-S267 PolarHBondContact O-N 3.47Å
266	F	57.5	Low	61.3	Low	121 Å²	121	100.3 Å²	100.3	53%	0.531	56%	0.556	S	S	.	*			trans	-58.7	126.9	169.2	-69.6	-77.7	0	0	0	110.6	P264 D270	P264-F266 VanDerWaalsContact C-N 3.33Å; P264-F266 HydrophobicContact CB-CE2 4.2Å; P264-F266 HydrophobicContact CG-CD2 4.31Å; P264-F266 HydrophobicContact CG-CE2 3.69Å; P264-F266 HydrophobicContact CG-CZ 4.17Å; P264-F266 PolarHBondContact O-N 3.31Å; F266-D270 HydrophobicContact CD1-CB 4.34Å
267	S	72.7	Confident	64.1	Low	51 Å²	51	96.7 Å²	96.7	36%	0.357	53%	0.525	S	S	.	.			trans	-77.8	170.1	169.9	77.6	0	0	0	0	110.7	N265 D269 D270	N265-S267 PolarHBondContact O-N 3.47Å; S267-D269 PolarHBondContact O-N 3.45Å; S267-D269 PolarHBondContact OG-N 3.14Å; S267-D270 WeakPolarHBondContact CA-OD2 3.44Å; S267-D270 VanDerWaalsContact CB-OD2 3.22Å; S267-D270 WeakPolarHBondContact CB-OD2 3.4Å; S267-D270 PolarHBondContact N-OD2 3.3Å; S267-D270 PolarHBondContact OG-N 3.44Å; S267-D270 PolarHBondContact OG-OD2 2.78Å
268	L	79.7	Confident	66.7	Low	42 Å²	42	91.9 Å²	91.9	22%	0.22	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-32.1	172.8	179.9	56.9	0	0	0	111.7	M271 V272 Y366	L268-M271 HydrophobicContact CD1-CE 3.88Å; L268-M271 PolarHBondContact O-N 3.11Å; L268-V272 HydrophobicContact CD1-CG2 4.08Å; L268-V272 HydrophobicContact CG-CG2 4.37Å; L268-V272 WeakPolarHBondContact O-CG2 3.49Å; L268-Y366 HydrophobicContact CD1-CD2 3.61Å; L268-Y366 HydrophobicContact CD1-CE2 3.49Å; L268-Y366 VanDerWaalsContact CD1-CE2 3.49Å
269	D	81.3	Confident	69.1	Low	98 Å²	98	86 Å²	86	52%	0.524	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-28.7	-173.8	-64.5	-44.9	0	0	0	112.5	S267 M271 V272 R326	S267-D269 PolarHBondContact O-N 3.45Å; S267-D269 PolarHBondContact OG-N 3.14Å; D269-M271 PolarHBondContact O-N 2.83Å; D269-V272 PolarHBondContact O-N 2.82Å; D269-R326 IonicContact OD1-CZ 3.82Å; D269-R326 IonicContact OD1-NH2 2.67Å; D269-R326 PolarHBondContact OD1-NH2 3.22Å
270	D	84.4	Confident	71.3	Confident	113 Å²	113	88.6 Å²	88.6	60%	0.604	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.5	172.3	-57.4	-57	0	0	0	112.9	F266 S267	F266-D270 HydrophobicContact CD1-CB 4.34Å; S267-D270 WeakPolarHBondContact CA-OD2 3.44Å; S267-D270 VanDerWaalsContact CB-OD2 3.22Å; S267-D270 WeakPolarHBondContact CB-OD2 3.4Å; S267-D270 PolarHBondContact N-OD2 3.3Å; S267-D270 PolarHBondContact OG-N 3.44Å; S267-D270 PolarHBondContact OG-OD2 2.78Å
271	M	84.2	Confident	73.1	Confident	10 Å²	10	83.9 Å²	83.9	5%	0.049	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-4.8	-172.2	-170.6	174	44.2	0	0	112.9	L268 D269 V358 P359 N362 Q365 Y366 L369	L268-M271 HydrophobicContact CD1-CE 3.88Å; L268-M271 PolarHBondContact O-N 3.11Å; D269-M271 PolarHBondContact O-N 2.83Å; M271-V358 HydrophobicContact CG-CG1 4.43Å; M271-P359 WeakPolarHBondContact O-CD 3.42Å; M271-N362 HydrophobicContact CG-CB 3.7Å; M271-N362 PolarHBondContact O-ND2 2.76Å; M271-N362 HydrophobicContact SD-CB 4.31Å; M271-Q365 HydrophobicContact SD-CB 3.89Å; M271-Y366 HydrophobicContact CE-CD2 3.74Å; M271-Y366 HydrophobicContact CE-CG 4.16Å; M271-L369 HydrophobicContact CE-CD1 3.49Å; M271-L369 VanDerWaalsContact CE-CD1 3.49Å; M271-L369 HydrophobicContact SD-CD1 3.87Å
272	V	90.4	Very high	75	Confident	22 Å²	22	77.6 Å²	77.6	13%	0.133	44%	0.435	C	S	.	.			trans	-111.3	116.6	-168.7	161.9	0	0	0	0	111.1	L268 D269 V325 H356 V358	L268-V272 HydrophobicContact CD1-CG2 4.08Å; L268-V272 HydrophobicContact CG-CG2 4.37Å; L268-V272 WeakPolarHBondContact O-CG2 3.49Å; D269-V272 PolarHBondContact O-N 2.82Å; V272-V325 HydrophobicContact CG1-CG2 4.5Å; V272-V325 HydrophobicContact CG2-CG2 3.86Å; V272-H356 HydrophobicContact CG1-CB 3.6Å; V272-V358 HydrophobicContact CG2-CG2 3.67Å
273	K	91.7	Very high	77.4	Confident	99 Å²	99	76 Å²	76	43%	0.43	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.2	169.7	-174.1	-171.6	177.9	-167	0	109.4	V275 V357 P359	K273-V275 HydrophobicContact CD-CG2 3.91Å; K273-V275 HydrophobicContact CG-CG2 4.06Å; K273-V357 PolarHBondContact N-O 2.87Å; K273-V357 PolarHBondContact O-N 3.48Å; K273-P359 HydrophobicContact CB-CG 4.21Å
274	L	92	Very high	79.9	Confident	89 Å²	89	69 Å²	69	47%	0.466	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	123	167	-174	61.8	0	0	0	109.6	W354	L274-W354 HydrophobicContact CD1-CB 4.15Å; L274-W354 HydrophobicContact CD1-CE3 3.96Å; L274-W354 HydrophobicContact CD2-CE3 3.83Å; L274-W354 HydrophobicContact CD2-CZ3 3.96Å; L274-W354 HydrophobicContact CG-CE3 3.83Å; L274-W354 HydrophobicContact CG-CZ3 4.25Å
275	V	92.9	Very high	82.1	Confident	7 Å²	7	65 Å²	65	4%	0.042	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.3	178.5	-179.9	0	0	0	0	109.1	K273 V277 L317 F355 V357	K273-V275 HydrophobicContact CD-CG2 3.91Å; K273-V275 HydrophobicContact CG-CG2 4.06Å; V275-V277 HydrophobicContact CG1-CG2 4.09Å; V275-L317 HydrophobicContact CG1-CB 4.1Å; V275-L317 HydrophobicContact CG1-CD2 3.97Å; V275-F355 HydrophobicContact CB-CB 4.34Å; V275-F355 PolarHBondContact N-O 3.5Å; V275-F355 PolarHBondContact O-N 2.94Å; V275-V357 HydrophobicContact CB-CG2 4.37Å; V275-V357 HydrophobicContact CG2-CB 4.43Å; V275-V357 HydrophobicContact CG2-CG2 3.94Å
276	Q	92.2	Very high	84.5	Confident	105 Å²	105	58.7 Å²	58.7	49%	0.491	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131	174.8	-169.5	-178.5	-14	0	0	110	V352 W354	Q276-V352 HydrophobicContact CG-CG1 3.47Å; Q276-V352 VanDerWaalsContact CG-CG1 3.47Å; Q276-W354 HydrophobicContact CB-CE3 3.87Å; Q276-W354 HydrophobicContact CB-CH2 4.06Å; Q276-W354 HydrophobicContact CB-CZ3 3.55Å; Q276-W354 HydrophobicContact CG-CD2 4.4Å; Q276-W354 HydrophobicContact CG-CE3 4.02Å; Q276-W354 HydrophobicContact CG-CH2 3.67Å; Q276-W354 HydrophobicContact CG-CZ2 4.05Å; Q276-W354 HydrophobicContact CG-CZ3 3.66Å; Q276-W354 VanDerWaalsContact OE1-CH2 3.3Å
277	V	91.1	Very high	86.2	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	116.3	179.2	-177.4	0	0	0	0	109.6	V275 L284 L317 F318 V352 I353 F355	V275-V277 HydrophobicContact CG1-CG2 4.09Å; V277-L284 HydrophobicContact CG1-CD1 3.73Å; V277-L317 HydrophobicContact CB-CD1 4.44Å; V277-L317 HydrophobicContact CG1-CD1 3.98Å; V277-L317 HydrophobicContact CG2-CD1 3.81Å; V277-L317 HydrophobicContact CG2-CD2 4.22Å; V277-L317 HydrophobicContact CG2-CG 4.46Å; V277-F318 HydrophobicContact CG2-CE2 4.5Å; V277-V352 WeakPolarHBondContact O-CA 3.21Å; V277-I353 HydrophobicContact CB-CB 4.45Å; V277-I353 PolarHBondContact N-O 2.72Å; V277-I353 PolarHBondContact O-N 3.39Å; V277-F355 HydrophobicContact CB-CD2 4.37Å; V277-F355 HydrophobicContact CB-CE2 4.08Å; V277-F355 HydrophobicContact CG2-CD2 3.64Å; V277-F355 HydrophobicContact CG2-CE2 3.69Å
278	P	87.7	Confident	87.2	Confident	52 Å²	52	56.9 Å²	56.9	34%	0.338	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	139	170.1	9.9	-2.1	0	0	0	110.3	K311	P278-K311 PolarHBondContact O-NZ 2.89Å
279	N	86.1	Confident	87.8	Confident	31 Å²	31	57.2 Å²	57.2	17%	0.166	33%	0.332	C	S	.	.			trans	-108.6	85.9	-177.3	179.8	22	0	0	0	111.3	G281 M348 A350 R351 I353	N279-G281 PolarHBondContact O-N 3.42Å; N279-G281 PolarHBondContact OD1-N 2.86Å; N279-M348 PolarHBondContact ND2-O 3.15Å; N279-A350 VanDerWaalsContact CB-O 3.26Å; N279-A350 WeakPolarHBondContact CB-O 3.24Å; N279-A350 PolarHBondContact ND2-O 2.9Å; N279-R351 PolarHBondContact N-O 2.84Å; N279-I353 HydrophobicContact CB-CD1 4.5Å
280	D	81.3	Confident	88.4	Confident	126 Å²	126	55.3 Å²	55.3	67%	0.674	33%	0.325	S	S	*	.			trans	-87.6	14	-178.9	-42.7	-72.3	0	0	0	112.8	G282 K311	D280-G282 VanDerWaalsContact C-N 3.32Å; D280-G282 PolarHBondContact O-N 3.44Å; D280-K311 IonicContact OD2-NZ 3.18Å; D280-K311 PolarHBondContact OD2-NZ 3.12Å
281	G	73	Confident	88.8	Confident	67 Å²	67	50.9 Å²	50.9	69%	0.691	30%	0.3	S	S	*	.	S	Bend	trans	81.7	-1.9	179.8	0	0	0	0	0	115.9	N279	N279-G281 PolarHBondContact O-N 3.42Å; N279-G281 PolarHBondContact OD1-N 2.86Å
282	G	78.6	Confident	89.1	Confident	40 Å²	40	53 Å²	53	41%	0.412	32%	0.316	S	S	.	.	S	Bend	trans	-79.5	166	174.4	0	0	0	0	0	114.3	D280	D280-G282 VanDerWaalsContact C-N 3.32Å; D280-G282 PolarHBondContact O-N 3.44Å
283	P	83.6	Confident	88.8	Confident	101 Å²	101	52.3 Å²	52.3	66%	0.656	31%	0.313	S	S	*	.			trans	-68.9	130.6	174.4	29.3	-33.8	0	0	0	111.3	G285	P283-G285 VanDerWaalsContact C-N 3.29Å; P283-G285 PolarHBondContact O-N 3.34Å
284	L	88.9	Confident	88.2	Confident	18 Å²	18	59 Å²	59	9%	0.094	34%	0.336	C	S	.	.			trans	-70.7	-23.3	179.3	-175	54.6	0	0	0	113	V277 I286 K311 A312 L317 F318 F355	V277-L284 HydrophobicContact CG1-CD1 3.73Å; L284-I286 HydrophobicContact CD2-CD1 3.7Å; L284-I286 HydrophobicContact CD2-CG1 4.16Å; L284-I286 HydrophobicContact CG-CD1 4.21Å; L284-I286 HydrophobicContact CG-CG1 4.2Å; L284-I286 HydrophobicContact CG-CG2 4.38Å; L284-K311 HydrophobicContact CD1-CB 4.38Å; L284-A312 HydrophobicContact CD1-CB 4.36Å; L284-A312 WeakPolarHBondContact O-CB 3.27Å; L284-A312 PolarHBondContact O-N 2.93Å; L284-L317 HydrophobicContact CD1-CD1 4.22Å; L284-F318 HydrophobicContact CD2-CE2 4.44Å; L284-F355 HydrophobicContact CD2-CE2 4.13Å; L284-F355 HydrophobicContact CD2-CZ 3.97Å
285	G	91.2	Very high	87.3	Confident	5 Å²	5	57.2 Å²	57.2	5%	0.052	34%	0.339	C	S	.	.			trans	71.6	39	175.2	0	0	0	0	0	115.1	P283 E307	P283-G285 VanDerWaalsContact C-N 3.29Å; P283-G285 PolarHBondContact O-N 3.34Å; G285-E307 PolarHBondContact O-N 3.17Å
286	I	93.4	Very high	86.6	Confident	32 Å²	32	60.1 Å²	60.1	16%	0.164	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.3	177.2	60.6	175.7	0	0	0	112.2	L284 V288 L306 A312 F318 I324 F344	L284-I286 HydrophobicContact CD2-CD1 3.7Å; L284-I286 HydrophobicContact CD2-CG1 4.16Å; L284-I286 HydrophobicContact CG-CD1 4.21Å; L284-I286 HydrophobicContact CG-CG1 4.2Å; L284-I286 HydrophobicContact CG-CG2 4.38Å; I286-V288 HydrophobicContact CD1-CG1 4.17Å; I286-V288 HydrophobicContact CG1-CG1 4.44Å; I286-L306 HydrophobicContact CG2-CD2 3.89Å; I286-A312 HydrophobicContact CG2-CB 3.3Å; I286-F318 HydrophobicContact CD1-CE2 4.47Å; I286-F318 HydrophobicContact CG2-CD2 4.02Å; I286-F318 HydrophobicContact CG2-CE2 4.34Å; I286-I324 HydrophobicContact CD1-CD1 4.44Å; I286-F344 HydrophobicContact CD1-CE1 3.93Å; I286-F344 HydrophobicContact CD1-CZ 3.75Å
287	H	93.2	Very high	86.2	Confident	99 Å²	99	57.9 Å²	57.9	46%	0.458	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.7	168.6	-63.8	-86.9	0	0	0	109.7	K304 R305	H287-K304 PolarHBondContact O-N 3.06Å; H287-R305 HydrophobicContact CB-CB 4.12Å; H287-R305 PolarHBondContact N-O 2.95Å; H287-R305 PolarHBondContact O-N 3.37Å
288	V	94.5	Very high	86.2	Confident	34 Å²	34	59 Å²	59	21%	0.206	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.4	-177.6	-67.8	0	0	0	0	112.9	I286 L301 L302 V303 I324 F344	I286-V288 HydrophobicContact CD1-CG1 4.17Å; I286-V288 HydrophobicContact CG1-CG1 4.44Å; V288-L301 HydrophobicContact CB-CB 4.27Å; V288-L301 HydrophobicContact CG2-CD1 4.27Å; V288-L302 CarbonylContact C-O 3.53Å; V288-L302 VanDerWaalsContact CA-O 3.29Å; V288-L302 WeakPolarHBondContact CA-O 3.26Å; V288-V303 HydrophobicContact CG1-CG2 4.28Å; V288-I324 HydrophobicContact CG1-CD1 4.3Å; V288-F344 HydrophobicContact CG2-CE2 4.35Å
289	V	93.4	Very high	86.4	Confident	49 Å²	49	56.6 Å²	56.6	30%	0.297	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.4	176.8	-61.1	0	0	0	0	110.8	F291 L301 L302 K304	V289-F291 PolarHBondContact O-N 3.48Å; V289-F291 VanDerWaalsContact O-N 3.16Å; V289-L301 CarbonylContact O-C 3.55Å; V289-L301 WeakPolarHBondContact O-CA 3.27Å; V289-L302 HydrophobicContact CG2-CB 3.96Å; V289-L302 HydrophobicContact CG2-CD2 4.4Å; V289-L302 PolarHBondContact N-O 2.82Å; V289-L302 PolarHBondContact O-N 3.48Å; V289-K304 HydrophobicContact CG1-CB 4.11Å; V289-K304 HydrophobicContact CG1-CD 3.85Å; V289-K304 HydrophobicContact CG2-CB 4.15Å
290	P	93	Very high	86.7	Confident	59 Å²	59	55.1 Å²	55.1	38%	0.383	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	112.7	-179.5	27.2	-33.5	0	0	0	111.6	F337	P290-F337 HydrophobicContact CB-CB 4.39Å; P290-F337 HydrophobicContact CB-CD2 4.02Å; P290-F337 HydrophobicContact CB-CG 4.5Å; P290-F337 HydrophobicContact CG-CD2 4.11Å; P290-F337 HydrophobicContact CG-CG 4.38Å
291	F	93.1	Very high	87.4	Confident	19 Å²	19	49.3 Å²	49.3	8%	0.083	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.8	171.8	-172.5	-140.2	0	0	0	109	V289 T298 L299 G300 L302 C323 K363 Y366 E367	V289-F291 PolarHBondContact O-N 3.48Å; V289-F291 VanDerWaalsContact O-N 3.16Å; F291-T298 CarbonylContact O-C 3.5Å; F291-T298 WeakPolarHBondContact O-CA 3.44Å; F291-T298 WeakPolarHBondContact O-CG2 3.28Å; F291-L299 HydrophobicContact CD1-CB 3.64Å; F291-L299 HydrophobicContact CD1-CD1 3.99Å; F291-L299 HydrophobicContact CD1-CG 4.41Å; F291-L299 HydrophobicContact CE1-CB 4.07Å; F291-L299 HydrophobicContact CE1-CD1 3.57Å; F291-L299 HydrophobicContact CE1-CG 4.44Å; F291-L299 HydrophobicContact CG-CB 4.35Å; F291-L299 HydrophobicContact CZ-CD1 4.02Å; F291-L299 PolarHBondContact O-N 2.71Å; F291-G300 PolarHBondContact N-O 2.87Å; F291-G300 PolarHBondContact O-N 3.13Å; F291-L302 HydrophobicContact CB-CB 4.16Å; F291-C323 HydrophobicContact CD1-CB 4.48Å; F291-C323 VanDerWaalsContact CD1-SG 3.57Å; F291-K363 HydrophobicContact CE1-CG 4.25Å; F291-K363 HydrophobicContact CZ-CD 4.44Å; F291-K363 HydrophobicContact CZ-CG 4.08Å; F291-Y366 HydrophobicContact CE1-CD1 4.28Å; F291-Y366 HydrophobicContact CE1-CE1 4.45Å; F291-E367 HydrophobicContact CZ-CB 4.22Å; F291-E367 HydrophobicContact CZ-CG 4.49Å; F291-E367 WeakPolarHBondContact CZ-OE2 3.42Å
292	S	90.2	Very high	88.4	Confident	55 Å²	55	47.2 Å²	47.2	39%	0.385	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.1	-177	-57.2	0	0	0	0	110.6	R297	S292-R297 CarbonylContact C-O 3.58Å; S292-R297 VanDerWaalsContact CA-O 3.27Å; S292-R297 WeakPolarHBondContact CA-O 3.43Å
293	A	83.7	Confident	89.2	Confident	8 Å²	8	45.3 Å²	45.3	7%	0.066	26%	0.263	C	S	.	.			trans	-65.8	158	174.2	0	0	0	0	0	110.9	G295 G296 R297 L299	A293-G295 PolarHBondContact O-N 3.39Å; A293-G296 PolarHBondContact O-N 2.87Å; A293-R297 PolarHBondContact N-O 2.7Å; A293-L299 HydrophobicContact CB-CD1 3.93Å; A293-L299 HydrophobicContact CB-CD2 4.15Å; A293-L299 HydrophobicContact CB-CG 4Å
294	R	79.6	Confident	89.7	Confident	238 Å²	238	47.3 Å²	47.3	90%	0.898	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-24.7	173.9	-169.4	178.4	-74.9	-151.6	-0.1	114.7
295	G	72.6	Confident	89.9	Confident	52 Å²	52	53.9 Å²	53.9	54%	0.536	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	22.5	174.2	0	0	0	0	0	116.7	A293 R297	A293-G295 PolarHBondContact O-N 3.39Å; G295-R297 VanDerWaalsContact C-N 3.3Å; G295-R297 PolarHBondContact O-N 3.15Å
296	G	78.6	Confident	89.9	Confident	68 Å²	68	54.9 Å²	54.9	70%	0.701	29%	0.289	S	S	*	.	S	Bend	trans	73.3	7.5	171.3	0	0	0	0	0	116.8	A293	A293-G296 PolarHBondContact O-N 2.87Å
297	R	84.4	Confident	89.8	Confident	58 Å²	58	58 Å²	58	22%	0.219	30%	0.303	C	S	.	.			trans	-91.7	132.1	175.5	-63.4	-174.2	-56	166.7	8.7	110.4	S292 A293 G295 L299 N334 S370	S292-R297 CarbonylContact C-O 3.58Å; S292-R297 VanDerWaalsContact CA-O 3.27Å; S292-R297 WeakPolarHBondContact CA-O 3.43Å; A293-R297 PolarHBondContact N-O 2.7Å; G295-R297 VanDerWaalsContact C-N 3.3Å; G295-R297 PolarHBondContact O-N 3.15Å; R297-L299 PolarHBondContact O-N 2.84Å; R297-N334 WeakPolarHBondContact CD-OD1 3.45Å; R297-S370 PolarHBondContact NH2-O 3.48Å
298	T	89.8	Confident	89.6	Confident	27 Å²	27	62.2 Å²	62.2	17%	0.166	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	125.6	172.2	-44	0	0	0	0	110.4	F291 N334 R335	F291-T298 CarbonylContact O-C 3.5Å; F291-T298 WeakPolarHBondContact O-CA 3.44Å; F291-T298 WeakPolarHBondContact O-CG2 3.28Å; T298-N334 PolarHBondContact O-N 3.5Å; T298-R335 WeakPolarHBondContact CB-O 3.46Å; T298-R335 WeakPolarHBondContact CG2-O 3.43Å; T298-R335 PolarHBondContact OG1-O 2.82Å; T298-R335 VanDerWaalsContact OG1-O 3.12Å
299	L	91.9	Very high	89	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-23.7	174.2	-64.6	-176	0	0	0	112.4	F291 A293 R297 R333 Y366 E367 S370	F291-L299 HydrophobicContact CD1-CB 3.64Å; F291-L299 HydrophobicContact CD1-CD1 3.99Å; F291-L299 HydrophobicContact CD1-CG 4.41Å; F291-L299 HydrophobicContact CE1-CB 4.07Å; F291-L299 HydrophobicContact CE1-CD1 3.57Å; F291-L299 HydrophobicContact CE1-CG 4.44Å; F291-L299 HydrophobicContact CG-CB 4.35Å; F291-L299 HydrophobicContact CZ-CD1 4.02Å; F291-L299 PolarHBondContact O-N 2.71Å; A293-L299 HydrophobicContact CB-CD1 3.93Å; A293-L299 HydrophobicContact CB-CD2 4.15Å; A293-L299 HydrophobicContact CB-CG 4Å; R297-L299 PolarHBondContact O-N 2.84Å; L299-R333 WeakPolarHBondContact O-CG 3.42Å; L299-Y366 HydrophobicContact CB-CE1 3.93Å; L299-Y366 PolarHBondContact O-OH 2.78Å; L299-E367 HydrophobicContact CD1-CB 4.23Å; L299-E367 HydrophobicContact CD1-CG 4.11Å; L299-S370 WeakPolarHBondContact CD2-OG 3.48Å
300	G	93	Very high	88.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	-151.8	-179.6	0	0	0	0	0	112	F291 I324	F291-G300 PolarHBondContact N-O 2.87Å; F291-G300 PolarHBondContact O-N 3.13Å; G300-I324 WeakPolarHBondContact CA-O 3.38Å
301	L	95.3	Very high	88.5	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.7	174.9	-65.8	-177.6	0	0	0	110.4	V288 V289 I324 L332 F337 A340 F344	V288-L301 HydrophobicContact CB-CB 4.27Å; V288-L301 HydrophobicContact CG2-CD1 4.27Å; V289-L301 CarbonylContact O-C 3.55Å; V289-L301 WeakPolarHBondContact O-CA 3.27Å; L301-I324 HydrophobicContact CB-CB 4.41Å; L301-I324 PolarHBondContact N-O 2.93Å; L301-I324 PolarHBondContact O-N 3.17Å; L301-L332 HydrophobicContact CB-CD1 4.45Å; L301-L332 HydrophobicContact CD1-CD1 4.14Å; L301-L332 HydrophobicContact CG-CD1 4.06Å; L301-F337 HydrophobicContact CD2-CD2 3.65Å; L301-F337 HydrophobicContact CD2-CE2 3.82Å; L301-A340 HydrophobicContact CD1-CB 3.91Å; L301-A340 HydrophobicContact CD2-CB 4.23Å; L301-A340 HydrophobicContact CG-CB 4.28Å; L301-F344 HydrophobicContact CD1-CD2 3.87Å; L301-F344 HydrophobicContact CD1-CE2 3.58Å
302	L	94.7	Very high	88.4	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.12	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.9	175.4	-169.1	74.7	0	0	0	109.9	V288 V289 F291 K304 N321 D322 C323 K363	V288-L302 CarbonylContact C-O 3.53Å; V288-L302 VanDerWaalsContact CA-O 3.29Å; V288-L302 WeakPolarHBondContact CA-O 3.26Å; V289-L302 HydrophobicContact CG2-CB 3.96Å; V289-L302 HydrophobicContact CG2-CD2 4.4Å; V289-L302 PolarHBondContact N-O 2.82Å; V289-L302 PolarHBondContact O-N 3.48Å; F291-L302 HydrophobicContact CB-CB 4.16Å; L302-K304 PolarHBondContact O-N 3.2Å; L302-N321 HydrophobicContact CD1-CB 4.4Å; L302-N321 VanDerWaalsContact CD1-O 3.26Å; L302-N321 WeakPolarHBondContact CD1-O 3.47Å; L302-D322 WeakPolarHBondContact CA-O 3.48Å; L302-C323 HydrophobicContact CD1-CB 4.38Å; L302-K363 HydrophobicContact CD1-CD 4.12Å
303	V	95	Very high	88.4	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	104.2	169.5	-179.4	0	0	0	0	108	V288 L306 F318 N321 D322 I324	V288-V303 HydrophobicContact CG1-CG2 4.28Å; V303-L306 HydrophobicContact CG1-CD2 3.72Å; V303-F318 HydrophobicContact CG2-CB 4.4Å; V303-F318 HydrophobicContact CG2-CD1 4.28Å; V303-N321 WeakPolarHBondContact O-CA 3.31Å; V303-N321 PolarHBondContact O-N 2.82Å; V303-D322 HydrophobicContact CG2-CB 4.32Å; V303-D322 PolarHBondContact N-O 3.38Å; V303-I324 HydrophobicContact CG2-CD1 4.27Å; V303-I324 HydrophobicContact CG2-CG1 4.28Å
304	K	93.6	Very high	88.5	Confident	142 Å²	142	66.8 Å²	66.8	62%	0.617	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	-28.5	-177.5	-177.3	173.1	179.1	-178.5	0	112.9	H287 V289 L302	H287-K304 PolarHBondContact O-N 3.06Å; V289-K304 HydrophobicContact CG1-CB 4.11Å; V289-K304 HydrophobicContact CG1-CD 3.85Å; V289-K304 HydrophobicContact CG2-CB 4.15Å; L302-K304 PolarHBondContact O-N 3.2Å
305	R	93.2	Very high	89	Confident	156 Å²	156	59.8 Å²	59.8	59%	0.589	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.5	148.5	178.7	171.7	176.4	-68	172.5	0.4	111.2	H287 E320	H287-R305 HydrophobicContact CB-CB 4.12Å; H287-R305 PolarHBondContact N-O 2.95Å; H287-R305 PolarHBondContact O-N 3.37Å; R305-E320 VanDerWaalsContact CA-OE1 3.29Å; R305-E320 WeakPolarHBondContact CA-OE1 3.22Å
306	L	92.3	Very high	89.8	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.141	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	143.2	164.8	-54.7	176.7	0	0	0	110.8	I286 V303 A312 E313 F318 E320	I286-L306 HydrophobicContact CG2-CD2 3.89Å; V303-L306 HydrophobicContact CG1-CD2 3.72Å; L306-A312 HydrophobicContact CD2-CB 4.18Å; L306-E313 HydrophobicContact CB-CB 4.38Å; L306-F318 VanDerWaalsContact CD1-O 3.32Å; L306-F318 WeakPolarHBondContact CD1-O 3.46Å; L306-F318 HydrophobicContact CD2-CB 4.23Å; L306-E320 HydrophobicContact CG-CG 4.36Å; L306-E320 PolarHBondContact N-OE1 3.31Å
307	E	90.8	Very high	90.4	Very high	96 Å²	96	60.2 Å²	60.2	45%	0.449	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-82.6	130.3	175.8	-173.2	172.4	-161.6	0	0	110.1	G285 G309 G310	G285-E307 PolarHBondContact O-N 3.17Å; E307-G309 PolarHBondContact O-N 3.26Å; E307-G310 WeakPolarHBondContact O-CA 3.26Å; E307-G310 PolarHBondContact O-N 3.23Å
308	K	88.7	Confident	90.9	Very high	188 Å²	188	57.6 Å²	57.6	82%	0.817	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	122	-174.7	-68.6	-162.8	169.5	-167.6	0	111.8	E313	K308-E313 VanDerWaalsContact CA-OE2 3.3Å; K308-E313 WeakPolarHBondContact CA-OE2 3.43Å
309	G	82.6	Confident	91	Very high	59 Å²	59	61.3 Å²	61.3	61%	0.608	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	7	-170.4	0	0	0	0	0	114.5	E307 E313	E307-G309 PolarHBondContact O-N 3.26Å; G309-E313 PolarHBondContact N-OE2 3.22Å
310	G	86.9	Confident	90.9	Very high	7 Å²	7	65.9 Å²	65.9	7%	0.072	32%	0.319	C	S	.	.	S	Bend	trans	-76	155.3	170.3	0	0	0	0	0	111.7	E307 A312 E313 Q314	E307-G310 WeakPolarHBondContact O-CA 3.26Å; E307-G310 PolarHBondContact O-N 3.23Å; G310-A312 VanDerWaalsContact C-N 3.25Å; G310-A312 PolarHBondContact O-N 3.31Å; G310-A312 VanDerWaalsContact O-N 3.13Å; G310-E313 PolarHBondContact O-N 3.27Å; G310-Q314 PolarHBondContact O-N 3Å
311	K	89.1	Confident	90.9	Very high	32 Å²	32	69.8 Å²	69.8	14%	0.139	34%	0.34	C	S	.	.	H	α-helix	trans	-54.6	-38.6	-171.9	-170.3	170.8	-174.6	-179.9	0	113.5	P278 D280 L284 E313 Q314 E315	P278-K311 PolarHBondContact O-NZ 2.89Å; D280-K311 IonicContact OD2-NZ 3.18Å; D280-K311 PolarHBondContact OD2-NZ 3.12Å; L284-K311 HydrophobicContact CD1-CB 4.38Å; K311-E313 PolarHBondContact O-N 2.84Å; K311-Q314 PolarHBondContact O-N 3.42Å; K311-E315 WeakPolarHBondContact CE-OE1 3.3Å; K311-E315 WeakPolarHBondContact CE-OE2 3.41Å; K311-E315 HydrophobicContact CG-CG 4.33Å; K311-E315 IonicContact NZ-OE1 3.52Å; K311-E315 IonicContact NZ-OE2 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.22Å; K311-E315 PolarHBondContact O-N 2.82Å
312	A	90.6	Very high	90.9	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-34	177.6	0	0	0	0	0	115	L284 I286 L306 G310 N316 L317 F318	L284-A312 HydrophobicContact CD1-CB 4.36Å; L284-A312 WeakPolarHBondContact O-CB 3.27Å; L284-A312 PolarHBondContact O-N 2.93Å; I286-A312 HydrophobicContact CG2-CB 3.3Å; L306-A312 HydrophobicContact CD2-CB 4.18Å; G310-A312 VanDerWaalsContact C-N 3.25Å; G310-A312 PolarHBondContact O-N 3.31Å; G310-A312 VanDerWaalsContact O-N 3.13Å; A312-N316 WeakPolarHBondContact O-CA 3.47Å; A312-N316 PolarHBondContact O-N 3.06Å; A312-L317 PolarHBondContact O-N 3.32Å; A312-F318 HydrophobicContact CB-CD2 3.86Å; A312-F318 HydrophobicContact CB-CE2 4.44Å
313	E	89.3	Confident	90.9	Very high	71 Å²	71	68.9 Å²	68.9	33%	0.332	34%	0.335	S	S	.	.	H	α-helix	trans	-76.4	-48	173.6	-169.6	-169.4	-118.1	0	0	109.8	L306 K308 G309 G310 K311 E315 N316	L306-E313 HydrophobicContact CB-CB 4.38Å; K308-E313 VanDerWaalsContact CA-OE2 3.3Å; K308-E313 WeakPolarHBondContact CA-OE2 3.43Å; G309-E313 PolarHBondContact N-OE2 3.22Å; G310-E313 PolarHBondContact O-N 3.27Å; K311-E313 PolarHBondContact O-N 2.84Å; E313-E315 PolarHBondContact O-N 2.9Å; E313-N316 PolarHBondContact O-N 3.2Å; E313-N316 VanDerWaalsContact O-N 3.14Å; E313-N316 PolarHBondContact O-ND2 2.84Å
314	Q	87.7	Confident	90.9	Very high	152 Å²	152	68.9 Å²	68.9	71%	0.71	34%	0.335	S	S	*	.	H	α-helix	trans	-62	-40.6	-176.7	-171.4	177.4	9.2	0	0	113.1	G310 K311	G310-Q314 PolarHBondContact O-N 3Å; K311-Q314 PolarHBondContact O-N 3.42Å
315	E	88.6	Confident	90.9	Very high	90 Å²	90	62.1 Å²	62.1	42%	0.421	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	3.1	177.7	-67.1	-177.2	175	0	0	113.3	K311 E313 L317	K311-E315 WeakPolarHBondContact CE-OE1 3.3Å; K311-E315 WeakPolarHBondContact CE-OE2 3.41Å; K311-E315 HydrophobicContact CG-CG 4.33Å; K311-E315 IonicContact NZ-OE1 3.52Å; K311-E315 IonicContact NZ-OE2 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.22Å; K311-E315 PolarHBondContact O-N 2.82Å; E313-E315 PolarHBondContact O-N 2.9Å; E315-L317 HydrophobicContact CB-CD1 4Å; E315-L317 HydrophobicContact CB-CD2 4.17Å; E315-L317 HydrophobicContact CB-CG 3.71Å; E315-L317 PolarHBondContact O-N 2.85Å
316	N	90.3	Very high	91	Very high	112 Å²	112	57.3 Å²	57.3	60%	0.599	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	39.6	-179	-65.2	-94.7	0	0	0	113.7	A312 E313	A312-N316 WeakPolarHBondContact O-CA 3.47Å; A312-N316 PolarHBondContact O-N 3.06Å; E313-N316 PolarHBondContact O-N 3.2Å; E313-N316 VanDerWaalsContact O-N 3.14Å; E313-N316 PolarHBondContact O-ND2 2.84Å
317	L	91.1	Very high	91.1	Very high	18 Å²	18	56.3 Å²	56.3	9%	0.094	28%	0.282	C	S	.	.			trans	-72.3	-33.9	-172.8	-66.9	168.1	0	0	0	112.7	V275 V277 L284 A312 E315	V275-L317 HydrophobicContact CG1-CB 4.1Å; V275-L317 HydrophobicContact CG1-CD2 3.97Å; V277-L317 HydrophobicContact CB-CD1 4.44Å; V277-L317 HydrophobicContact CG1-CD1 3.98Å; V277-L317 HydrophobicContact CG2-CD1 3.81Å; V277-L317 HydrophobicContact CG2-CD2 4.22Å; V277-L317 HydrophobicContact CG2-CG 4.46Å; L284-L317 HydrophobicContact CD1-CD1 4.22Å; A312-L317 PolarHBondContact O-N 3.32Å; E315-L317 HydrophobicContact CB-CD1 4Å; E315-L317 HydrophobicContact CB-CD2 4.17Å; E315-L317 HydrophobicContact CB-CG 3.71Å; E315-L317 PolarHBondContact O-N 2.85Å
318	F	93.8	Very high	91.2	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.009	27%	0.27	C	S	.	.			trans	-138.9	160.6	-176.8	-53.6	-92	0	0	0	110	V277 L284 I286 V303 L306 A312 I324 F355 V357	V277-F318 HydrophobicContact CG2-CE2 4.5Å; L284-F318 HydrophobicContact CD2-CE2 4.44Å; I286-F318 HydrophobicContact CD1-CE2 4.47Å; I286-F318 HydrophobicContact CG2-CD2 4.02Å; I286-F318 HydrophobicContact CG2-CE2 4.34Å; V303-F318 HydrophobicContact CG2-CB 4.4Å; V303-F318 HydrophobicContact CG2-CD1 4.28Å; L306-F318 VanDerWaalsContact CD1-O 3.32Å; L306-F318 WeakPolarHBondContact CD1-O 3.46Å; L306-F318 HydrophobicContact CD2-CB 4.23Å; A312-F318 HydrophobicContact CB-CD2 3.86Å; A312-F318 HydrophobicContact CB-CE2 4.44Å; F318-I324 HydrophobicContact CD1-CD1 4.44Å; F318-I324 HydrophobicContact CE1-CD1 3.83Å; F318-I324 HydrophobicContact CE1-CG1 4.12Å; F318-I324 HydrophobicContact CZ-CD1 4.41Å; F318-F355 HydrophobicContact CE1-CB 4.03Å; F318-F355 HydrophobicContact CE1-CD1 4.5Å; F318-F355 HydrophobicContact CE1-CD2 4.33Å; F318-F355 HydrophobicContact CE1-CG 4.05Å; F318-F355 HydrophobicContact CZ-CB 4.14Å; F318-F355 HydrophobicContact CZ-CD1 4.25Å; F318-F355 AromaticContact CZ-CD2 3.59Å; F318-F355 HydrophobicContact CZ-CD2 3.59Å; F318-F355 AromaticContact CZ-CE2 3.94Å; F318-F355 HydrophobicContact CZ-CE2 3.94Å; F318-F355 AromaticContact CZ-CG 3.73Å; F318-F355 HydrophobicContact CZ-CG 3.73Å; F318-F355 HydrophobicContact CZ-CZ 4.41Å; F318-V357 HydrophobicContact CD1-CG2 4.08Å; F318-V357 HydrophobicContact CE1-CG2 3.76Å
319	H	91.8	Very high	91.1	Very high	105 Å²	105	52.4 Å²	52.4	49%	0.486	27%	0.273	S	S	.	.			trans	-117	161.7	170.3	-57.8	77.4	0	0	0	110.8	N321 D322	H319-N321 PolarHBondContact O-N 3.13Å; H319-D322 PolarHBondContact N-OD2 2.8Å; H319-D322 IonicContact ND1-OD2 3.32Å; H319-D322 WeakPolarHBondContact O-CB 3.3Å; H319-D322 PolarHBondContact O-N 3.35Å
320	E	91.8	Very high	91.5	Very high	98 Å²	98	50.6 Å²	50.6	46%	0.458	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	131.7	170.8	-61	-166.3	151.1	0	0	110.2	R305 L306	R305-E320 VanDerWaalsContact CA-OE1 3.29Å; R305-E320 WeakPolarHBondContact CA-OE1 3.22Å; L306-E320 HydrophobicContact CG-CG 4.36Å; L306-E320 PolarHBondContact N-OE1 3.31Å
321	N	91.8	Very high	91.8	Very high	84 Å²	84	52.3 Å²	52.3	45%	0.449	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	8.2	-171.9	-46.6	-82.5	0	0	0	117	L302 V303 H319 A360	L302-N321 HydrophobicContact CD1-CB 4.4Å; L302-N321 VanDerWaalsContact CD1-O 3.26Å; L302-N321 WeakPolarHBondContact CD1-O 3.47Å; V303-N321 WeakPolarHBondContact O-CA 3.31Å; V303-N321 PolarHBondContact O-N 2.82Å; H319-N321 PolarHBondContact O-N 3.13Å; N321-A360 HydrophobicContact CB-CB 4.12Å
322	D	95.1	Very high	92	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.037	26%	0.256	C	S	.	.			trans	-64.1	145.1	164.5	-80.4	-10.5	0	0	0	111.1	L302 V303 H319 V357 P359 A360	L302-D322 WeakPolarHBondContact CA-O 3.48Å; V303-D322 HydrophobicContact CG2-CB 4.32Å; V303-D322 PolarHBondContact N-O 3.38Å; H319-D322 PolarHBondContact N-OD2 2.8Å; H319-D322 IonicContact ND1-OD2 3.32Å; H319-D322 WeakPolarHBondContact O-CB 3.3Å; H319-D322 PolarHBondContact O-N 3.35Å; D322-V357 HydrophobicContact CB-CG1 3.71Å; D322-P359 VanDerWaalsContact OD1-CA 3.32Å; D322-P359 WeakPolarHBondContact OD1-CA 3.34Å; D322-A360 PolarHBondContact OD1-N 2.88Å
323	C	94.6	Very high	92	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	108.9	-177.5	176.4	0	0	0	0	112.2	F291 L302 V325 V358	F291-C323 HydrophobicContact CD1-CB 4.48Å; F291-C323 VanDerWaalsContact CD1-SG 3.57Å; L302-C323 HydrophobicContact CD1-CB 4.38Å; C323-V325 PolarHBondContact O-N 3.42Å; C323-V358 HydrophobicContact CB-CB 4.3Å; C323-V358 PolarHBondContact N-O 3.1Å; C323-V358 PolarHBondContact O-N 3.47Å
324	I	95.5	Very high	92	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.3	175	-47.2	178.8	0	0	0	109.2	I286 V288 G300 L301 V303 F318 I327 L332 F344 F355 V357	I286-I324 HydrophobicContact CD1-CD1 4.44Å; V288-I324 HydrophobicContact CG1-CD1 4.3Å; G300-I324 WeakPolarHBondContact CA-O 3.38Å; L301-I324 HydrophobicContact CB-CB 4.41Å; L301-I324 PolarHBondContact N-O 2.93Å; L301-I324 PolarHBondContact O-N 3.17Å; V303-I324 HydrophobicContact CG2-CD1 4.27Å; V303-I324 HydrophobicContact CG2-CG1 4.28Å; F318-I324 HydrophobicContact CD1-CD1 4.44Å; F318-I324 HydrophobicContact CE1-CD1 3.83Å; F318-I324 HydrophobicContact CE1-CG1 4.12Å; F318-I324 HydrophobicContact CZ-CD1 4.41Å; I324-I327 HydrophobicContact CG2-CG1 4.05Å; I324-L332 HydrophobicContact CB-CD1 4.33Å; I324-L332 HydrophobicContact CG2-CD1 3.93Å; I324-L332 WeakPolarHBondContact O-CD1 3.38Å; I324-F344 HydrophobicContact CD1-CE2 4.44Å; I324-F344 HydrophobicContact CD1-CZ 3.99Å; I324-F355 HydrophobicContact CD1-CD1 4.14Å; I324-F355 HydrophobicContact CD1-CE1 4.47Å; I324-F355 HydrophobicContact CG2-CB 4.43Å; I324-F355 HydrophobicContact CG2-CD1 3.83Å; I324-V357 HydrophobicContact CG1-CG2 4.41Å
325	V	94.5	Very high	92.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-29.7	-177.3	-64.3	0	0	0	0	113.7	V272 C323 L332 H356 V358 Y366	V272-V325 HydrophobicContact CG1-CG2 4.5Å; V272-V325 HydrophobicContact CG2-CG2 3.86Å; C323-V325 PolarHBondContact O-N 3.42Å; V325-L332 VanDerWaalsContact O-CB 3.28Å; V325-L332 WeakPolarHBondContact O-CB 3.18Å; V325-L332 PolarHBondContact O-N 2.88Å; V325-H356 HydrophobicContact CG2-CB 4.08Å; V325-H356 WeakPolarHBondContact CG2-O 3.49Å; V325-H356 PolarHBondContact N-O 3.46Å; V325-V358 HydrophobicContact CG1-CG2 3.84Å; V325-V358 HydrophobicContact CG2-CG2 4.31Å; V325-Y366 HydrophobicContact CG1-CD1 4.36Å; V325-Y366 HydrophobicContact CG1-CE1 3.53Å; V325-Y366 HydrophobicContact CG1-CE2 4.25Å; V325-Y366 VanDerWaalsContact CG1-CZ 3.47Å; V325-Y366 WeakPolarHBondContact CG1-OH 3.44Å
326	R	94.5	Very high	92.2	Very high	55 Å²	55	57.6 Å²	57.6	21%	0.208	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.8	171.5	-39.9	-170.7	-108.9	117.8	-3.7	110.8	D269 G330 D331 H356	D269-R326 IonicContact OD1-CZ 3.82Å; D269-R326 IonicContact OD1-NH2 2.67Å; D269-R326 PolarHBondContact OD1-NH2 3.22Å; R326-G330 CarbonylContact C-O 3.55Å; R326-G330 VanDerWaalsContact CA-O 3.27Å; R326-G330 WeakPolarHBondContact CA-O 3.39Å; R326-D331 HydrophobicContact CG-CB 4.43Å; R326-H356 HydrophobicContact CB-CB 3.76Å; R326-H356 HydrophobicContact CG-CB 4.1Å; R326-H356 PolarHBondContact N-O 3.47Å; R326-H356 PolarHBondContact NH1-CD2 2.95Å; R326-H356 VanDerWaalsContact NH1-CD2 3.29Å; R326-H356 PolarHBondContact NH1-CE1 2.9Å; R326-H356 PolarHBondContact NH1-NE2 3.47Å; R326-H356 PolarHBondContact NH2-CD2 3.37Å; R326-H356 VanDerWaalsContact NH2-CD2 3.29Å; R326-H356 PolarHBondContact O-N 2.79Å
327	I	94.6	Very high	92.3	Very high	7 Å²	7	55.9 Å²	55.9	4%	0.036	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.6	173.3	-49.6	176.8	0	0	0	108	I324 D329 G330 L332 F344 A347 I353 F355	I324-I327 HydrophobicContact CG2-CG1 4.05Å; I327-D329 PolarHBondContact O-N 3.48Å; I327-G330 PolarHBondContact N-O 2.95Å; I327-G330 WeakPolarHBondContact O-CA 3.42Å; I327-G330 PolarHBondContact O-N 3.4Å; I327-L332 HydrophobicContact CD1-CD1 4Å; I327-L332 HydrophobicContact CD1-CD2 4.1Å; I327-L332 HydrophobicContact CG1-CD1 3.82Å; I327-L332 HydrophobicContact CG1-CD2 4.23Å; I327-L332 HydrophobicContact CG1-CG 4.25Å; I327-F344 HydrophobicContact CD1-CD1 4.36Å; I327-F344 HydrophobicContact CD1-CD2 3.36Å; I327-F344 HydrophobicContact CD1-CE1 4.45Å; I327-F344 HydrophobicContact CD1-CE2 3.48Å; I327-F344 VanDerWaalsContact CD1-CE2 3.48Å; I327-F344 HydrophobicContact CD1-CG 3.85Å; I327-F344 HydrophobicContact CD1-CZ 4.04Å; I327-A347 HydrophobicContact CG2-CB 3.63Å; I327-I353 HydrophobicContact CG2-CG2 3.89Å; I327-F355 HydrophobicContact CD1-CE1 4.21Å; I327-F355 HydrophobicContact CG1-CD1 4.03Å; I327-F355 HydrophobicContact CG1-CE1 4.11Å; I327-F355 HydrophobicContact CG2-CD1 4.12Å; I327-F355 HydrophobicContact CG2-CE1 3.84Å
328	N	91.9	Very high	92.3	Very high	37 Å²	37	62 Å²	62	20%	0.198	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	-130.9	-160.2	-57.4	-14.5	0	0	0	108.8	G330 W354	N328-G330 PolarHBondContact O-N 3.45Å; N328-W354 PolarHBondContact N-O 2.73Å; N328-W354 PolarHBondContact OD1-N 2.83Å
329	D	87.4	Confident	92.2	Very high	164 Å²	164	66 Å²	66	88%	0.877	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	0.4	177.9	-39.9	-82.8	0	0	0	113.4	I327	I327-D329 PolarHBondContact O-N 3.48Å
330	G	91	Very high	92.3	Very high	21 Å²	21	61.2 Å²	61.2	22%	0.216	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	106.4	-172.9	0	0	0	0	0	114	R326 I327 N328 M343	R326-G330 CarbonylContact C-O 3.55Å; R326-G330 VanDerWaalsContact CA-O 3.27Å; R326-G330 WeakPolarHBondContact CA-O 3.39Å; I327-G330 PolarHBondContact N-O 2.95Å; I327-G330 WeakPolarHBondContact O-CA 3.42Å; I327-G330 PolarHBondContact O-N 3.4Å; N328-G330 PolarHBondContact O-N 3.45Å; G330-M343 VanDerWaalsContact CA-CE 3.46Å; G330-M343 VanDerWaalsContact O-CE 3.27Å; G330-M343 WeakPolarHBondContact O-CE 3.14Å
331	D	93.1	Very high	92.3	Very high	43 Å²	43	59.9 Å²	59.9	23%	0.23	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.1	173.3	-165.9	-12.8	0	0	0	112.3	R326 R333 R335	R326-D331 HydrophobicContact CG-CB 4.43Å; D331-R333 VanDerWaalsContact OD1-CB 3.23Å; D331-R333 WeakPolarHBondContact OD1-CB 3.17Å; D331-R333 VanDerWaalsContact OD1-CG 3.23Å; D331-R333 WeakPolarHBondContact OD1-CG 3.26Å; D331-R333 PolarHBondContact OD1-N 2.81Å; D331-R333 IonicContact OD1-NE 3.67Å; D331-R333 PolarHBondContact OD1-NE 2.76Å; D331-R333 IonicContact OD2-CZ 3.58Å; D331-R333 VanDerWaalsContact OD2-CZ 3.3Å; D331-R333 IonicContact OD2-NE 2.76Å; D331-R333 PolarHBondContact OD2-NE 3.32Å; D331-R333 IonicContact OD2-NH2 2.78Å; D331-R333 PolarHBondContact OD2-NH2 3.27Å; D331-R335 VanDerWaalsContact O-CG 3.26Å; D331-R335 WeakPolarHBondContact O-CG 3.33Å; D331-R335 PolarHBondContact O-NE 2.96Å
332	L	93.3	Very high	92.3	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	27%	0.27	C	S	.	.			trans	-87.4	-14.5	178.4	-58.2	176.2	0	0	0	112.9	L301 I324 V325 I327 N334 R335 A340 M343	L301-L332 HydrophobicContact CB-CD1 4.45Å; L301-L332 HydrophobicContact CD1-CD1 4.14Å; L301-L332 HydrophobicContact CG-CD1 4.06Å; I324-L332 HydrophobicContact CB-CD1 4.33Å; I324-L332 HydrophobicContact CG2-CD1 3.93Å; I324-L332 WeakPolarHBondContact O-CD1 3.38Å; V325-L332 VanDerWaalsContact O-CB 3.28Å; V325-L332 WeakPolarHBondContact O-CB 3.18Å; V325-L332 PolarHBondContact O-N 2.88Å; I327-L332 HydrophobicContact CD1-CD1 4Å; I327-L332 HydrophobicContact CD1-CD2 4.1Å; I327-L332 HydrophobicContact CG1-CD1 3.82Å; I327-L332 HydrophobicContact CG1-CD2 4.23Å; I327-L332 HydrophobicContact CG1-CG 4.25Å; L332-N334 PolarHBondContact O-N 3.25Å; L332-R335 WeakPolarHBondContact O-CB 3.28Å; L332-R335 WeakPolarHBondContact O-CG 3.4Å; L332-R335 PolarHBondContact O-N 2.91Å; L332-R335 VanDerWaalsContact O-N 3.12Å; L332-A340 HydrophobicContact CD2-CB 3.83Å; L332-M343 HydrophobicContact CD2-CE 3.64Å; L332-M343 HydrophobicContact CD2-SD 3.86Å
333	R	90.5	Very high	92.2	Very high	53 Å²	53	59 Å²	59	20%	0.2	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	135.7	178.7	-64.2	-179	-57.4	151.2	1.9	110.5	L299 D331 R335 Y366 E373	L299-R333 WeakPolarHBondContact O-CG 3.42Å; D331-R333 VanDerWaalsContact OD1-CB 3.23Å; D331-R333 WeakPolarHBondContact OD1-CB 3.17Å; D331-R333 VanDerWaalsContact OD1-CG 3.23Å; D331-R333 WeakPolarHBondContact OD1-CG 3.26Å; D331-R333 PolarHBondContact OD1-N 2.81Å; D331-R333 IonicContact OD1-NE 3.67Å; D331-R333 PolarHBondContact OD1-NE 2.76Å; D331-R333 IonicContact OD2-CZ 3.58Å; D331-R333 VanDerWaalsContact OD2-CZ 3.3Å; D331-R333 IonicContact OD2-NE 2.76Å; D331-R333 PolarHBondContact OD2-NE 3.32Å; D331-R333 IonicContact OD2-NH2 2.78Å; D331-R333 PolarHBondContact OD2-NH2 3.27Å; R333-R335 PolarHBondContact O-N 3.01Å; R333-R335 VanDerWaalsContact O-N 3.08Å; R333-Y366 VanDerWaalsContact CD-OH 3.31Å; R333-Y366 WeakPolarHBondContact CD-OH 3.35Å; R333-Y366 WeakPolarHBondContact CG-OH 3.3Å; R333-E373 IonicContact CZ-OE1 3.93Å; R333-E373 IonicContact NH1-OE1 2.77Å; R333-E373 PolarHBondContact NH1-OE1 3.12Å; R333-E373 IonicContact NH1-OE2 3.46Å; R333-E373 PolarHBondContact NH1-OE2 3.06Å
334	N	88.9	Confident	92.1	Very high	94 Å²	94	60.5 Å²	60.5	50%	0.503	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	14.8	-175.7	-53.5	-78.2	0	0	0	115.2	R297 T298 L332	R297-N334 WeakPolarHBondContact CD-OD1 3.45Å; T298-N334 PolarHBondContact O-N 3.5Å; L332-N334 PolarHBondContact O-N 3.25Å
335	R	90.3	Very high	91.9	Very high	107 Å²	107	66.4 Å²	66.4	40%	0.404	30%	0.303	S	S	.	.			trans	-88.3	149.4	175	-56.5	-50	-167.2	164.8	-4.3	111.7	T298 D331 L332 R333	T298-R335 WeakPolarHBondContact CB-O 3.46Å; T298-R335 WeakPolarHBondContact CG2-O 3.43Å; T298-R335 PolarHBondContact OG1-O 2.82Å; T298-R335 VanDerWaalsContact OG1-O 3.12Å; D331-R335 VanDerWaalsContact O-CG 3.26Å; D331-R335 WeakPolarHBondContact O-CG 3.33Å; D331-R335 PolarHBondContact O-NE 2.96Å; L332-R335 WeakPolarHBondContact O-CB 3.28Å; L332-R335 WeakPolarHBondContact O-CG 3.4Å; L332-R335 PolarHBondContact O-N 2.91Å; L332-R335 VanDerWaalsContact O-N 3.12Å; R333-R335 PolarHBondContact O-N 3.01Å; R333-R335 VanDerWaalsContact O-N 3.08Å
336	R	89.9	Confident	91.8	Very high	201 Å²	201	72.1 Å²	72.1	76%	0.758	33%	0.33	S	S	*	.			trans	-72.6	148.5	170.1	-67.8	-178	-179.3	-98.9	-1.5	110.1	E338 Q339 A340	R336-E338 PolarHBondContact O-N 3.33Å; R336-E338 VanDerWaalsContact O-N 3.16Å; R336-Q339 WeakPolarHBondContact O-CA 3.48Å; R336-Q339 WeakPolarHBondContact O-CB 3.49Å; R336-Q339 PolarHBondContact O-N 3.41Å; R336-A340 PolarHBondContact O-N 2.83Å; R336-A340 VanDerWaalsContact O-N 3.07Å
337	F	92	Very high	91.6	Very high	75 Å²	75	69.6 Å²	69.6	33%	0.329	32%	0.321	S	S	.	.	H	α-helix	trans	-53.4	-37.9	-180	-174.7	-116.9	0	0	0	113.4	P290 L301 Q339 A340 Q341	P290-F337 HydrophobicContact CB-CB 4.39Å; P290-F337 HydrophobicContact CB-CD2 4.02Å; P290-F337 HydrophobicContact CB-CG 4.5Å; P290-F337 HydrophobicContact CG-CD2 4.11Å; P290-F337 HydrophobicContact CG-CG 4.38Å; L301-F337 HydrophobicContact CD2-CD2 3.65Å; L301-F337 HydrophobicContact CD2-CE2 3.82Å; F337-Q339 PolarHBondContact O-N 3.19Å; F337-A340 WeakPolarHBondContact O-CB 3.18Å; F337-A340 PolarHBondContact O-N 3.12Å; F337-Q341 HydrophobicContact CE1-CG 4.34Å; F337-Q341 WeakPolarHBondContact O-CG 3.35Å; F337-Q341 PolarHBondContact O-N 2.92Å
338	E	92	Very high	91.4	Very high	148 Å²	148	72.6 Å²	72.6	69%	0.692	34%	0.336	S	S	*	.	H	α-helix	trans	-62.9	-37.5	174.8	-177.9	174.4	-152.3	0	0	113.4	R336 Q341 H342	R336-E338 PolarHBondContact O-N 3.33Å; R336-E338 VanDerWaalsContact O-N 3.16Å; E338-Q341 WeakPolarHBondContact O-CB 3.49Å; E338-Q341 PolarHBondContact O-N 2.83Å; E338-H342 PolarHBondContact O-N 3.22Å
339	Q	91.7	Very high	91.1	Very high	86 Å²	86	80.2 Å²	80.2	40%	0.402	36%	0.362	S	S	.	.	H	α-helix	trans	-69.3	-41.5	174.9	-173.1	171.7	10.7	0	0	110.6	R336 F337 Q341 H342 M343	R336-Q339 WeakPolarHBondContact O-CA 3.48Å; R336-Q339 WeakPolarHBondContact O-CB 3.49Å; R336-Q339 PolarHBondContact O-N 3.41Å; F337-Q339 PolarHBondContact O-N 3.19Å; Q339-Q341 VanDerWaalsContact C-N 3.33Å; Q339-Q341 PolarHBondContact O-N 3.27Å; Q339-H342 WeakPolarHBondContact O-CB 3.39Å; Q339-H342 PolarHBondContact O-N 3.01Å; Q339-H342 VanDerWaalsContact O-N 3.11Å; Q339-M343 HydrophobicContact CG-SD 4.17Å; Q339-M343 VanDerWaalsContact O-CG 3.31Å; Q339-M343 WeakPolarHBondContact O-CG 3.17Å; Q339-M343 PolarHBondContact O-N 2.9Å
340	A	93.1	Very high	91.2	Very high	3 Å²	3	74 Å²	74	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-38.2	173.8	0	0	0	0	0	112.3	L301 L332 R336 F337 M343 F344	L301-A340 HydrophobicContact CD1-CB 3.91Å; L301-A340 HydrophobicContact CD2-CB 4.23Å; L301-A340 HydrophobicContact CG-CB 4.28Å; L332-A340 HydrophobicContact CD2-CB 3.83Å; R336-A340 PolarHBondContact O-N 2.83Å; R336-A340 VanDerWaalsContact O-N 3.07Å; F337-A340 WeakPolarHBondContact O-CB 3.18Å; F337-A340 PolarHBondContact O-N 3.12Å; A340-M343 PolarHBondContact O-N 3.23Å; A340-F344 PolarHBondContact O-N 3.35Å
341	Q	92.8	Very high	91.2	Very high	71 Å²	71	83.9 Å²	83.9	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-39.6	170.7	-74.4	-174.4	-1.5	0	0	112.6	F337 E338 Q339 F344 R345	F337-Q341 HydrophobicContact CE1-CG 4.34Å; F337-Q341 WeakPolarHBondContact O-CG 3.35Å; F337-Q341 PolarHBondContact O-N 2.92Å; E338-Q341 WeakPolarHBondContact O-CB 3.49Å; E338-Q341 PolarHBondContact O-N 2.83Å; Q339-Q341 VanDerWaalsContact C-N 3.33Å; Q339-Q341 PolarHBondContact O-N 3.27Å; Q341-F344 PolarHBondContact O-N 3.44Å; Q341-R345 WeakPolarHBondContact O-CG 3.49Å; Q341-R345 PolarHBondContact O-N 3.12Å
342	H	92.4	Very high	91.1	Very high	47 Å²	47	84.1 Å²	84.1	22%	0.218	37%	0.367	C	S	.	.	H	α-helix	trans	-64.3	-42.8	175.2	-178.8	83.9	0	0	0	111.4	E338 Q339 F344 R345 Q346 I482	E338-H342 PolarHBondContact O-N 3.22Å; Q339-H342 WeakPolarHBondContact O-CB 3.39Å; Q339-H342 PolarHBondContact O-N 3.01Å; Q339-H342 VanDerWaalsContact O-N 3.11Å; H342-F344 VanDerWaalsContact C-N 3.34Å; H342-F344 PolarHBondContact O-N 3.17Å; H342-R345 CarbonylContact O-C 3.43Å; H342-R345 PolarHBondContact O-N 2.87Å; H342-R345 VanDerWaalsContact O-N 3.1Å; H342-Q346 PolarHBondContact O-N 2.77Å; H342-I482 WeakPolarHBondContact CE1-CG2 3.32Å; H342-I482 WeakPolarHBondContact ND1-CG2 3.38Å
343	M	92.7	Very high	91.1	Very high	26 Å²	26	84.1 Å²	84.1	13%	0.128	37%	0.367	C	S	.	.	H	α-helix	trans	-61.2	-42	176.5	-64.6	160	73.6	0	0	111.4	G330 L332 Q339 A340 Q346 A347	G330-M343 VanDerWaalsContact CA-CE 3.46Å; G330-M343 VanDerWaalsContact O-CE 3.27Å; G330-M343 WeakPolarHBondContact O-CE 3.14Å; L332-M343 HydrophobicContact CD2-CE 3.64Å; L332-M343 HydrophobicContact CD2-SD 3.86Å; Q339-M343 HydrophobicContact CG-SD 4.17Å; Q339-M343 VanDerWaalsContact O-CG 3.31Å; Q339-M343 WeakPolarHBondContact O-CG 3.17Å; Q339-M343 PolarHBondContact O-N 2.9Å; A340-M343 PolarHBondContact O-N 3.23Å; M343-Q346 PolarHBondContact O-N 3.19Å; M343-A347 WeakPolarHBondContact O-CB 3.35Å; M343-A347 PolarHBondContact O-N 3.46Å
344	F	92.5	Very high	91.3	Very high	30 Å²	30	86.3 Å²	86.3	13%	0.132	38%	0.375	C	S	.	.	H	α-helix	trans	-57.3	-48.6	169	-107	-71.1	0	0	0	112.4	I286 V288 L301 I324 I327 A340 Q341 H342 Q346 A347 M348 F355	I286-F344 HydrophobicContact CD1-CE1 3.93Å; I286-F344 HydrophobicContact CD1-CZ 3.75Å; V288-F344 HydrophobicContact CG2-CE2 4.35Å; L301-F344 HydrophobicContact CD1-CD2 3.87Å; L301-F344 HydrophobicContact CD1-CE2 3.58Å; I324-F344 HydrophobicContact CD1-CE2 4.44Å; I324-F344 HydrophobicContact CD1-CZ 3.99Å; I327-F344 HydrophobicContact CD1-CD1 4.36Å; I327-F344 HydrophobicContact CD1-CD2 3.36Å; I327-F344 HydrophobicContact CD1-CE1 4.45Å; I327-F344 HydrophobicContact CD1-CE2 3.48Å; I327-F344 VanDerWaalsContact CD1-CE2 3.48Å; I327-F344 HydrophobicContact CD1-CG 3.85Å; I327-F344 HydrophobicContact CD1-CZ 4.04Å; A340-F344 PolarHBondContact O-N 3.35Å; Q341-F344 PolarHBondContact O-N 3.44Å; H342-F344 VanDerWaalsContact C-N 3.34Å; H342-F344 PolarHBondContact O-N 3.17Å; F344-Q346 VanDerWaalsContact C-N 3.26Å; F344-Q346 PolarHBondContact O-N 3.33Å; F344-A347 PolarHBondContact O-N 2.83Å; F344-M348 WeakPolarHBondContact O-CG 3.45Å; F344-M348 PolarHBondContact O-N 3.47Å; F344-F355 HydrophobicContact CD1-CE1 4.3Å; F344-F355 HydrophobicContact CD1-CZ 4.45Å; F344-F355 AromaticContact CE1-CE1 3.46Å; F344-F355 HydrophobicContact CE1-CE1 3.46Å; F344-F355 VanDerWaalsContact CE1-CE1 3.46Å; F344-F355 AromaticContact CE1-CZ 3.66Å; F344-F355 HydrophobicContact CE1-CZ 3.66Å; F344-F355 HydrophobicContact CE2-CE1 4.49Å; F344-F355 HydrophobicContact CZ-CD1 4.49Å; F344-F355 AromaticContact CZ-CE1 3.57Å; F344-F355 HydrophobicContact CZ-CE1 3.57Å; F344-F355 HydrophobicContact CZ-CZ 4.19Å
345	R	91.8	Very high	91.6	Very high	124 Å²	124	81.8 Å²	81.8	47%	0.468	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-27.6	177.3	-67.9	172.1	-163.5	131.2	10	113.1	Q341 H342 R349	Q341-R345 WeakPolarHBondContact O-CG 3.49Å; Q341-R345 PolarHBondContact O-N 3.12Å; H342-R345 CarbonylContact O-C 3.43Å; H342-R345 PolarHBondContact O-N 2.87Å; H342-R345 VanDerWaalsContact O-N 3.1Å; R345-R349 PolarHBondContact O-NH1 3.01Å
346	Q	91	Very high	91.8	Very high	121 Å²	121	78.2 Å²	78.2	57%	0.565	34%	0.339	S	S	*	.	H	α-helix	trans	-75.5	-44.6	174.2	-173.6	177.7	-3.7	0	0	110.6	H342 M343 F344 M348 R349	H342-Q346 PolarHBondContact O-N 2.77Å; M343-Q346 PolarHBondContact O-N 3.19Å; F344-Q346 VanDerWaalsContact C-N 3.26Å; F344-Q346 PolarHBondContact O-N 3.33Å; Q346-M348 PolarHBondContact O-N 3.22Å; Q346-R349 WeakPolarHBondContact O-CB 3.2Å; Q346-R349 PolarHBondContact O-N 3.12Å; Q346-R349 VanDerWaalsContact O-N 3.08Å
347	A	91.3	Very high	92	Very high	2 Å²	2	68.7 Å²	68.7	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-42.2	175.2	0	0	0	0	0	112.4	I327 M343 F344 R349 A350 I353	I327-A347 HydrophobicContact CG2-CB 3.63Å; M343-A347 WeakPolarHBondContact O-CB 3.35Å; M343-A347 PolarHBondContact O-N 3.46Å; F344-A347 PolarHBondContact O-N 2.83Å; A347-R349 PolarHBondContact O-N 3.2Å; A347-A350 WeakPolarHBondContact O-CB 3.47Å; A347-A350 PolarHBondContact O-N 2.93Å; A347-I353 HydrophobicContact CB-CD1 4.09Å; A347-I353 HydrophobicContact CB-CG1 4.13Å; A347-I353 HydrophobicContact CB-CG2 3.76Å; A347-I353 WeakPolarHBondContact O-CG1 3.46Å
348	M	88.9	Confident	92.2	Very high	70 Å²	70	65.1 Å²	65.1	35%	0.345	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	4.8	173.8	-66.5	-60.1	-59	0	0	114.9	N279 F344 Q346 I353	N279-M348 PolarHBondContact ND2-O 3.15Å; F344-M348 WeakPolarHBondContact O-CG 3.45Å; F344-M348 PolarHBondContact O-N 3.47Å; Q346-M348 PolarHBondContact O-N 3.22Å; M348-I353 HydrophobicContact CG-CD1 4.4Å; M348-I353 HydrophobicContact SD-CD1 3.57Å; M348-I353 VanDerWaalsContact SD-CD1 3.57Å
349	R	87.5	Confident	92.2	Very high	197 Å²	197	59.8 Å²	59.8	74%	0.743	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-11.6	167.8	-63.9	-179.7	174.9	94.3	-13.9	114	R345 Q346 A347	R345-R349 PolarHBondContact O-NH1 3.01Å; Q346-R349 WeakPolarHBondContact O-CB 3.2Å; Q346-R349 PolarHBondContact O-N 3.12Å; Q346-R349 VanDerWaalsContact O-N 3.08Å; A347-R349 PolarHBondContact O-N 3.2Å
350	A	89.1	Confident	92.2	Very high	34 Å²	34	57.5 Å²	57.5	28%	0.281	26%	0.261	S	S	.	.	S	Bend	trans	-79.5	154.4	171.4	0	0	0	0	0	110.1	N279 A347 V352	N279-A350 VanDerWaalsContact CB-O 3.26Å; N279-A350 WeakPolarHBondContact CB-O 3.24Å; N279-A350 PolarHBondContact ND2-O 2.9Å; A347-A350 WeakPolarHBondContact O-CB 3.47Å; A347-A350 PolarHBondContact O-N 2.93Å; A350-V352 VanDerWaalsContact C-N 3.28Å; A350-V352 WeakPolarHBondContact CB-O 3.48Å; A350-V352 PolarHBondContact O-N 3.14Å
351	R	90.8	Very high	92.1	Very high	228 Å²	228	61.6 Å²	61.6	86%	0.86	30%	0.295	S	S	*	.	S	Bend	trans	-70.2	-25.8	175.8	-68.5	-176.9	177.7	179.7	-1.4	113.3	N279	N279-R351 PolarHBondContact N-O 2.84Å
352	V	91.4	Very high	92	Very high	48 Å²	48	60.5 Å²	60.5	29%	0.291	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139	179.1	178.2	0	0	0	0	107.2	Q276 V277 A350 W354	Q276-V352 HydrophobicContact CG-CG1 3.47Å; Q276-V352 VanDerWaalsContact CG-CG1 3.47Å; V277-V352 WeakPolarHBondContact O-CA 3.21Å; A350-V352 VanDerWaalsContact C-N 3.28Å; A350-V352 WeakPolarHBondContact CB-O 3.48Å; A350-V352 PolarHBondContact O-N 3.14Å; V352-W354 HydrophobicContact CG1-CD2 4.49Å; V352-W354 HydrophobicContact CG1-CZ2 4.17Å
353	I	93.3	Very high	91.9	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.9	174.9	-51.5	174.2	0	0	0	108.7	V277 N279 I327 A347 M348 F355	V277-I353 HydrophobicContact CB-CB 4.45Å; V277-I353 PolarHBondContact N-O 2.72Å; V277-I353 PolarHBondContact O-N 3.39Å; N279-I353 HydrophobicContact CB-CD1 4.5Å; I327-I353 HydrophobicContact CG2-CG2 3.89Å; A347-I353 HydrophobicContact CB-CD1 4.09Å; A347-I353 HydrophobicContact CB-CG1 4.13Å; A347-I353 HydrophobicContact CB-CG2 3.76Å; A347-I353 WeakPolarHBondContact O-CG1 3.46Å; M348-I353 HydrophobicContact CG-CD1 4.4Å; M348-I353 HydrophobicContact SD-CD1 3.57Å; M348-I353 VanDerWaalsContact SD-CD1 3.57Å; I353-F355 HydrophobicContact CB-CD2 4.43Å; I353-F355 HydrophobicContact CB-CE2 3.8Å; I353-F355 HydrophobicContact CB-CZ 4.22Å; I353-F355 HydrophobicContact CD1-CZ 4.46Å; I353-F355 HydrophobicContact CG2-CD1 4.45Å; I353-F355 HydrophobicContact CG2-CD2 3.86Å; I353-F355 HydrophobicContact CG2-CE1 3.96Å; I353-F355 HydrophobicContact CG2-CE2 3.32Å; I353-F355 HydrophobicContact CG2-CG 4.42Å; I353-F355 HydrophobicContact CG2-CZ 3.39Å
354	W	94	Very high	91.6	Very high	99 Å²	99	65.7 Å²	65.7	38%	0.375	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111.2	178.4	-62.9	100.3	0	0	0	109.5	L274 Q276 N328 V352	L274-W354 HydrophobicContact CD1-CB 4.15Å; L274-W354 HydrophobicContact CD1-CE3 3.96Å; L274-W354 HydrophobicContact CD2-CE3 3.83Å; L274-W354 HydrophobicContact CD2-CZ3 3.96Å; L274-W354 HydrophobicContact CG-CE3 3.83Å; L274-W354 HydrophobicContact CG-CZ3 4.25Å; Q276-W354 HydrophobicContact CB-CE3 3.87Å; Q276-W354 HydrophobicContact CB-CH2 4.06Å; Q276-W354 HydrophobicContact CB-CZ3 3.55Å; Q276-W354 HydrophobicContact CG-CD2 4.4Å; Q276-W354 HydrophobicContact CG-CE3 4.02Å; Q276-W354 HydrophobicContact CG-CH2 3.67Å; Q276-W354 HydrophobicContact CG-CZ2 4.05Å; Q276-W354 HydrophobicContact CG-CZ3 3.66Å; Q276-W354 VanDerWaalsContact OE1-CH2 3.3Å; N328-W354 PolarHBondContact N-O 2.73Å; N328-W354 PolarHBondContact OD1-N 2.83Å; V352-W354 HydrophobicContact CG1-CD2 4.49Å; V352-W354 HydrophobicContact CG1-CZ2 4.17Å
355	F	95.2	Very high	91.3	Very high	0 Å²	0	69 Å²	69	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.5	175.6	-63.9	-82.8	0	0	0	109.9	V275 V277 L284 F318 I324 I327 F344 I353 V357	V275-F355 HydrophobicContact CB-CB 4.34Å; V275-F355 PolarHBondContact N-O 3.5Å; V275-F355 PolarHBondContact O-N 2.94Å; V277-F355 HydrophobicContact CB-CD2 4.37Å; V277-F355 HydrophobicContact CB-CE2 4.08Å; V277-F355 HydrophobicContact CG2-CD2 3.64Å; V277-F355 HydrophobicContact CG2-CE2 3.69Å; L284-F355 HydrophobicContact CD2-CE2 4.13Å; L284-F355 HydrophobicContact CD2-CZ 3.97Å; F318-F355 HydrophobicContact CE1-CB 4.03Å; F318-F355 HydrophobicContact CE1-CD1 4.5Å; F318-F355 HydrophobicContact CE1-CD2 4.33Å; F318-F355 HydrophobicContact CE1-CG 4.05Å; F318-F355 HydrophobicContact CZ-CB 4.14Å; F318-F355 HydrophobicContact CZ-CD1 4.25Å; F318-F355 AromaticContact CZ-CD2 3.59Å; F318-F355 HydrophobicContact CZ-CD2 3.59Å; F318-F355 AromaticContact CZ-CE2 3.94Å; F318-F355 HydrophobicContact CZ-CE2 3.94Å; F318-F355 AromaticContact CZ-CG 3.73Å; F318-F355 HydrophobicContact CZ-CG 3.73Å; F318-F355 HydrophobicContact CZ-CZ 4.41Å; I324-F355 HydrophobicContact CD1-CD1 4.14Å; I324-F355 HydrophobicContact CD1-CE1 4.47Å; I324-F355 HydrophobicContact CG2-CB 4.43Å; I324-F355 HydrophobicContact CG2-CD1 3.83Å; I327-F355 HydrophobicContact CD1-CE1 4.21Å; I327-F355 HydrophobicContact CG1-CD1 4.03Å; I327-F355 HydrophobicContact CG1-CE1 4.11Å; I327-F355 HydrophobicContact CG2-CD1 4.12Å; I327-F355 HydrophobicContact CG2-CE1 3.84Å; F344-F355 HydrophobicContact CD1-CE1 4.3Å; F344-F355 HydrophobicContact CD1-CZ 4.45Å; F344-F355 AromaticContact CE1-CE1 3.46Å; F344-F355 HydrophobicContact CE1-CE1 3.46Å; F344-F355 VanDerWaalsContact CE1-CE1 3.46Å; F344-F355 AromaticContact CE1-CZ 3.66Å; F344-F355 HydrophobicContact CE1-CZ 3.66Å; F344-F355 HydrophobicContact CE2-CE1 4.49Å; F344-F355 HydrophobicContact CZ-CD1 4.49Å; F344-F355 AromaticContact CZ-CE1 3.57Å; F344-F355 HydrophobicContact CZ-CE1 3.57Å; F344-F355 HydrophobicContact CZ-CZ 4.19Å; I353-F355 HydrophobicContact CB-CD2 4.43Å; I353-F355 HydrophobicContact CB-CE2 3.8Å; I353-F355 HydrophobicContact CB-CZ 4.22Å; I353-F355 HydrophobicContact CD1-CZ 4.46Å; I353-F355 HydrophobicContact CG2-CD1 4.45Å; I353-F355 HydrophobicContact CG2-CD2 3.86Å; I353-F355 HydrophobicContact CG2-CE1 3.96Å; I353-F355 HydrophobicContact CG2-CE2 3.32Å; I353-F355 HydrophobicContact CG2-CG 4.42Å; I353-F355 HydrophobicContact CG2-CZ 3.39Å; F355-V357 HydrophobicContact CB-CG2 3.74Å
356	H	94.4	Very high	91.3	Very high	31 Å²	31	63.2 Å²	63.2	14%	0.144	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110.4	167.7	-70.9	80	0	0	0	107.1	V272 V325 R326	V272-H356 HydrophobicContact CG1-CB 3.6Å; V325-H356 HydrophobicContact CG2-CB 4.08Å; V325-H356 WeakPolarHBondContact CG2-O 3.49Å; V325-H356 PolarHBondContact N-O 3.46Å; R326-H356 HydrophobicContact CB-CB 3.76Å; R326-H356 HydrophobicContact CG-CB 4.1Å; R326-H356 PolarHBondContact N-O 3.47Å; R326-H356 PolarHBondContact NH1-CD2 2.95Å; R326-H356 VanDerWaalsContact NH1-CD2 3.29Å; R326-H356 PolarHBondContact NH1-CE1 2.9Å; R326-H356 PolarHBondContact NH1-NE2 3.47Å; R326-H356 PolarHBondContact NH2-CD2 3.37Å; R326-H356 VanDerWaalsContact NH2-CD2 3.29Å; R326-H356 PolarHBondContact O-N 2.79Å
357	V	94.9	Very high	91.2	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121	-169.2	-172	0	0	0	0	109.8	K273 V275 F318 D322 I324 F355 P359	K273-V357 PolarHBondContact N-O 2.87Å; K273-V357 PolarHBondContact O-N 3.48Å; V275-V357 HydrophobicContact CB-CG2 4.37Å; V275-V357 HydrophobicContact CG2-CB 4.43Å; V275-V357 HydrophobicContact CG2-CG2 3.94Å; F318-V357 HydrophobicContact CD1-CG2 4.08Å; F318-V357 HydrophobicContact CE1-CG2 3.76Å; D322-V357 HydrophobicContact CB-CG1 3.71Å; I324-V357 HydrophobicContact CG1-CG2 4.41Å; F355-V357 HydrophobicContact CB-CG2 3.74Å; V357-P359 WeakPolarHBondContact O-CD 3.08Å
358	V	94.6	Very high	90.9	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	117.5	163	175.7	0	0	0	0	107.2	M271 V272 C323 V325 N362 Y366	M271-V358 HydrophobicContact CG-CG1 4.43Å; V272-V358 HydrophobicContact CG2-CG2 3.67Å; C323-V358 HydrophobicContact CB-CB 4.3Å; C323-V358 PolarHBondContact N-O 3.1Å; C323-V358 PolarHBondContact O-N 3.47Å; V325-V358 HydrophobicContact CG1-CG2 3.84Å; V325-V358 HydrophobicContact CG2-CG2 4.31Å; V358-N362 HydrophobicContact CG1-CB 3.75Å; V358-Y366 HydrophobicContact CB-CD1 4.43Å; V358-Y366 HydrophobicContact CG1-CD1 4.4Å; V358-Y366 HydrophobicContact CG1-CG 4.24Å; V358-Y366 HydrophobicContact CG2-CD1 4.04Å; V358-Y366 HydrophobicContact CG2-CD2 4.22Å; V358-Y366 HydrophobicContact CG2-CE1 4.49Å; V358-Y366 HydrophobicContact CG2-CG 3.91Å
359	P	93.7	Very high	90.8	Very high	36 Å²	36	64.1 Å²	64.1	23%	0.234	31%	0.314	C	S	.	.			trans	-62.5	152.9	178.6	-22.2	34.5	0	0	0	111.9	M271 K273 D322 V357 A361 N362 K363	M271-P359 WeakPolarHBondContact O-CD 3.42Å; K273-P359 HydrophobicContact CB-CG 4.21Å; D322-P359 VanDerWaalsContact OD1-CA 3.32Å; D322-P359 WeakPolarHBondContact OD1-CA 3.34Å; V357-P359 WeakPolarHBondContact O-CD 3.08Å; P359-A361 PolarHBondContact O-N 2.79Å; P359-A361 VanDerWaalsContact O-N 3.07Å; P359-N362 PolarHBondContact O-N 2.99Å; P359-K363 PolarHBondContact O-N 2.86Å
360	A	91.2	Very high	90.5	Very high	38 Å²	38	54.9 Å²	54.9	31%	0.314	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-50	-38	-178.8	0	0	0	0	0	113.8	N321 D322 N362 K363	N321-A360 HydrophobicContact CB-CB 4.12Å; D322-A360 PolarHBondContact OD1-N 2.88Å; A360-N362 VanDerWaalsContact C-N 3.31Å; A360-N362 PolarHBondContact O-N 2.86Å; A360-K363 WeakPolarHBondContact O-CB 3.44Å; A360-K363 PolarHBondContact O-N 3.33Å
361	A	90.7	Very high	89.8	Confident	90 Å²	90	57.6 Å²	57.6	74%	0.744	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-63.5	-31.3	176.8	0	0	0	0	0	114	P359	P359-A361 PolarHBondContact O-N 2.79Å; P359-A361 VanDerWaalsContact O-N 3.07Å
362	N	91.2	Very high	88.7	Confident	47 Å²	47	55.2 Å²	55.2	25%	0.251	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-92.2	-4.3	-178.5	-64.3	5.1	0	0	0	112.3	M271 V358 P359 A360 E364 Q365 Y366	M271-N362 HydrophobicContact CG-CB 3.7Å; M271-N362 PolarHBondContact O-ND2 2.76Å; M271-N362 HydrophobicContact SD-CB 4.31Å; V358-N362 HydrophobicContact CG1-CB 3.75Å; P359-N362 PolarHBondContact O-N 2.99Å; A360-N362 VanDerWaalsContact C-N 3.31Å; A360-N362 PolarHBondContact O-N 2.86Å; N362-E364 VanDerWaalsContact C-N 3.28Å; N362-E364 PolarHBondContact O-N 2.9Å; N362-Q365 PolarHBondContact O-N 2.91Å; N362-Y366 PolarHBondContact O-N 2.72Å
363	K	89.2	Confident	87.6	Confident	44 Å²	44	56.3 Å²	56.3	19%	0.191	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-39.3	-172.9	-179	-169.1	158.7	-65.1	0	113	F291 L302 P359 A360 E367	F291-K363 HydrophobicContact CE1-CG 4.25Å; F291-K363 HydrophobicContact CZ-CD 4.44Å; F291-K363 HydrophobicContact CZ-CG 4.08Å; L302-K363 HydrophobicContact CD1-CD 4.12Å; P359-K363 PolarHBondContact O-N 2.86Å; A360-K363 WeakPolarHBondContact O-CB 3.44Å; A360-K363 PolarHBondContact O-N 3.33Å; K363-E367 IonicContact NZ-OE2 2.94Å; K363-E367 PolarHBondContact O-N 3.2Å
364	E	86.5	Confident	85.7	Confident	138 Å²	138	61.8 Å²	61.8	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-72.3	-42.3	-179.2	-62.2	-171.4	172.6	0	0	112.1	N362 Y366 E367 Q368	N362-E364 VanDerWaalsContact C-N 3.28Å; N362-E364 PolarHBondContact O-N 2.9Å; E364-Y366 VanDerWaalsContact C-N 3.28Å; E364-Y366 PolarHBondContact O-N 3.09Å; E364-E367 PolarHBondContact O-N 2.89Å; E364-Q368 WeakPolarHBondContact O-CG 3.42Å; E364-Q368 PolarHBondContact O-N 2.87Å
365	Q	87.2	Confident	83.3	Confident	99 Å²	99	63.2 Å²	63.2	46%	0.463	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-41.6	173.2	-65.7	177.1	-20.9	0	0	110.8	M271 N362 Q368 L369	M271-Q365 HydrophobicContact SD-CB 3.89Å; N362-Q365 PolarHBondContact O-N 2.91Å; Q365-Q368 PolarHBondContact O-N 3.36Å; Q365-L369 WeakPolarHBondContact O-CB 3.48Å; Q365-L369 WeakPolarHBondContact O-CG 3.5Å; Q365-L369 PolarHBondContact O-N 3Å
366	Y	91.5	Very high	80.7	Confident	3 Å²	3	70.1 Å²	70.1	1%	0.012	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-42.8	175.5	175.7	-124.7	0	0	0	113.3	L268 M271 F291 L299 V325 R333 V358 N362 E364 Q368 L369 S370	L268-Y366 HydrophobicContact CD1-CD2 3.61Å; L268-Y366 HydrophobicContact CD1-CE2 3.49Å; L268-Y366 VanDerWaalsContact CD1-CE2 3.49Å; M271-Y366 HydrophobicContact CE-CD2 3.74Å; M271-Y366 HydrophobicContact CE-CG 4.16Å; F291-Y366 HydrophobicContact CE1-CD1 4.28Å; F291-Y366 HydrophobicContact CE1-CE1 4.45Å; L299-Y366 HydrophobicContact CB-CE1 3.93Å; L299-Y366 PolarHBondContact O-OH 2.78Å; V325-Y366 HydrophobicContact CG1-CD1 4.36Å; V325-Y366 HydrophobicContact CG1-CE1 3.53Å; V325-Y366 HydrophobicContact CG1-CE2 4.25Å; V325-Y366 VanDerWaalsContact CG1-CZ 3.47Å; V325-Y366 WeakPolarHBondContact CG1-OH 3.44Å; R333-Y366 VanDerWaalsContact CD-OH 3.31Å; R333-Y366 WeakPolarHBondContact CD-OH 3.35Å; R333-Y366 WeakPolarHBondContact CG-OH 3.3Å; V358-Y366 HydrophobicContact CB-CD1 4.43Å; V358-Y366 HydrophobicContact CG1-CD1 4.4Å; V358-Y366 HydrophobicContact CG1-CG 4.24Å; V358-Y366 HydrophobicContact CG2-CD1 4.04Å; V358-Y366 HydrophobicContact CG2-CD2 4.22Å; V358-Y366 HydrophobicContact CG2-CE1 4.49Å; V358-Y366 HydrophobicContact CG2-CG 3.91Å; N362-Y366 PolarHBondContact O-N 2.72Å; E364-Y366 VanDerWaalsContact C-N 3.28Å; E364-Y366 PolarHBondContact O-N 3.09Å; Y366-Q368 VanDerWaalsContact C-N 3.33Å; Y366-Q368 PolarHBondContact O-N 3.49Å; Y366-L369 PolarHBondContact O-N 3.42Å; Y366-S370 PolarHBondContact O-N 3.21Å
367	E	89.2	Confident	77.6	Confident	42 Å²	42	77.9 Å²	77.9	20%	0.196	38%	0.384	C	S	.	.	H	α-helix	trans	-64.5	-37	175.7	-178.8	162.2	-171.4	0	0	111.8	F291 L299 K363 E364 Q371	F291-E367 HydrophobicContact CZ-CB 4.22Å; F291-E367 HydrophobicContact CZ-CG 4.49Å; F291-E367 WeakPolarHBondContact CZ-OE2 3.42Å; L299-E367 HydrophobicContact CD1-CB 4.23Å; L299-E367 HydrophobicContact CD1-CG 4.11Å; K363-E367 IonicContact NZ-OE2 2.94Å; K363-E367 PolarHBondContact O-N 3.2Å; E364-E367 PolarHBondContact O-N 2.89Å; E367-Q371 WeakPolarHBondContact O-CB 3.47Å; E367-Q371 VanDerWaalsContact O-CG 3.25Å; E367-Q371 WeakPolarHBondContact O-CG 3.44Å; E367-Q371 PolarHBondContact O-N 3.29Å; E367-Q371 PolarHBondContact O-NE2 3.06Å
368	Q	84.8	Confident	74.5	Confident	112 Å²	112	82.7 Å²	82.7	52%	0.523	42%	0.418	S	S	.	.	H	α-helix	trans	-68.2	-43.4	172.8	-68.8	176.4	39.4	0	0	112.6	E364 Q365 Y366 Q371 R372	E364-Q368 WeakPolarHBondContact O-CG 3.42Å; E364-Q368 PolarHBondContact O-N 2.87Å; Q365-Q368 PolarHBondContact O-N 3.36Å; Y366-Q368 VanDerWaalsContact C-N 3.33Å; Y366-Q368 PolarHBondContact O-N 3.49Å; Q368-Q371 WeakPolarHBondContact O-CB 3.31Å; Q368-Q371 PolarHBondContact O-N 2.72Å; Q368-R372 PolarHBondContact O-N 3.03Å
369	L	85.8	Confident	71.4	Confident	59 Å²	59	89.2 Å²	89.2	31%	0.309	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-45.5	179.8	-80.9	164.3	0	0	0	111.7	M271 Q365 Y366 Q371 R372 E373	M271-L369 HydrophobicContact CE-CD1 3.49Å; M271-L369 VanDerWaalsContact CE-CD1 3.49Å; M271-L369 HydrophobicContact SD-CD1 3.87Å; Q365-L369 WeakPolarHBondContact O-CB 3.48Å; Q365-L369 WeakPolarHBondContact O-CG 3.5Å; Q365-L369 PolarHBondContact O-N 3Å; Y366-L369 PolarHBondContact O-N 3.42Å; L369-Q371 VanDerWaalsContact C-N 3.28Å; L369-Q371 PolarHBondContact O-N 3.33Å; L369-R372 PolarHBondContact O-N 3.49Å; L369-R372 VanDerWaalsContact O-N 3.15Å; L369-E373 WeakPolarHBondContact O-CB 3.42Å; L369-E373 PolarHBondContact O-N 3.46Å
370	S	82.3	Confident	68.4	Low	3 Å²	3	90.8 Å²	90.8	2%	0.021	48%	0.482	C	S	.	.	H	α-helix	trans	-73.3	-19.3	176.4	-163.4	0	0	0	0	113.1	R297 L299 Y366 E373	R297-S370 PolarHBondContact NH2-O 3.48Å; L299-S370 WeakPolarHBondContact CD2-OG 3.48Å; Y366-S370 PolarHBondContact O-N 3.21Å; S370-E373 PolarHBondContact OG-OE2 3.21Å
371	Q	73.7	Confident	65.4	Low	90 Å²	90	99.9 Å²	99.9	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-68.3	-46.4	164.2	-77	178	61.4	0	0	111.6	E367 Q368 L369 E373 K374	E367-Q371 WeakPolarHBondContact O-CB 3.47Å; E367-Q371 VanDerWaalsContact O-CG 3.25Å; E367-Q371 WeakPolarHBondContact O-CG 3.44Å; E367-Q371 PolarHBondContact O-N 3.29Å; E367-Q371 PolarHBondContact O-NE2 3.06Å; Q368-Q371 WeakPolarHBondContact O-CB 3.31Å; Q368-Q371 PolarHBondContact O-N 2.72Å; L369-Q371 VanDerWaalsContact C-N 3.28Å; L369-Q371 PolarHBondContact O-N 3.33Å; Q371-E373 VanDerWaalsContact C-N 3.32Å; Q371-E373 PolarHBondContact O-N 2.86Å; Q371-K374 WeakPolarHBondContact O-CB 3.44Å; Q371-K374 PolarHBondContact O-N 2.73Å
372	R	69.1	Low	62.6	Low	178 Å²	178	105.4 Å²	105.4	67%	0.672	52%	0.516	S	S	*	.	H	α-helix	trans	-60.9	-38.4	174.6	-73.5	-178.3	172.1	-174.6	-1.8	112.7	Q368 L369 K374 N375	Q368-R372 PolarHBondContact O-N 3.03Å; L369-R372 PolarHBondContact O-N 3.49Å; L369-R372 VanDerWaalsContact O-N 3.15Å; R372-K374 PolarHBondContact O-N 3.25Å; R372-N375 PolarHBondContact O-N 3.08Å
373	E	68.2	Low	59.6	Low	72 Å²	72	107.9 Å²	107.9	34%	0.336	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.4	172.3	-164.9	-179.4	-151.4	0	0	112.7	R333 L369 S370 Q371 Y377	R333-E373 IonicContact CZ-OE1 3.93Å; R333-E373 IonicContact NH1-OE1 2.77Å; R333-E373 PolarHBondContact NH1-OE1 3.12Å; R333-E373 IonicContact NH1-OE2 3.46Å; R333-E373 PolarHBondContact NH1-OE2 3.06Å; L369-E373 WeakPolarHBondContact O-CB 3.42Å; L369-E373 PolarHBondContact O-N 3.46Å; S370-E373 PolarHBondContact OG-OE2 3.21Å; Q371-E373 VanDerWaalsContact C-N 3.32Å; Q371-E373 PolarHBondContact O-N 2.86Å; E373-Y377 WeakPolarHBondContact O-CD2 3.47Å
374	K	51.7	Low	56.9	Low	115 Å²	115	110.6 Å²	110.6	50%	0.5	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-24.4	175.8	-156.2	180	-179.6	-172.4	0	114.1	Q371 R372	Q371-K374 WeakPolarHBondContact O-CB 3.44Å; Q371-K374 PolarHBondContact O-N 2.73Å; R372-K374 PolarHBondContact O-N 3.25Å
375	N	43.4	Very low	54.1	Low	129 Å²	129	111.2 Å²	111.2	69%	0.69	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-20.3	-176.2	-77.9	11.9	0	0	0	113.4	R372 Y377	R372-N375 PolarHBondContact O-N 3.08Å; N375-Y377 VanDerWaalsContact C-N 3.32Å; N375-Y377 PolarHBondContact O-N 3.22Å
376	N	42	Very low	51.7	Low	145 Å²	145	112.3 Å²	112.3	78%	0.775	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	4.7	-178.2	-72	7.1	0	0	0	114.5
377	Y	29.7	Very low	48.7	Very low	195 Å²	195	120.7 Å²	120.7	77%	0.765	63%	0.625	S	S	*	*			trans	-105.7	52.9	176.9	-77.2	-75.9	0	0	0	113.2	E373 N375	E373-Y377 WeakPolarHBondContact O-CD2 3.47Å; N375-Y377 VanDerWaalsContact C-N 3.32Å; N375-Y377 PolarHBondContact O-N 3.22Å
378	S	28.1	Very low	45.9	Very low	101 Å²	101	124.4 Å²	124.4	71%	0.706	65%	0.654	S	S	*	*			trans	-85.9	125.3	162.8	-68.5	0	0	0	0	109.9	G380	S378-G380 PolarHBondContact O-N 2.97Å
379	P	29.9	Very low	43.4	Very low	138 Å²	138	125.8 Å²	125.8	90%	0.896	67%	0.67	S	S	*	*			trans	-77.1	62.5	177.7	31.9	-35.1	0	0	0	112	R381	P379-R381 PolarHBondContact O-N 2.99Å
380	G	31.7	Very low	40.6	Very low	68 Å²	68	126.8 Å²	126.8	70%	0.701	69%	0.687	S	S	*	*			trans	-82.7	96	-174.5	0	0	0	0	0	113.7	S378 F382	S378-G380 PolarHBondContact O-N 2.97Å; G380-F382 PolarHBondContact O-N 3.2Å
381	R	28.8	Very low	38.2	Very low	230 Å²	230	133.4 Å²	133.4	87%	0.868	72%	0.722	S	S	*	*			trans	-78.9	95.1	-175.8	-179.6	-156.2	-61.2	-148.5	-3.9	113.8	P379	P379-R381 PolarHBondContact O-N 2.99Å
382	F	31	Very low	36.2	Very low	205 Å²	205	140.1 Å²	140.1	90%	0.899	74%	0.743	S	S	*	*			trans	-158.7	145	157.8	-71.2	-76.2	0	0	0	108.7	G380	G380-F382 PolarHBondContact O-N 3.2Å
383	S	28.5	Very low	34.4	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	75%	0.745	S	S	*	*			cis	-156.2	139.6	-21.6	-169.7	0	0	0	0	107.9
384	P	31.6	Very low	32.9	Very low	102 Å²	102	139.4 Å²	139.4	66%	0.662	77%	0.767	S	S	*	*			trans	-80.5	154.1	170.3	33.7	-33.4	0	0	0	111.9
385	D	28.2	Very low	32.1	Very low	150 Å²	150	137 Å²	137	80%	0.802	77%	0.769	S	S	*	*			trans	48.7	111.6	158.9	-49.5	-35	0	0	0	119.8
386	S	36.2	Very low	31.7	Very low	123 Å²	123	137.5 Å²	137.5	86%	0.86	77%	0.772	S	S	*	*			trans	-160.3	146.3	164.3	-74.4	0	0	0	0	110.7
387	H	30	Very low	31.4	Very low	178 Å²	178	137.5 Å²	137.5	82%	0.824	77%	0.772	S	S	*	*			trans	-104.3	150.7	-164.8	-67.6	-99	0	0	0	115.9
388	C	28.3	Very low	31.6	Very low	120 Å²	120	132.2 Å²	132.2	81%	0.811	77%	0.768	S	S	*	*			trans	30.4	104	144.3	-59.2	0	0	0	0	121.5
389	V	33.3	Very low	32.1	Very low	141 Å²	141	132.5 Å²	132.5	86%	0.855	77%	0.768	S	S	*	*			trans	-154.5	123.5	135.2	-94.9	0	0	0	0	107
390	A	27.3	Very low	32.3	Very low	80 Å²	80	134.6 Å²	134.6	66%	0.661	77%	0.766	S	S	*	*			cis	85.5	93.7	39.9	0	0	0	0	0	114.9
391	N	30.9	Very low	32.2	Very low	142 Å²	142	135.6 Å²	135.6	76%	0.759	77%	0.767	S	S	*	*				170.6	141.9	120.3	-96.7	-66.6	0	0	0	114.5
392	R	32.8	Very low	32.5	Very low	231 Å²	231	132.4 Å²	132.4	87%	0.872	77%	0.766	S	S	*	*			trans	40.7	147.6	142.2	-68.5	178.1	163.8	-153.8	-5.2	120.6
393	S	31.4	Very low	32.8	Very low	100 Å²	100	127.8 Å²	127.8	70%	0.699	76%	0.757	S	S	*	*			cis	-154.8	161.6	11.6	-153.2	0	0	0	0	107.1
394	V	36.5	Very low	32.7	Very low	135 Å²	135	134.4 Å²	134.4	82%	0.818	77%	0.767	S	S	*	*				-169.5	148.1	53.3	169	0	0	0	0	106
395	A	35.1	Very low	32.9	Very low	64 Å²	64	133.9 Å²	133.9	53%	0.529	77%	0.771	S	S	.	*			cis	-169.4	175.9	-22.7	0	0	0	0	0	108.5
396	N	35	Very low	33	Very low	140 Å²	140	133 Å²	133	75%	0.749	77%	0.773	S	S	*	*			trans	71.9	148.3	169.7	-50.2	-31.1	0	0	0	116.1
397	N	34.7	Very low	32.7	Very low	145 Å²	145	138 Å²	138	78%	0.775	77%	0.773	S	S	*	*			cis	-173.7	153.8	-23	-101.3	-16.1	0	0	0	106.2
398	A	33.7	Very low	32.5	Very low	84 Å²	84	137.4 Å²	137.4	69%	0.694	78%	0.776	S	S	*	*			cis	-156.3	-163.9	-15.5	0	0	0	0	0	107
399	P	38.8	Very low	32.4	Very low	107 Å²	107	136.7 Å²	136.7	70%	0.695	77%	0.772	S	S	*	*			trans	-127.2	-159.8	-133	29.7	-3.7	0	0	0	114.8
400	Q	33.8	Very low	32.5	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	77%	0.771	S	S	*	*			trans	84.6	145.6	162.3	-53.7	179.4	16.2	0	0	116.7
401	A	29.7	Very low	33	Very low	88 Å²	88	140.4 Å²	140.4	73%	0.727	78%	0.776	S	S	*	*			cis	-162.5	161.7	-20.2	0	0	0	0	0	112.5
402	L	36	Very low	33.2	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	77%	0.774	S	S	*	*			trans	-9.9	162.5	145.5	-65	171.9	0	0	0	119.3
403	P	37.1	Very low	33.1	Very low	108 Å²	108	135.2 Å²	135.2	70%	0.701	77%	0.767	S	S	*	*			cis	-141.1	-165.5	-13.1	32.9	-9.8	0	0	0	114.8
404	R	25.7	Very low	33.1	Very low	239 Å²	239	139.3 Å²	139.3	90%	0.902	78%	0.775	S	S	*	*			trans	89.5	135.6	144.3	-139.7	175	-157.4	144.4	3.2	117.4
405	A	36.1	Very low	32.8	Very low	91 Å²	91	138.8 Å²	138.8	75%	0.752	77%	0.767	S	S	*	*			trans	-84.9	163.8	178.3	0	0	0	0	0	113.1
406	P	31.2	Very low	32.4	Very low	130 Å²	130	142.9 Å²	142.9	84%	0.844	78%	0.78	S	S	*	*				-126.2	-180	123.3	38.2	-32.4	0	0	0	113.5
407	R	30.5	Very low	32	Very low	228 Å²	228	139.9 Å²	139.9	86%	0.86	78%	0.775	S	S	*	*			trans	-94.2	178.9	176.7	-61	173.4	167.8	178.7	-5.9	111.2
408	L	24.7	Very low	32.2	Very low	167 Å²	167	142.1 Å²	142.1	87%	0.874	78%	0.78	S	S	*	*			trans	76.8	146.8	164.1	-57.3	157.4	0	0	0	113.6
409	S	25.8	Very low	32.2	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	78%	0.782	S	S	*	*			cis	-155.9	167	-0.7	35.9	0	0	0	0	111.2
410	Q	36.6	Very low	31.6	Very low	180 Å²	180	149 Å²	149	84%	0.841	79%	0.789	S	S	*	*			trans	-60.8	161.2	164.3	-68.2	171.6	-42.4	0	0	111.7
411	P	36.7	Very low	31.9	Very low	118 Å²	118	146.9 Å²	146.9	77%	0.766	78%	0.783	S	S	*	*				-143	168.3	117.4	40.7	-29.6	0	0	0	113.6
412	P	36.2	Very low	32.3	Very low	111 Å²	111	148.1 Å²	148.1	72%	0.721	78%	0.783	S	S	*	*			cis	-134	-176.2	-47	39.4	-24.5	0	0	0	112.1
413	E	30.3	Very low	32.1	Very low	154 Å²	154	148 Å²	148	72%	0.72	78%	0.778	S	S	*	*			trans	-66	152.9	172.9	-48.9	117.6	91.7	0	0	113.7	L415	E413-L415 HydrophobicContact CB-CD1 3.9Å
414	Q	31.9	Very low	31.9	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	78%	0.78	S	S	*	*				-152.7	103.5	121.7	-104.1	173.5	7.1	0	0	107.6
415	L	29.8	Very low	32.3	Very low	124 Å²	124	139.4 Å²	139.4	65%	0.649	76%	0.761	S	S	*	*				75.5	101.7	87.8	-95.1	88.6	0	0	0	114.4	E413	E413-L415 HydrophobicContact CB-CD1 3.9Å
416	D	25.6	Very low	32.2	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	77%	0.766	S	S	*	*				85.5	157.5	119	-104.6	-60.3	0	0	0	124.1
417	A	28.2	Very low	32.3	Very low	78 Å²	78	142 Å²	142	65%	0.645	76%	0.761	S	S	*	*			trans	60	111.5	154.3	0	0	0	0	0	120.8	P419	A417-P419 WeakPolarHBondContact O-CD 3.33Å
418	H	37.9	Very low	32.4	Very low	191 Å²	191	135.6 Å²	135.6	88%	0.884	75%	0.752	S	S	*	*			trans	-51.4	138.7	150.7	-49.9	-82.8	0	0	0	112.4
419	P	32.7	Very low	32.6	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	75%	0.745	S	S	*	*				-128	129.6	118.4	4.9	16.4	0	0	0	110.8	A417	A417-P419 WeakPolarHBondContact O-CD 3.33Å
420	R	27.5	Very low	32.9	Very low	225 Å²	225	138 Å²	138	85%	0.849	75%	0.752	S	S	*	*				58.4	107.2	79.3	-71	-164.7	177.4	-149.5	2.4	115.2
421	L	40.4	Very low	33.5	Very low	137 Å²	137	134.9 Å²	134.9	72%	0.717	75%	0.748	S	S	*	*			trans	45.2	133.1	133.2	-64.1	167	0	0	0	119.3
422	P	37.7	Very low	33.5	Very low	114 Å²	114	135 Å²	135	74%	0.74	75%	0.748	S	S	*	*				-113.5	141.3	84.2	-8.3	28.3	0	0	0	112.6
423	H	32.1	Very low	33.1	Very low	160 Å²	160	134.5 Å²	134.5	74%	0.741	75%	0.753	S	S	*	*				56.2	133.5	89.8	-59.9	-41.8	0	0	0	113
424	S	32	Very low	33.4	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	75%	0.754	S	S	*	*			cis	173.3	175.2	2.7	-150.6	0	0	0	0	103.5
425	A	34.6	Very low	33.7	Very low	61 Å²	61	128.2 Å²	128.2	50%	0.504	75%	0.749	S	S	.	*			cis	-156.8	149.8	8.4	0	0	0	0	0	110.6
426	H	34.4	Very low	33.7	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.856	75%	0.751	S	S	*	*			trans	64.4	161.9	153.2	-56.3	-44.6	0	0	0	117.6
427	A	33.2	Very low	34	Very low	89 Å²	89	127 Å²	127	74%	0.736	75%	0.754	S	S	*	*			cis	-175.4	158	-26.5	0	0	0	0	0	106.4
428	S	33	Very low	34.4	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	76%	0.756	S	S	*	*			cis	-169.8	165.9	-15.6	169.4	0	0	0	0	107.9
429	T	28.7	Very low	34.9	Very low	121 Å²	121	123.8 Å²	123.8	74%	0.742	75%	0.751	S	S	*	*			trans	53.6	102.6	152	36.5	0	0	0	0	120.9
430	K	30.7	Very low	35.6	Very low	200 Å²	200	123.5 Å²	123.5	87%	0.87	75%	0.749	S	S	*	*				56	150.4	122.6	-84.1	-173.2	172.2	-179.3	0	122.1
431	P	51.1	Low	35.8	Very low	116 Å²	116	117.8 Å²	117.8	75%	0.753	74%	0.743	S	S	*	*			trans	-83.9	167.7	-176.3	38.5	-39	0	0	0	112.9
432	P	35.9	Very low	35.6	Very low	120 Å²	120	117 Å²	117	78%	0.779	74%	0.744	S	S	*	*				-147.9	171.6	102.1	41.1	-26.9	0	0	0	115.9
433	A	26.7	Very low	35.7	Very low	100 Å²	100	118.7 Å²	118.7	83%	0.826	75%	0.746	S	S	*	*			trans	51.7	144.1	143.9	0	0	0	0	0	123.3
434	A	38.2	Very low	35.9	Very low	89 Å²	89	115.6 Å²	115.6	74%	0.736	74%	0.742	S	S	*	*			trans	-70.1	174.4	159.7	0	0	0	0	0	110.9
435	P	38.2	Very low	36.2	Very low	119 Å²	119	116.6 Å²	116.6	77%	0.773	74%	0.744	S	S	*	*			cis	-150.4	-176	21.9	45.3	-24.7	0	0	0	118.9
436	A	30.1	Very low	36.4	Very low	82 Å²	82	119.6 Å²	119.6	68%	0.678	75%	0.752	S	S	*	*			trans	76.5	137.9	137.9	0	0	0	0	0	123.7
437	L	31.7	Very low	36.8	Very low	166 Å²	166	117 Å²	117	87%	0.869	75%	0.748	S	S	*	*			trans	79.5	90.9	142.7	-70.3	162.5	0	0	0	123
438	A	36.6	Very low	36.9	Very low	83 Å²	83	115.8 Å²	115.8	69%	0.686	75%	0.745	S	S	*	*				82.4	-174.4	117.6	0	0	0	0	0	118.9
439	P	48.2	Very low	37.1	Very low	119 Å²	119	116 Å²	116	77%	0.773	75%	0.747	S	S	*	*				-127.5	-155.9	-111	41.7	-19.8	0	0	0	111.7
440	P	46.1	Very low	37.2	Very low	105 Å²	105	116.4 Å²	116.4	68%	0.682	75%	0.748	S	S	*	*			cis	-140.4	176.4	-2.6	43.5	-25.8	0	0	0	118.2
441	S	32.2	Very low	37.4	Very low	105 Å²	105	116.5 Å²	116.5	73%	0.734	75%	0.745	S	S	*	*			trans	70.1	161.6	150.7	74.3	0	0	0	0	118.9
442	V	37.4	Very low	36.3	Very low	121 Å²	121	117.1 Å²	117.1	73%	0.733	74%	0.742	S	S	*	*			cis	-139	145.6	5.2	-139.7	0	0	0	0	112.2
443	L	38.2	Very low	36.2	Very low	150 Å²	150	117.4 Å²	117.4	79%	0.785	74%	0.741	S	S	*	*			trans	19.2	119.9	149.6	-65.8	171.4	0	0	0	120.1
444	S	36.3	Very low	36.5	Very low	95 Å²	95	120.7 Å²	120.7	66%	0.664	74%	0.737	S	S	*	*				81.2	153.8	77.4	-65.9	0	0	0	0	114.6
445	T	39.5	Very low	37	Very low	128 Å²	128	126 Å²	126	79%	0.785	74%	0.743	S	S	*	*			cis	-137.2	149.5	28.7	50.2	0	0	0	0	110.5
446	N	37.7	Very low	37.6	Very low	124 Å²	124	125.2 Å²	125.2	66%	0.663	74%	0.736	S	S	*	*			cis	68	140	40.4	-139.6	18	0	0	0	111.4
447	V	42.6	Very low	39.1	Very low	129 Å²	129	122 Å²	122	78%	0.782	71%	0.711	S	S	*	*			cis	-136.9	160.7	20.5	-76.3	0	0	0	0	110.6
448	G	36.4	Very low	41.5	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	69%	0.692	S	S	*	*			cis	117.8	158.4	2.4	0	0	0	0	0	113
449	S	36	Very low	44	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	69%	0.69	S	S	*	*			cis	-175.2	157.4	-16.4	-158.9	0	0	0	0	109.6
450	V	31.6	Very low	46	Very low	128 Å²	128	120.2 Å²	120.2	78%	0.776	67%	0.666	S	S	*	*			trans	64.9	132.3	158.3	163.4	0	0	0	0	115.5
451	Y	33.9	Very low	48.3	Very low	202 Å²	202	118.8 Å²	118.8	79%	0.792	65%	0.653	S	S	*	*			cis	-131.9	150.5	45.1	44.8	-92.4	0	0	0	116.4	T453	Y451-T453 HydrophobicContact CD2-CG2 4.29Å
452	N	29.4	Very low	51.2	Low	130 Å²	130	113.9 Å²	113.9	70%	0.695	62%	0.618	S	S	*	*			trans	-119	96.8	-178.6	175.6	-15.5	0	0	0	107.3	K454	N452-K454 PolarHBondContact O-N 3.42Å
453	T	32.8	Very low	53.9	Low	125 Å²	125	113.2 Å²	113.2	77%	0.767	61%	0.607	S	S	*	*			trans	-73.5	79.9	-178.1	49.5	0	0	0	0	110.6	Y451 K455	Y451-T453 HydrophobicContact CD2-CG2 4.29Å; T453-K455 PolarHBondContact O-N 2.87Å
454	K	34.1	Very low	56.4	Low	169 Å²	169	106.2 Å²	106.2	74%	0.735	57%	0.57	S	S	*	*			trans	-49.4	137.2	169.8	-69.6	178.6	178.6	176.5	0	109.6	N452 V456	N452-K454 PolarHBondContact O-N 3.42Å; K454-V456 WeakPolarHBondContact O-CG2 3.03Å; K454-V456 PolarHBondContact O-N 3.21Å
455	K	48.6	Very low	59	Low	200 Å²	200	108.7 Å²	108.7	87%	0.87	57%	0.569	S	S	*	*			trans	-61	87.7	-172.2	-58.6	163	-174.9	173.8	0	111.9	T453 G457	T453-K455 PolarHBondContact O-N 2.87Å; K455-G457 PolarHBondContact O-N 2.72Å
456	V	50.5	Low	61.3	Low	104 Å²	104	104 Å²	104	63%	0.63	54%	0.538	S	S	*	.			trans	-82	82.6	175.4	-171.6	0	0	0	0	110.2	K454	K454-V456 WeakPolarHBondContact O-CG2 3.03Å; K454-V456 PolarHBondContact O-N 3.21Å
457	G	60.6	Low	63.5	Low	13 Å²	13	99.6 Å²	99.6	13%	0.134	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	129.5	164.9	0	0	0	0	0	108.8	K455 R459 F545 R546	K455-G457 PolarHBondContact O-N 2.72Å; G457-R459 PolarHBondContact O-N 2.94Å; G457-F545 WeakPolarHBondContact O-CE2 3.29Å; G457-R546 CarbonylContact C-O 3.58Å; G457-R546 VanDerWaalsContact CA-O 3.26Å; G457-R546 WeakPolarHBondContact CA-O 3.29Å
458	K	82	Confident	65.4	Low	111 Å²	111	100.1 Å²	100.1	48%	0.483	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	117.8	-174.6	-78.1	168.7	176.2	151.8	0	109.3	L460 R546 E548	K458-L460 HydrophobicContact CB-CD2 4.4Å; K458-L460 HydrophobicContact CB-CG 4.46Å; K458-R546 PolarHBondContact N-O 3.4Å; K458-R546 PolarHBondContact O-N 3.09Å; K458-E548 VanDerWaalsContact CD-OE2 3.22Å; K458-E548 WeakPolarHBondContact CD-OE2 3.09Å; K458-E548 WeakPolarHBondContact CE-OE2 3.34Å; K458-E548 IonicContact NZ-OE1 3.01Å; K458-E548 PolarHBondContact NZ-OE1 2.76Å; K458-E548 IonicContact NZ-OE2 2.86Å; K458-E548 PolarHBondContact NZ-OE2 2.87Å
459	R	89.4	Confident	67.4	Low	170 Å²	170	101.5 Å²	101.5	64%	0.642	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.3	161.5	-70.8	-175.9	172.1	-155.3	-4.9	107.6	G457 I512 L543 V544 F545	G457-R459 PolarHBondContact O-N 2.94Å; R459-I512 HydrophobicContact CG-CD1 4.03Å; R459-L543 HydrophobicContact CB-CD1 4.4Å; R459-V544 CarbonylContact C-O 3.57Å; R459-V544 WeakPolarHBondContact CA-O 3.42Å; R459-F545 HydrophobicContact CG-CD2 4.32Å
460	L	91.5	Very high	69.8	Low	50 Å²	50	97.4 Å²	97.4	26%	0.262	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.6	-179.1	-62.9	168.8	0	0	0	108.3	K458 I462 V544 R546	K458-L460 HydrophobicContact CB-CD2 4.4Å; K458-L460 HydrophobicContact CB-CG 4.46Å; L460-I462 HydrophobicContact CB-CG1 4.44Å; L460-V544 HydrophobicContact CB-CG2 4.09Å; L460-V544 PolarHBondContact N-O 2.87Å; L460-V544 WeakPolarHBondContact O-CG2 3.46Å; L460-V544 PolarHBondContact O-N 2.84Å; L460-R546 HydrophobicContact CD1-CB 4.1Å; L460-R546 VanDerWaalsContact CD1-CZ 3.5Å
461	N	93.6	Very high	72.6	Confident	76 Å²	76	92.2 Å²	92.2	41%	0.406	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.7	166.6	-176	-92.1	0	0	0	109.1	R504 S541 L542 L543	N461-R504 PolarHBondContact O-NH1 3.29Å; N461-S541 PolarHBondContact ND2-OG 3.21Å; N461-S541 VanDerWaalsContact ND2-OG 3.12Å; N461-L542 WeakPolarHBondContact CA-O 3.5Å; N461-L543 HydrophobicContact CB-CD1 4.39Å
462	I	93.6	Very high	75.3	Confident	1 Å²	1	82.8 Å²	82.8	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.9	-176.8	-58.3	-179.7	0	0	0	107.9	L460 L464 D502 R504 L505 L542 V544	L460-I462 HydrophobicContact CB-CG1 4.44Å; I462-L464 HydrophobicContact CG2-CD2 3.77Å; I462-L464 HydrophobicContact CG2-CG 4.04Å; I462-D502 WeakPolarHBondContact CG2-OD2 3.18Å; I462-R504 HydrophobicContact CD1-CB 3.77Å; I462-R504 HydrophobicContact CG1-CB 3.97Å; I462-R504 HydrophobicContact CG2-CB 4.33Å; I462-L505 HydrophobicContact CD1-CB 4.03Å; I462-L505 HydrophobicContact CD1-CD1 3.81Å; I462-L542 HydrophobicContact CB-CB 4.45Å; I462-L542 PolarHBondContact N-O 3.04Å; I462-L542 PolarHBondContact O-N 3.02Å; I462-V544 HydrophobicContact CD1-CG2 3.56Å; I462-V544 HydrophobicContact CG1-CG2 4.08Å
463	Q	92.9	Very high	78.4	Confident	107 Å²	107	77.8 Å²	77.8	50%	0.5	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.5	-179.7	-68	-176.5	22.7	0	0	109.3	R504 T539 V540	Q463-R504 VanDerWaalsContact N-NH2 3.15Å; Q463-R504 PolarHBondContact O-NH2 3.2Å; Q463-T539 HydrophobicContact CB-CG2 3.87Å; Q463-T539 HydrophobicContact CG-CG2 4.43Å; Q463-V540 CarbonylContact C-O 3.51Å; Q463-V540 WeakPolarHBondContact CA-O 3.37Å
464	L	92.1	Very high	81.2	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.016	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.3	-177.3	-58.8	-176.2	0	0	0	110.3	I462 L471 F473 A498 A499 D502 L505 V540 L542	I462-L464 HydrophobicContact CG2-CD2 3.77Å; I462-L464 HydrophobicContact CG2-CG 4.04Å; L464-L471 HydrophobicContact CB-CD2 4.18Å; L464-F473 HydrophobicContact CD1-CD1 4.01Å; L464-F473 HydrophobicContact CD1-CE1 3.81Å; L464-A498 HydrophobicContact CB-CB 4.41Å; L464-A499 HydrophobicContact CD1-CB 3.88Å; L464-D502 HydrophobicContact CD2-CB 3.37Å; L464-L505 HydrophobicContact CD1-CD2 4.46Å; L464-V540 PolarHBondContact N-O 2.92Å; L464-V540 PolarHBondContact O-N 2.84Å; L464-L542 HydrophobicContact CD1-CD1 3.77Å; L464-L542 HydrophobicContact CG-CD1 4.27Å
465	K	90.1	Very high	84	Confident	148 Å²	148	67 Å²	67	64%	0.643	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	129.4	171	-67.2	-175.6	177.4	-176.1	0	110	G467 A498	K465-G467 PolarHBondContact O-N 2.79Å; K465-A498 WeakPolarHBondContact O-CB 3.32Å
466	K	88.9	Confident	85.9	Confident	30 Å²	30	59.5 Å²	59.5	13%	0.13	31%	0.312	C	S	.	.			trans	-73.5	96.5	-177.3	-173.9	172.9	170.3	-178.2	0	111.6	L471 R532 T534 M536 E537 G538	K466-L471 HydrophobicContact CB-CD2 3.92Å; K466-L471 HydrophobicContact CG-CD2 4.28Å; K466-L471 HydrophobicContact CG-CG 4.45Å; K466-R532 PolarHBondContact NZ-O 2.79Å; K466-T534 WeakPolarHBondContact CD-O 3.21Å; K466-T534 PolarHBondContact NZ-O 3.27Å; K466-M536 HydrophobicContact CD-SD 4.33Å; K466-M536 HydrophobicContact CG-SD 4.33Å; K466-E537 WeakPolarHBondContact O-CA 3.47Å; K466-E537 PolarHBondContact O-N 2.76Å; K466-G538 WeakPolarHBondContact CB-O 3.3Å; K466-G538 PolarHBondContact N-O 2.93Å
467	G	83.1	Confident	87.6	Confident	31 Å²	31	55.9 Å²	55.9	32%	0.32	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-73.8	-173.8	178.6	0	0	0	0	0	114	K465 E469 G470 M536	K465-G467 PolarHBondContact O-N 2.79Å; G467-E469 VanDerWaalsContact C-N 3.34Å; G467-E469 PolarHBondContact O-N 2.97Å; G467-G470 PolarHBondContact N-O 3.44Å; G467-G470 WeakPolarHBondContact O-CA 3.19Å; G467-G470 PolarHBondContact O-N 2.94Å; G467-M536 WeakPolarHBondContact O-CE 3.37Å
468	T	81.9	Confident	87.9	Confident	139 Å²	139	62 Å²	62	85%	0.853	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-40.8	177.7	46.9	0	0	0	0	112.8	G470	T468-G470 PolarHBondContact O-N 3.21Å
469	E	79.8	Confident	86.6	Confident	93 Å²	93	61.1 Å²	61.1	44%	0.435	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	20.2	171.4	-60.7	-168.2	-154	0	0	113	G467 R496	G467-E469 VanDerWaalsContact C-N 3.34Å; G467-E469 PolarHBondContact O-N 2.97Å; E469-R496 WeakPolarHBondContact OE1-CD 3.47Å; E469-R496 IonicContact OE1-CZ 2.94Å; E469-R496 IonicContact OE1-NE 2.66Å; E469-R496 IonicContact OE1-NH1 3.73Å; E469-R496 PolarHBondContact OE1-NH1 2.89Å; E469-R496 WeakPolarHBondContact OE2-CB 3.26Å
470	G	86.5	Confident	84.7	Confident	16 Å²	16	59.1 Å²	59.1	17%	0.165	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	71	-143.9	179.2	0	0	0	0	0	113.7	G467 T468	G467-G470 PolarHBondContact N-O 3.44Å; G467-G470 WeakPolarHBondContact O-CA 3.19Å; G467-G470 PolarHBondContact O-N 2.94Å; T468-G470 PolarHBondContact O-N 3.21Å
471	L	90.4	Very high	82.6	Confident	18 Å²	18	61.6 Å²	61.6	9%	0.094	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.9	-174.7	-62.6	172.8	0	0	0	114	L464 K466 F473 A499 L531 V540	L464-L471 HydrophobicContact CB-CD2 4.18Å; K466-L471 HydrophobicContact CB-CD2 3.92Å; K466-L471 HydrophobicContact CG-CD2 4.28Å; K466-L471 HydrophobicContact CG-CG 4.45Å; L471-F473 HydrophobicContact CB-CD1 3.94Å; L471-F473 HydrophobicContact CB-CE1 3.74Å; L471-F473 HydrophobicContact CD1-CE1 4.16Å; L471-F473 PolarHBondContact O-N 3.4Å; L471-A499 WeakPolarHBondContact O-CB 3.28Å; L471-A499 PolarHBondContact O-N 2.94Å; L471-L531 HydrophobicContact CD1-CB 4.06Å; L471-L531 HydrophobicContact CD1-CD2 3.85Å; L471-V540 HydrophobicContact CD1-CG2 4.05Å; L471-V540 HydrophobicContact CD2-CB 4.19Å; L471-V540 HydrophobicContact CD2-CG2 3.76Å
472	G	90.6	Very high	80.4	Confident	4 Å²	4	63.6 Å²	63.6	4%	0.041	34%	0.344	C	S	.	.			trans	73.8	18.6	174	0	0	0	0	0	117.1	L494	G472-L494 PolarHBondContact O-N 3.2Å
473	F	93.4	Very high	78.1	Confident	26 Å²	26	65.9 Å²	65.9	11%	0.114	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	161.3	172.7	71	-83.5	0	0	0	111.8	L464 L471 I475 V490 N492 I493 A499 L505 L511 L531 L542	L464-F473 HydrophobicContact CD1-CD1 4.01Å; L464-F473 HydrophobicContact CD1-CE1 3.81Å; L471-F473 HydrophobicContact CB-CD1 3.94Å; L471-F473 HydrophobicContact CB-CE1 3.74Å; L471-F473 HydrophobicContact CD1-CE1 4.16Å; L471-F473 PolarHBondContact O-N 3.4Å; F473-I475 HydrophobicContact CD2-CG2 3.87Å; F473-I475 HydrophobicContact CE2-CG2 3.55Å; F473-V490 HydrophobicContact CB-CG1 4.26Å; F473-V490 HydrophobicContact CD2-CG1 4.28Å; F473-V490 HydrophobicContact CD2-CG2 4.26Å; F473-N492 WeakPolarHBondContact CA-O 3.42Å; F473-I493 HydrophobicContact CB-CG1 4.22Å; F473-A499 HydrophobicContact CB-CB 4.04Å; F473-A499 HydrophobicContact CD1-CB 3.99Å; F473-A499 HydrophobicContact CG-CB 4.45Å; F473-L505 HydrophobicContact CB-CD2 3.95Å; F473-L505 HydrophobicContact CD1-CD2 3.8Å; F473-L505 HydrophobicContact CD2-CD2 4.06Å; F473-L505 HydrophobicContact CE1-CD2 4.28Å; F473-L505 HydrophobicContact CG-CD2 3.67Å; F473-L511 HydrophobicContact CE2-CD1 4.21Å; F473-L531 HydrophobicContact CE2-CD1 4.28Å; F473-L531 HydrophobicContact CZ-CD1 4.1Å; F473-L531 HydrophobicContact CZ-CD2 4.1Å; F473-L542 HydrophobicContact CE1-CD1 3.9Å; F473-L542 HydrophobicContact CZ-CD1 3.82Å; F473-L542 HydrophobicContact CZ-CD2 4.43Å
474	S	92	Very high	76.4	Confident	42 Å²	42	63.5 Å²	63.5	29%	0.294	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.2	175.8	50.9	0	0	0	0	110.3	K491 N492	S474-K491 PolarHBondContact O-N 3.23Å; S474-N492 PolarHBondContact N-O 2.87Å; S474-N492 WeakPolarHBondContact OG-CA 3.37Å; S474-N492 WeakPolarHBondContact OG-CB 3.39Å; S474-N492 PolarHBondContact OG-N 3.16Å; S474-N492 PolarHBondContact OG-O 3.25Å
475	I	92.7	Very high	75	Confident	26 Å²	26	67.2 Å²	67.2	13%	0.133	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	156.7	179.6	64.9	174.3	0	0	0	111.5	F473 I488 Y489 L511 Q524 V527 V528 L531	F473-I475 HydrophobicContact CD2-CG2 3.87Å; F473-I475 HydrophobicContact CE2-CG2 3.55Å; I475-I488 HydrophobicContact CB-CG2 3.78Å; I475-I488 HydrophobicContact CD1-CG2 3.93Å; I475-I488 HydrophobicContact CG1-CG2 4.31Å; I475-I488 HydrophobicContact CG2-CG2 4.24Å; I475-Y489 CarbonylContact C-O 3.52Å; I475-Y489 VanDerWaalsContact CA-O 3.3Å; I475-Y489 WeakPolarHBondContact CA-O 3.47Å; I475-L511 HydrophobicContact CG2-CD1 3.55Å; I475-Q524 HydrophobicContact CD1-CG 4.17Å; I475-Q524 HydrophobicContact CG1-CG 4.39Å; I475-V527 HydrophobicContact CD1-CB 4.36Å; I475-V527 HydrophobicContact CD1-CG1 3.98Å; I475-V528 HydrophobicContact CD1-CG2 3.95Å; I475-V528 HydrophobicContact CG1-CG2 4.37Å; I475-L531 HydrophobicContact CD1-CD1 4.3Å
476	T	88.9	Confident	74	Confident	41 Å²	41	61.2 Å²	61.2	25%	0.252	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	133.8	171.5	-165.1	0	0	0	0	108.9	Y489 K491	T476-Y489 PolarHBondContact N-O 3.39Å; T476-Y489 PolarHBondContact O-N 2.61Å; T476-K491 HydrophobicContact CG2-CB 3.97Å; T476-K491 HydrophobicContact CG2-CD 4.34Å; T476-K491 HydrophobicContact CG2-CG 4.34Å
477	S	85.8	Confident	73.8	Confident	29 Å²	29	61.8 Å²	61.8	20%	0.203	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	150.2	151.2	46.8	0	0	0	0	109	Q524	S477-Q524 PolarHBondContact OG-OE1 2.81Å; S477-Q524 VanDerWaalsContact OG-OE1 3.14Å
478	R	66.1	Low	74.2	Confident	142 Å²	142	60.5 Å²	60.5	54%	0.536	37%	0.369	S	S	.	.	S	Bend	trans	-102.9	132.2	159.2	-69.6	-174.3	-169.4	-176.9	5.2	107.8	P487 Y489	R478-P487 PolarHBondContact N-O 2.79Å; R478-Y489 HydrophobicContact CB-CD2 4.3Å; R478-Y489 HydrophobicContact CB-CE2 4.1Å; R478-Y489 HydrophobicContact CG-CD2 3.72Å; R478-Y489 HydrophobicContact CG-CE2 3.85Å
479	D	55.5	Low	74.7	Confident	92 Å²	92	56.1 Å²	56.1	49%	0.492	34%	0.337	S	S	.	.			trans	49.2	106.4	178.5	-57.9	-42.9	0	0	0	117	T481	D479-T481 PolarHBondContact O-N 2.76Å
480	V	48.6	Very low	75.3	Confident	128 Å²	128	51.9 Å²	51.9	78%	0.776	32%	0.317	S	S	*	.			trans	-72.4	77.1	168.5	-174.1	0	0	0	0	109.2
481	T	49.2	Very low	75.6	Confident	101 Å²	101	57 Å²	57	62%	0.62	34%	0.335	S	S	*	.			trans	-67.7	148.1	153	55.8	0	0	0	0	108.5	D479 G483	D479-T481 PolarHBondContact O-N 2.76Å; T481-G483 VanDerWaalsContact C-N 3.31Å; T481-G483 PolarHBondContact O-N 2.8Å
482	I	46.7	Very low	75.6	Confident	119 Å²	119	60.7 Å²	60.7	61%	0.61	36%	0.355	S	S	*	.	S	Bend	trans	-79.9	83.7	-171.4	-48.8	170.4	0	0	0	109.3	H342	H342-I482 WeakPolarHBondContact CE1-CG2 3.32Å; H342-I482 WeakPolarHBondContact ND1-CG2 3.38Å
483	G	45.9	Very low	75.7	Confident	49 Å²	49	62.7 Å²	62.7	51%	0.505	36%	0.364	S	S	.	.	S	Bend	trans	173.2	129	178.4	0	0	0	0	0	110	T481 S485	T481-G483 VanDerWaalsContact C-N 3.31Å; T481-G483 PolarHBondContact O-N 2.8Å; G483-S485 PolarHBondContact O-N 3.43Å
484	G	55.7	Low	75.6	Confident	56 Å²	56	65.3 Å²	65.3	58%	0.577	38%	0.379	S	S	*	.	S	Bend	trans	-72	31.9	-164.1	0	0	0	0	0	117.9	G521 K522	G484-G521 CarbonylContact O-C 3.5Å; G484-G521 WeakPolarHBondContact O-CA 3.45Å; G484-K522 PolarHBondContact O-N 2.84Å
485	S	62.6	Low	75.2	Confident	81 Å²	81	68.4 Å²	68.4	57%	0.566	40%	0.398	S	S	*	.			trans	-122.7	33.5	-174.3	-154.7	0	0	0	0	113.2	G483 G521	G483-S485 PolarHBondContact O-N 3.43Å; S485-G521 WeakPolarHBondContact OG-CA 3.27Å; S485-G521 PolarHBondContact OG-N 2.79Å; S485-G521 VanDerWaalsContact OG-N 3.12Å
486	A	70.2	Confident	74.7	Confident	22 Å²	22	75.5 Å²	75.5	18%	0.182	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-72.8	131.1	-179.8	0	0	0	0	0	111.4	I488	A486-I488 PolarHBondContact O-N 2.81Å
487	P	85	Confident	74.6	Confident	42 Å²	42	73.7 Å²	73.7	27%	0.273	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65.6	131.6	179.7	25.4	-33.2	0	0	0	112	R478 Y489	R478-P487 PolarHBondContact N-O 2.79Å; P487-Y489 HydrophobicContact CB-CE2 3.86Å; P487-Y489 HydrophobicContact CG-CE2 3.89Å; P487-Y489 WeakPolarHBondContact O-CD2 3.41Å; P487-Y489 WeakPolarHBondContact O-CE2 3.23Å
488	I	90.6	Very high	74.8	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.026	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.8	-178.7	-59.4	-177.6	0	0	0	110.4	I475 A486 R510 L511 V527	I475-I488 HydrophobicContact CB-CG2 3.78Å; I475-I488 HydrophobicContact CD1-CG2 3.93Å; I475-I488 HydrophobicContact CG1-CG2 4.31Å; I475-I488 HydrophobicContact CG2-CG2 4.24Å; A486-I488 PolarHBondContact O-N 2.81Å; I488-R510 CarbonylContact O-C 3.56Å; I488-R510 WeakPolarHBondContact O-CA 3.49Å; I488-L511 HydrophobicContact CG2-CD1 4.02Å; I488-L511 PolarHBondContact O-N 3.49Å; I488-V527 HydrophobicContact CD1-CB 3.76Å; I488-V527 HydrophobicContact CD1-CG1 4.02Å; I488-V527 HydrophobicContact CD1-CG2 3.53Å
489	Y	92.7	Very high	76	Confident	47 Å²	47	65.9 Å²	65.9	18%	0.184	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.2	179.4	-63.2	-94.2	0	0	0	111.3	I475 T476 R478 P487 K491 D509 R510	I475-Y489 CarbonylContact C-O 3.52Å; I475-Y489 VanDerWaalsContact CA-O 3.3Å; I475-Y489 WeakPolarHBondContact CA-O 3.47Å; T476-Y489 PolarHBondContact N-O 3.39Å; T476-Y489 PolarHBondContact O-N 2.61Å; R478-Y489 HydrophobicContact CB-CD2 4.3Å; R478-Y489 HydrophobicContact CB-CE2 4.1Å; R478-Y489 HydrophobicContact CG-CD2 3.72Å; R478-Y489 HydrophobicContact CG-CE2 3.85Å; P487-Y489 HydrophobicContact CB-CE2 3.86Å; P487-Y489 HydrophobicContact CG-CE2 3.89Å; P487-Y489 WeakPolarHBondContact O-CD2 3.41Å; P487-Y489 WeakPolarHBondContact O-CE2 3.23Å; Y489-K491 PolarHBondContact O-N 3.45Å; Y489-D509 CarbonylContact C-O 3.56Å; Y489-D509 WeakPolarHBondContact CA-O 2.98Å; Y489-R510 HydrophobicContact CD1-CB 3.89Å; Y489-R510 HydrophobicContact CD1-CG 4.47Å; Y489-R510 HydrophobicContact CE1-CB 3.79Å; Y489-R510 HydrophobicContact CE1-CG 4.21Å
490	V	93.4	Very high	77.7	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.018	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	122.6	166.1	-178.4	0	0	0	0	108.7	F473 I493 L505 G508 D509 L511	F473-V490 HydrophobicContact CB-CG1 4.26Å; F473-V490 HydrophobicContact CD2-CG1 4.28Å; F473-V490 HydrophobicContact CD2-CG2 4.26Å; V490-I493 HydrophobicContact CG1-CG1 4.11Å; V490-L505 HydrophobicContact CG1-CD2 4.25Å; V490-L505 HydrophobicContact CG2-CD1 4.03Å; V490-L505 HydrophobicContact CG2-CD2 4.1Å; V490-L505 HydrophobicContact CG2-CG 4.15Å; V490-G508 PolarHBondContact O-N 2.81Å; V490-D509 HydrophobicContact CG2-CB 4.21Å; V490-D509 PolarHBondContact N-O 2.83Å; V490-L511 HydrophobicContact CG2-CD1 4.16Å; V490-L511 HydrophobicContact CG2-CG 4.36Å
491	K	91.7	Very high	79.6	Confident	125 Å²	125	67 Å²	67	54%	0.543	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-69.8	-177.3	-174.4	175.8	177.5	174.2	0	111.5	S474 T476 Y489 A507	S474-K491 PolarHBondContact O-N 3.23Å; T476-K491 HydrophobicContact CG2-CB 3.97Å; T476-K491 HydrophobicContact CG2-CD 4.34Å; T476-K491 HydrophobicContact CG2-CG 4.34Å; Y489-K491 PolarHBondContact O-N 3.45Å; K491-A507 VanDerWaalsContact O-CB 3.29Å; K491-A507 WeakPolarHBondContact O-CB 3.39Å
492	N	90.7	Very high	81.6	Confident	95 Å²	95	64.6 Å²	64.6	51%	0.508	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.2	174.9	-64.7	15.2	0	0	0	110.2	F473 S474	F473-N492 WeakPolarHBondContact CA-O 3.42Å; S474-N492 PolarHBondContact N-O 2.87Å; S474-N492 WeakPolarHBondContact OG-CA 3.37Å; S474-N492 WeakPolarHBondContact OG-CB 3.39Å; S474-N492 PolarHBondContact OG-N 3.16Å; S474-N492 PolarHBondContact OG-O 3.25Å
493	I	92.4	Very high	83.6	Confident	45 Å²	45	61.2 Å²	61.2	23%	0.231	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.1	165	-64.8	175	0	0	0	107.9	F473 V490 A499 I500 L505	F473-I493 HydrophobicContact CB-CG1 4.22Å; V490-I493 HydrophobicContact CG1-CG1 4.11Å; I493-A499 HydrophobicContact CG2-CB 4.11Å; I493-I500 HydrophobicContact CG2-CB 3.82Å; I493-I500 HydrophobicContact CG2-CG1 4.18Å; I493-L505 HydrophobicContact CD1-CB 4.2Å; I493-L505 HydrophobicContact CD1-CD2 4.46Å; I493-L505 HydrophobicContact CD1-CG 4.3Å; I493-L505 WeakPolarHBondContact CD1-O 3.41Å
494	L	90.9	Very high	85.8	Confident	82 Å²	82	64.2 Å²	64.2	43%	0.429	35%	0.35	S	S	.	.			trans	-94.5	138.7	-175.5	-58.9	178.2	0	0	0	110.5	G472 R496 G497	G472-L494 PolarHBondContact O-N 3.2Å; L494-R496 PolarHBondContact O-N 3.18Å; L494-G497 PolarHBondContact O-N 2.82Å
495	P	85.1	Confident	87.6	Confident	107 Å²	107	61.8 Å²	61.8	70%	0.695	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-1.2	-170.3	28.2	-36.6	0	0	0	115.8
496	R	82	Confident	89	Confident	175 Å²	175	63.8 Å²	63.8	66%	0.66	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	-7.1	-175	-79.5	172.6	144.5	-123.1	5.2	115.2	E469 L494	E469-R496 WeakPolarHBondContact OE1-CD 3.47Å; E469-R496 IonicContact OE1-CZ 2.94Å; E469-R496 IonicContact OE1-NE 2.66Å; E469-R496 IonicContact OE1-NH1 3.73Å; E469-R496 PolarHBondContact OE1-NH1 2.89Å; E469-R496 WeakPolarHBondContact OE2-CB 3.26Å; L494-R496 PolarHBondContact O-N 3.18Å
497	G	86.1	Confident	89.9	Confident	3 Å²	3	65.8 Å²	65.8	3%	0.031	34%	0.339	C	S	.	.	S	Bend	trans	-103.6	169.6	-174.4	0	0	0	0	0	114.5	L494 A499 I500	L494-G497 PolarHBondContact O-N 2.82Å; G497-A499 VanDerWaalsContact C-N 3.3Å; G497-A499 PolarHBondContact O-N 3.14Å; G497-I500 WeakPolarHBondContact O-CG2 3.4Å; G497-I500 PolarHBondContact O-N 2.94Å
498	A	90.6	Very high	90.1	Very high	7 Å²	7	65.7 Å²	65.7	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-52.4	-37.3	-166.6	0	0	0	0	0	116	L464 K465 I500 Q501 D502	L464-A498 HydrophobicContact CB-CB 4.41Å; K465-A498 WeakPolarHBondContact O-CB 3.32Å; A498-I500 VanDerWaalsContact C-N 3.29Å; A498-I500 PolarHBondContact O-N 2.89Å; A498-Q501 PolarHBondContact O-N 2.66Å; A498-Q501 VanDerWaalsContact O-N 3.15Å; A498-D502 PolarHBondContact O-N 2.84Å
499	A	91.8	Very high	90.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-31.9	179.7	0	0	0	0	0	114.4	L464 L471 F473 I493 G497 G503 L505	L464-A499 HydrophobicContact CD1-CB 3.88Å; L471-A499 WeakPolarHBondContact O-CB 3.28Å; L471-A499 PolarHBondContact O-N 2.94Å; F473-A499 HydrophobicContact CB-CB 4.04Å; F473-A499 HydrophobicContact CD1-CB 3.99Å; F473-A499 HydrophobicContact CG-CB 4.45Å; I493-A499 HydrophobicContact CG2-CB 4.11Å; G497-A499 VanDerWaalsContact C-N 3.3Å; G497-A499 PolarHBondContact O-N 3.14Å; A499-G503 PolarHBondContact O-N 3.18Å; A499-L505 HydrophobicContact CB-CD2 3.9Å
500	I	90.2	Very high	90.2	Very high	88 Å²	88	69 Å²	69	45%	0.451	36%	0.357	S	S	.	.	H	α-helix	trans	-82.5	-26.9	176.5	-149.1	173.1	0	0	0	112.3	I493 G497 A498	I493-I500 HydrophobicContact CG2-CB 3.82Å; I493-I500 HydrophobicContact CG2-CG1 4.18Å; G497-I500 WeakPolarHBondContact O-CG2 3.4Å; G497-I500 PolarHBondContact O-N 2.94Å; A498-I500 VanDerWaalsContact C-N 3.29Å; A498-I500 PolarHBondContact O-N 2.89Å
501	Q	88.7	Confident	90.2	Very high	155 Å²	155	69 Å²	69	72%	0.724	36%	0.358	S	S	*	.	H	α-helix	trans	-71.3	-35.6	175.3	-61.8	178.1	-7.7	0	0	111.6	A498	A498-Q501 PolarHBondContact O-N 2.66Å; A498-Q501 VanDerWaalsContact O-N 3.15Å
502	D	90.6	Very high	90.2	Very high	50 Å²	50	64.4 Å²	64.4	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-78.6	-34.7	173.5	179.3	91.1	0	0	0	112.8	I462 L464 A498 R504	I462-D502 WeakPolarHBondContact CG2-OD2 3.18Å; L464-D502 HydrophobicContact CD2-CB 3.37Å; A498-D502 PolarHBondContact O-N 2.84Å; D502-R504 VanDerWaalsContact CG-NE 3.32Å; D502-R504 PolarHBondContact O-N 2.94Å; D502-R504 IonicContact OD1-CZ 3.35Å; D502-R504 VanDerWaalsContact OD1-CZ 3.24Å; D502-R504 IonicContact OD1-NE 2.76Å; D502-R504 PolarHBondContact OD1-NE 3.37Å; D502-R504 IonicContact OD1-NH2 3.58Å; D502-R504 PolarHBondContact OD1-NH2 2.9Å; D502-R504 WeakPolarHBondContact OD2-CB 3.1Å; D502-R504 VanDerWaalsContact OD2-CG 3.32Å; D502-R504 WeakPolarHBondContact OD2-CG 3.34Å; D502-R504 IonicContact OD2-CZ 2.75Å; D502-R504 PolarHBondContact OD2-N 3.26Å; D502-R504 IonicContact OD2-NE 3.52Å; D502-R504 PolarHBondContact OD2-NE 3.48Å; D502-R504 IonicContact OD2-NH2 3.94Å
503	G	89.6	Confident	90.4	Very high	48 Å²	48	62.9 Å²	62.9	50%	0.495	33%	0.328	S	S	.	.			trans	69.8	-9.2	172	0	0	0	0	0	116.5	A499	A499-G503 PolarHBondContact O-N 3.18Å
504	R	91.6	Very high	90.4	Very high	112 Å²	112	60.7 Å²	60.7	42%	0.423	32%	0.317	S	S	.	.			trans	-75	-30.4	-179.5	-60.5	178.7	-75.5	178.8	-12.9	112.8	N461 I462 Q463 D502 R546	N461-R504 PolarHBondContact O-NH1 3.29Å; I462-R504 HydrophobicContact CD1-CB 3.77Å; I462-R504 HydrophobicContact CG1-CB 3.97Å; I462-R504 HydrophobicContact CG2-CB 4.33Å; Q463-R504 VanDerWaalsContact N-NH2 3.15Å; Q463-R504 PolarHBondContact O-NH2 3.2Å; D502-R504 VanDerWaalsContact CG-NE 3.32Å; D502-R504 PolarHBondContact O-N 2.94Å; D502-R504 IonicContact OD1-CZ 3.35Å; D502-R504 VanDerWaalsContact OD1-CZ 3.24Å; D502-R504 IonicContact OD1-NE 2.76Å; D502-R504 PolarHBondContact OD1-NE 3.37Å; D502-R504 IonicContact OD1-NH2 3.58Å; D502-R504 PolarHBondContact OD1-NH2 2.9Å; D502-R504 WeakPolarHBondContact OD2-CB 3.1Å; D502-R504 VanDerWaalsContact OD2-CG 3.32Å; D502-R504 WeakPolarHBondContact OD2-CG 3.34Å; D502-R504 IonicContact OD2-CZ 2.75Å; D502-R504 PolarHBondContact OD2-N 3.26Å; D502-R504 IonicContact OD2-NE 3.52Å; D502-R504 PolarHBondContact OD2-NE 3.48Å; D502-R504 IonicContact OD2-NH2 3.94Å; R504-R546 PolarHBondContact O-NH2 2.78Å
505	L	93.5	Very high	90.4	Very high	5 Å²	5	60 Å²	60	3%	0.026	31%	0.314	C	S	.	.			trans	-77.4	142.8	179.8	-163.6	72.8	0	0	0	110.1	I462 L464 F473 V490 I493 A499 V544	I462-L505 HydrophobicContact CD1-CB 4.03Å; I462-L505 HydrophobicContact CD1-CD1 3.81Å; L464-L505 HydrophobicContact CD1-CD2 4.46Å; F473-L505 HydrophobicContact CB-CD2 3.95Å; F473-L505 HydrophobicContact CD1-CD2 3.8Å; F473-L505 HydrophobicContact CD2-CD2 4.06Å; F473-L505 HydrophobicContact CE1-CD2 4.28Å; F473-L505 HydrophobicContact CG-CD2 3.67Å; V490-L505 HydrophobicContact CG1-CD2 4.25Å; V490-L505 HydrophobicContact CG2-CD1 4.03Å; V490-L505 HydrophobicContact CG2-CD2 4.1Å; V490-L505 HydrophobicContact CG2-CG 4.15Å; I493-L505 HydrophobicContact CD1-CB 4.2Å; I493-L505 HydrophobicContact CD1-CD2 4.46Å; I493-L505 HydrophobicContact CD1-CG 4.3Å; I493-L505 WeakPolarHBondContact CD1-O 3.41Å; A499-L505 HydrophobicContact CB-CD2 3.9Å; L505-V544 HydrophobicContact CD1-CG1 4.01Å; L505-V544 HydrophobicContact CD1-CG2 4.12Å
506	K	91	Very high	90.5	Very high	123 Å²	123	57.9 Å²	57.9	54%	0.535	31%	0.311	S	S	.	.			trans	-130.9	149.8	176.2	-69.2	-171.1	177.5	-170.3	0	111.8	G508 D509	K506-G508 PolarHBondContact O-N 2.92Å; K506-D509 PolarHBondContact N-OD2 2.93Å; K506-D509 WeakPolarHBondContact O-CB 3.32Å; K506-D509 VanDerWaalsContact O-CG 3.31Å; K506-D509 PolarHBondContact O-N 3.37Å; K506-D509 VanDerWaalsContact O-N 3.16Å
507	A	90.5	Very high	90.9	Very high	65 Å²	65	52 Å²	52	54%	0.537	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	133.1	164.9	0	0	0	0	0	109.5	K491	K491-A507 VanDerWaalsContact O-CB 3.29Å; K491-A507 WeakPolarHBondContact O-CB 3.39Å
508	G	87.7	Confident	91.2	Very high	40 Å²	40	56 Å²	56	41%	0.412	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-13.8	-173.2	0	0	0	0	0	115.6	V490 K506 R510	V490-G508 PolarHBondContact O-N 2.81Å; K506-G508 PolarHBondContact O-N 2.92Å; G508-R510 PolarHBondContact O-N 3.24Å
509	D	93.3	Very high	91.1	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.027	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-61.2	135.3	173.8	-72.6	-21.9	0	0	0	111	Y489 V490 K506 V544 R546	Y489-D509 CarbonylContact C-O 3.56Å; Y489-D509 WeakPolarHBondContact CA-O 2.98Å; V490-D509 HydrophobicContact CG2-CB 4.21Å; V490-D509 PolarHBondContact N-O 2.83Å; K506-D509 PolarHBondContact N-OD2 2.93Å; K506-D509 WeakPolarHBondContact O-CB 3.32Å; K506-D509 VanDerWaalsContact O-CG 3.31Å; K506-D509 PolarHBondContact O-N 3.37Å; K506-D509 VanDerWaalsContact O-N 3.16Å; D509-V544 HydrophobicContact CB-CB 4.14Å; D509-V544 HydrophobicContact CB-CG1 3.82Å; D509-R546 VanDerWaalsContact CG-NH2 3.31Å; D509-R546 IonicContact OD1-CZ 3.76Å; D509-R546 IonicContact OD1-NE 2.67Å; D509-R546 PolarHBondContact OD1-NE 3.48Å; D509-R546 IonicContact OD1-NH2 3.24Å; D509-R546 PolarHBondContact OD1-NH2 3.18Å; D509-R546 VanDerWaalsContact OD1-NH2 3.11Å; D509-R546 IonicContact OD2-CZ 3.79Å; D509-R546 IonicContact OD2-NE 3.32Å; D509-R546 IonicContact OD2-NH2 3.74Å; D509-R546 PolarHBondContact OD2-NH2 3.32Å
510	R	92.7	Very high	90.7	Very high	115 Å²	115	59.3 Å²	59.3	43%	0.434	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.8	174.9	178.3	-179.5	170.3	176.1	0.6	109.9	I488 Y489 G508 V544 F545	I488-R510 CarbonylContact O-C 3.56Å; I488-R510 WeakPolarHBondContact O-CA 3.49Å; Y489-R510 HydrophobicContact CD1-CB 3.89Å; Y489-R510 HydrophobicContact CD1-CG 4.47Å; Y489-R510 HydrophobicContact CE1-CB 3.79Å; Y489-R510 HydrophobicContact CE1-CG 4.21Å; G508-R510 PolarHBondContact O-N 3.24Å; R510-V544 CarbonylContact O-C 3.58Å; R510-V544 VanDerWaalsContact O-CA 3.32Å; R510-V544 WeakPolarHBondContact O-CA 3.27Å; R510-F545 HydrophobicContact CB-CB 4.39Å; R510-F545 PolarHBondContact N-O 3.14Å; R510-F545 VanDerWaalsContact N-O 3.13Å; R510-F545 PolarHBondContact O-N 2.84Å
511	L	93.1	Very high	90.2	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.3	174.4	-74	150.8	0	0	0	110.2	F473 I475 I488 V490 L519 L542 V544	F473-L511 HydrophobicContact CE2-CD1 4.21Å; I475-L511 HydrophobicContact CG2-CD1 3.55Å; I488-L511 HydrophobicContact CG2-CD1 4.02Å; I488-L511 PolarHBondContact O-N 3.49Å; V490-L511 HydrophobicContact CG2-CD1 4.16Å; V490-L511 HydrophobicContact CG2-CG 4.36Å; L511-L519 HydrophobicContact CB-CD1 3.58Å; L511-L542 HydrophobicContact CD2-CB 4.31Å; L511-L542 HydrophobicContact CD2-CD1 4.49Å; L511-L542 HydrophobicContact CD2-CD2 4.07Å; L511-V544 HydrophobicContact CB-CG1 4.49Å; L511-V544 HydrophobicContact CD2-CG1 3.72Å; L511-V544 HydrophobicContact CG-CG1 3.89Å
512	I	92.5	Very high	90	Very high	28 Å²	28	52.6 Å²	52.6	14%	0.144	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-47.2	177.2	-36.9	178.4	0	0	0	110.2	R459 L519 L543 F545	R459-I512 HydrophobicContact CG-CD1 4.03Å; I512-L519 WeakPolarHBondContact O-CB 3.49Å; I512-L519 WeakPolarHBondContact O-CG 3.43Å; I512-L519 PolarHBondContact O-N 3.38Å; I512-L543 HydrophobicContact CB-CB 4.37Å; I512-L543 HydrophobicContact CB-CD2 4.25Å; I512-L543 HydrophobicContact CB-CG 4.42Å; I512-L543 HydrophobicContact CD1-CD2 3.9Å; I512-L543 HydrophobicContact CD1-CG 4Å; I512-L543 PolarHBondContact N-O 3.16Å; I512-F545 HydrophobicContact CD1-CB 3.76Å; I512-F545 HydrophobicContact CG1-CB 3.98Å
513	E	93.7	Very high	89.7	Confident	62 Å²	62	52.1 Å²	52.1	29%	0.29	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	148.5	-175.9	-57	163.2	-159.4	0	0	110.8	V517 L543	E513-V517 CarbonylContact C-O 3.5Å; E513-V517 VanDerWaalsContact CA-O 3.24Å; E513-V517 WeakPolarHBondContact CA-O 3.48Å; E513-L543 HydrophobicContact CB-CB 3.76Å; E513-L543 VanDerWaalsContact CD-CD2 3.42Å; E513-L543 HydrophobicContact CG-CB 4.11Å; E513-L543 HydrophobicContact CG-CD2 4.11Å; E513-L543 PolarHBondContact N-O 2.93Å; E513-L543 PolarHBondContact O-N 2.52Å; E513-L543 WeakPolarHBondContact OE1-CD2 3.45Å
514	V	93.6	Very high	89.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121.8	170.7	175.1	0	0	0	0	108.6	G516 V517 L519 V527 L530 L531 V540 S541 L542	V514-G516 PolarHBondContact O-N 3.41Å; V514-V517 PolarHBondContact N-O 3.37Å; V514-V517 VanDerWaalsContact O-CB 3.28Å; V514-V517 WeakPolarHBondContact O-CB 3.13Å; V514-V517 PolarHBondContact O-N 3.21Å; V514-L519 HydrophobicContact CB-CD2 4.12Å; V514-L519 HydrophobicContact CG2-CD1 4.06Å; V514-L519 HydrophobicContact CG2-CD2 3.89Å; V514-L519 HydrophobicContact CG2-CG 4.43Å; V514-V527 HydrophobicContact CG2-CG1 4.36Å; V514-L530 HydrophobicContact CG1-CB 4.22Å; V514-L531 HydrophobicContact CG1-CD2 3.7Å; V514-L531 HydrophobicContact CG1-CG 4.29Å; V514-L531 HydrophobicContact CG2-CD2 4.07Å; V514-V540 HydrophobicContact CG1-CG1 4.06Å; V514-S541 CarbonylContact C-O 3.57Å; V514-S541 WeakPolarHBondContact CA-O 3.43Å; V514-L542 HydrophobicContact CB-CD2 4.48Å; V514-L542 HydrophobicContact CG1-CD2 4.33Å; V514-L542 HydrophobicContact CG2-CD2 3.84Å
515	N	91.1	Very high	89.5	Confident	67 Å²	67	53 Å²	53	36%	0.358	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	34.7	-177.9	-65.2	-18.8	0	0	0	114.1	V517 T534 V540 S541	N515-V517 VanDerWaalsContact C-N 3.29Å; N515-T534 PolarHBondContact ND2-OG1 3.38Å; N515-V540 VanDerWaalsContact OD1-CA 3.3Å; N515-V540 WeakPolarHBondContact OD1-CA 3.15Å; N515-S541 PolarHBondContact N-O 2.94Å; N515-S541 PolarHBondContact OD1-N 2.87Å
516	G	87.2	Confident	89.3	Confident	62 Å²	62	56.7 Å²	56.7	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	4.5	-176.4	0	0	0	0	0	114.7	V514	V514-G516 PolarHBondContact O-N 3.41Å
517	V	90.3	Very high	89.3	Confident	52 Å²	52	50.8 Å²	50.8	32%	0.315	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.5	174.3	-176.6	0	0	0	0	109.1	E513 V514 N515 K522 L530	E513-V517 CarbonylContact C-O 3.5Å; E513-V517 VanDerWaalsContact CA-O 3.24Å; E513-V517 WeakPolarHBondContact CA-O 3.48Å; V514-V517 PolarHBondContact N-O 3.37Å; V514-V517 VanDerWaalsContact O-CB 3.28Å; V514-V517 WeakPolarHBondContact O-CB 3.13Å; V514-V517 PolarHBondContact O-N 3.21Å; N515-V517 VanDerWaalsContact C-N 3.29Å; V517-K522 HydrophobicContact CG1-CD 4.23Å; V517-K522 VanDerWaalsContact CG1-CE 3.5Å; V517-L530 HydrophobicContact CB-CD1 4.35Å; V517-L530 HydrophobicContact CG1-CD1 4Å; V517-L530 HydrophobicContact CG2-CD2 4.47Å
518	D	91.5	Very high	89.3	Confident	86 Å²	86	49.3 Å²	49.3	46%	0.46	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	141.1	172.4	-170.5	-3.3	0	0	0	110.7	A520 K522	D518-A520 WeakPolarHBondContact OD1-CB 3.41Å; D518-A520 PolarHBondContact OD1-N 3.2Å; D518-K522 VanDerWaalsContact O-CD 3.28Å; D518-K522 WeakPolarHBondContact O-CD 3.18Å; D518-K522 VanDerWaalsContact O-CE 3.23Å; D518-K522 WeakPolarHBondContact O-CE 3.34Å
519	L	88.8	Confident	89.4	Confident	12 Å²	12	50.7 Å²	50.7	6%	0.063	30%	0.295	C	S	.	.			trans	-96.1	-4.9	178.5	-49	-171.2	0	0	0	113	L511 I512 V514 G521 K522 V527	L511-L519 HydrophobicContact CB-CD1 3.58Å; I512-L519 WeakPolarHBondContact O-CB 3.49Å; I512-L519 WeakPolarHBondContact O-CG 3.43Å; I512-L519 PolarHBondContact O-N 3.38Å; V514-L519 HydrophobicContact CB-CD2 4.12Å; V514-L519 HydrophobicContact CG2-CD1 4.06Å; V514-L519 HydrophobicContact CG2-CD2 3.89Å; V514-L519 HydrophobicContact CG2-CG 4.43Å; L519-G521 PolarHBondContact O-N 3.46Å; L519-K522 PolarHBondContact O-N 2.81Å; L519-K522 VanDerWaalsContact O-N 3.13Å; L519-V527 HydrophobicContact CB-CG2 4.44Å; L519-V527 HydrophobicContact CD1-CG1 3.87Å; L519-V527 HydrophobicContact CD1-CG2 4.28Å; L519-V527 HydrophobicContact CD2-CG1 4.09Å; L519-V527 HydrophobicContact CD2-CG2 3.72Å; L519-V527 HydrophobicContact CG-CG2 4.34Å
520	A	84	Confident	89.3	Confident	66 Å²	66	52.4 Å²	52.4	55%	0.545	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	125.9	170.1	0	0	0	0	0	110.5	D518 K522	D518-A520 WeakPolarHBondContact OD1-CB 3.41Å; D518-A520 PolarHBondContact OD1-N 3.2Å; A520-K522 VanDerWaalsContact C-N 3.3Å; A520-K522 PolarHBondContact O-N 3.44Å
521	G	78.5	Confident	89.2	Confident	45 Å²	45	47.8 Å²	47.8	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	12	-178.3	0	0	0	0	0	116.2	G484 S485 L519	G484-G521 CarbonylContact O-C 3.5Å; G484-G521 WeakPolarHBondContact O-CA 3.45Å; S485-G521 WeakPolarHBondContact OG-CA 3.27Å; S485-G521 PolarHBondContact OG-N 2.79Å; S485-G521 VanDerWaalsContact OG-N 3.12Å; L519-G521 PolarHBondContact O-N 3.46Å
522	K	84.6	Confident	89	Confident	56 Å²	56	56.3 Å²	56.3	24%	0.243	32%	0.32	C	S	.	.			trans	-100.9	140.7	177.2	-66.8	-168.7	173.6	-80.5	0	113.1	G484 V517 D518 L519 A520 E526 V527 L530	G484-K522 PolarHBondContact O-N 2.84Å; V517-K522 HydrophobicContact CG1-CD 4.23Å; V517-K522 VanDerWaalsContact CG1-CE 3.5Å; D518-K522 VanDerWaalsContact O-CD 3.28Å; D518-K522 WeakPolarHBondContact O-CD 3.18Å; D518-K522 VanDerWaalsContact O-CE 3.23Å; D518-K522 WeakPolarHBondContact O-CE 3.34Å; L519-K522 PolarHBondContact O-N 2.81Å; L519-K522 VanDerWaalsContact O-N 3.13Å; A520-K522 VanDerWaalsContact C-N 3.3Å; A520-K522 PolarHBondContact O-N 3.44Å; K522-E526 IonicContact NZ-OE1 3.3Å; K522-V527 HydrophobicContact CB-CG2 3.99Å; K522-L530 HydrophobicContact CD-CD1 4.39Å
523	S	85.8	Confident	88.7	Confident	40 Å²	40	59.3 Å²	59.3	28%	0.28	34%	0.343	S	S	.	.			trans	-66.7	155.7	171.5	63.7	0	0	0	0	112	E525 E526 V527	S523-E525 PolarHBondContact O-N 3.18Å; S523-E526 WeakPolarHBondContact CB-OE2 3.44Å; S523-E526 PolarHBondContact N-OE2 2.89Å; S523-E526 PolarHBondContact O-N 3.3Å; S523-E526 VanDerWaalsContact OG-CG 3.25Å; S523-E526 WeakPolarHBondContact OG-CG 3.43Å; S523-E526 PolarHBondContact OG-N 3.41Å; S523-E526 PolarHBondContact OG-OE2 3.39Å; S523-V527 WeakPolarHBondContact O-CG2 3.48Å; S523-V527 PolarHBondContact O-N 2.75Å
524	Q	88	Confident	88.2	Confident	56 Å²	56	57.3 Å²	57.3	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-32.4	176	-169	178.1	-82.3	0	0	111.1	I475 S477 V527 V528	I475-Q524 HydrophobicContact CD1-CG 4.17Å; I475-Q524 HydrophobicContact CG1-CG 4.39Å; S477-Q524 PolarHBondContact OG-OE1 2.81Å; S477-Q524 VanDerWaalsContact OG-OE1 3.14Å; Q524-V527 PolarHBondContact O-N 3.29Å; Q524-V528 WeakPolarHBondContact O-CB 3.46Å; Q524-V528 VanDerWaalsContact O-CG2 3.3Å; Q524-V528 WeakPolarHBondContact O-CG2 3.37Å; Q524-V528 PolarHBondContact O-N 3.49Å
525	E	87.8	Confident	87.7	Confident	123 Å²	123	65.6 Å²	65.6	58%	0.575	37%	0.371	S	S	*	.	H	α-helix	trans	-66.4	-42.9	179.7	-68.4	58.7	-132.1	0	0	111.9	S523 S529	S523-E525 PolarHBondContact O-N 3.18Å; E525-S529 WeakPolarHBondContact O-CB 3.43Å; E525-S529 PolarHBondContact O-N 2.81Å; E525-S529 PolarHBondContact O-OG 3.4Å
526	E	89.4	Confident	87	Confident	82 Å²	82	67.8 Å²	67.8	38%	0.383	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-42.2	172.2	-75.6	165.7	91.9	0	0	111.7	K522 S523 S529 L530	K522-E526 IonicContact NZ-OE1 3.3Å; S523-E526 WeakPolarHBondContact CB-OE2 3.44Å; S523-E526 PolarHBondContact N-OE2 2.89Å; S523-E526 PolarHBondContact O-N 3.3Å; S523-E526 VanDerWaalsContact OG-CG 3.25Å; S523-E526 WeakPolarHBondContact OG-CG 3.43Å; S523-E526 PolarHBondContact OG-N 3.41Å; S523-E526 PolarHBondContact OG-OE2 3.39Å; E526-S529 CarbonylContact O-C 3.57Å; E526-S529 WeakPolarHBondContact O-CA 3.48Å; E526-S529 WeakPolarHBondContact O-CB 3.39Å; E526-S529 PolarHBondContact O-N 3.32Å; E526-S529 VanDerWaalsContact O-N 3.08Å; E526-L530 WeakPolarHBondContact O-CG 3.25Å; E526-L530 PolarHBondContact O-N 3.42Å
527	V	90.5	Very high	86.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-71.3	-38.6	-179	-178.8	0	0	0	0	111.6	I475 I488 V514 L519 K522 S523 Q524 S529 L530 L531	I475-V527 HydrophobicContact CD1-CB 4.36Å; I475-V527 HydrophobicContact CD1-CG1 3.98Å; I488-V527 HydrophobicContact CD1-CB 3.76Å; I488-V527 HydrophobicContact CD1-CG1 4.02Å; I488-V527 HydrophobicContact CD1-CG2 3.53Å; V514-V527 HydrophobicContact CG2-CG1 4.36Å; L519-V527 HydrophobicContact CB-CG2 4.44Å; L519-V527 HydrophobicContact CD1-CG1 3.87Å; L519-V527 HydrophobicContact CD1-CG2 4.28Å; L519-V527 HydrophobicContact CD2-CG1 4.09Å; L519-V527 HydrophobicContact CD2-CG2 3.72Å; L519-V527 HydrophobicContact CG-CG2 4.34Å; K522-V527 HydrophobicContact CB-CG2 3.99Å; S523-V527 WeakPolarHBondContact O-CG2 3.48Å; S523-V527 PolarHBondContact O-N 2.75Å; Q524-V527 PolarHBondContact O-N 3.29Å; V527-S529 PolarHBondContact O-N 2.67Å; V527-L530 PolarHBondContact O-N 3.35Å; V527-L531 HydrophobicContact CG1-CD1 4.26Å; V527-L531 WeakPolarHBondContact O-CB 3.47Å; V527-L531 VanDerWaalsContact O-CG 3.28Å; V527-L531 WeakPolarHBondContact O-CG 3.4Å; V527-L531 PolarHBondContact O-N 2.75Å
528	V	91.5	Very high	86.4	Confident	34 Å²	34	71.4 Å²	71.4	21%	0.206	38%	0.383	C	S	.	.	H	α-helix	trans	-58.1	-38.3	166.7	167.5	0	0	0	0	110.7	I475 Q524 R532	I475-V528 HydrophobicContact CD1-CG2 3.95Å; I475-V528 HydrophobicContact CG1-CG2 4.37Å; Q524-V528 WeakPolarHBondContact O-CB 3.46Å; Q524-V528 VanDerWaalsContact O-CG2 3.3Å; Q524-V528 WeakPolarHBondContact O-CG2 3.37Å; Q524-V528 PolarHBondContact O-N 3.49Å; V528-R532 HydrophobicContact CG1-CG 4.31Å; V528-R532 VanDerWaalsContact CG1-NE 3.33Å; V528-R532 VanDerWaalsContact O-CB 3.28Å; V528-R532 WeakPolarHBondContact O-CB 3.44Å; V528-R532 WeakPolarHBondContact O-CG 3.41Å; V528-R532 PolarHBondContact O-N 2.98Å
529	S	90	Very high	86.3	Confident	69 Å²	69	70.5 Å²	70.5	48%	0.483	38%	0.381	S	S	.	.	H	α-helix	trans	-69.4	-41.5	179	-58.8	0	0	0	0	112.7	E525 E526 V527 R532 S533	E525-S529 WeakPolarHBondContact O-CB 3.43Å; E525-S529 PolarHBondContact O-N 2.81Å; E525-S529 PolarHBondContact O-OG 3.4Å; E526-S529 CarbonylContact O-C 3.57Å; E526-S529 WeakPolarHBondContact O-CA 3.48Å; E526-S529 WeakPolarHBondContact O-CB 3.39Å; E526-S529 PolarHBondContact O-N 3.32Å; E526-S529 VanDerWaalsContact O-N 3.08Å; V527-S529 PolarHBondContact O-N 2.67Å; S529-R532 PolarHBondContact O-N 3.24Å; S529-S533 WeakPolarHBondContact O-CB 3.13Å; S529-S533 PolarHBondContact O-N 2.86Å; S529-S533 PolarHBondContact O-OG 2.84Å
530	L	90.5	Very high	86.5	Confident	41 Å²	41	69.9 Å²	69.9	22%	0.215	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-40.9	173.3	-72.4	165.8	0	0	0	112.4	V514 V517 K522 E526 V527 R532 S533	V514-L530 HydrophobicContact CG1-CB 4.22Å; V517-L530 HydrophobicContact CB-CD1 4.35Å; V517-L530 HydrophobicContact CG1-CD1 4Å; V517-L530 HydrophobicContact CG2-CD2 4.47Å; K522-L530 HydrophobicContact CD-CD1 4.39Å; E526-L530 WeakPolarHBondContact O-CG 3.25Å; E526-L530 PolarHBondContact O-N 3.42Å; V527-L530 PolarHBondContact O-N 3.35Å; L530-R532 VanDerWaalsContact C-N 3.35Å; L530-S533 PolarHBondContact O-OG 2.71Å
531	L	91.4	Very high	86.9	Confident	17 Å²	17	68.5 Å²	68.5	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-70.8	-30	175.5	-66.6	171.1	0	0	0	112.3	L471 F473 I475 V514 V527 V540 L542	L471-L531 HydrophobicContact CD1-CB 4.06Å; L471-L531 HydrophobicContact CD1-CD2 3.85Å; F473-L531 HydrophobicContact CE2-CD1 4.28Å; F473-L531 HydrophobicContact CZ-CD1 4.1Å; F473-L531 HydrophobicContact CZ-CD2 4.1Å; I475-L531 HydrophobicContact CD1-CD1 4.3Å; V514-L531 HydrophobicContact CG1-CD2 3.7Å; V514-L531 HydrophobicContact CG1-CG 4.29Å; V514-L531 HydrophobicContact CG2-CD2 4.07Å; V527-L531 HydrophobicContact CG1-CD1 4.26Å; V527-L531 WeakPolarHBondContact O-CB 3.47Å; V527-L531 VanDerWaalsContact O-CG 3.28Å; V527-L531 WeakPolarHBondContact O-CG 3.4Å; V527-L531 PolarHBondContact O-N 2.75Å; L531-V540 HydrophobicContact CD2-CG1 3.94Å; L531-L542 HydrophobicContact CD2-CD2 3.9Å
532	R	88.7	Confident	87.7	Confident	185 Å²	185	66.3 Å²	66.3	70%	0.698	34%	0.342	S	S	*	.	H	α-helix	trans	-81.9	-36.6	177.9	-77.5	176.6	-178.3	173.6	3.2	113.8	K466 V528 S529 L530 T534	K466-R532 PolarHBondContact NZ-O 2.79Å; V528-R532 HydrophobicContact CG1-CG 4.31Å; V528-R532 VanDerWaalsContact CG1-NE 3.33Å; V528-R532 VanDerWaalsContact O-CB 3.28Å; V528-R532 WeakPolarHBondContact O-CB 3.44Å; V528-R532 WeakPolarHBondContact O-CG 3.41Å; V528-R532 PolarHBondContact O-N 2.98Å; S529-R532 PolarHBondContact O-N 3.24Å; L530-R532 VanDerWaalsContact C-N 3.35Å; R532-T534 VanDerWaalsContact C-N 3.26Å; R532-T534 PolarHBondContact O-N 3.28Å
533	S	86.9	Confident	88.2	Confident	90 Å²	90	64.8 Å²	64.8	63%	0.629	34%	0.336	S	S	*	.	H	α-helix	trans	-67	-23.1	-174.6	63.9	0	0	0	0	114	S529 L530 K535	S529-S533 WeakPolarHBondContact O-CB 3.13Å; S529-S533 PolarHBondContact O-N 2.86Å; S529-S533 PolarHBondContact O-OG 2.84Å; L530-S533 PolarHBondContact O-OG 2.71Å; S533-K535 PolarHBondContact O-N 3.48Å
534	T	83.1	Confident	88.6	Confident	20 Å²	20	62.9 Å²	62.9	12%	0.123	32%	0.323	C	S	.	.	S	Bend	trans	-60.2	129.4	172.6	-59.3	0	0	0	0	109.9	K466 N515 R532 V540	K466-T534 WeakPolarHBondContact CD-O 3.21Å; K466-T534 PolarHBondContact NZ-O 3.27Å; N515-T534 PolarHBondContact ND2-OG1 3.38Å; R532-T534 VanDerWaalsContact C-N 3.26Å; R532-T534 PolarHBondContact O-N 3.28Å; T534-V540 HydrophobicContact CG2-CG2 3.69Å
535	K	82.6	Confident	88.8	Confident	174 Å²	174	63 Å²	63	76%	0.757	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-57.4	156.6	-179.4	-65	180	179.3	178.4	0	111.7	S533 G538	S533-K535 PolarHBondContact O-N 3.48Å; K535-G538 WeakPolarHBondContact O-CA 3.37Å; K535-G538 PolarHBondContact O-N 3.44Å
536	M	77	Confident	88.8	Confident	114 Å²	114	60.3 Å²	60.3	56%	0.562	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	143.9	166.2	-60.8	-59.3	-73.1	0	0	109.4	K466 G467 G538	K466-M536 HydrophobicContact CD-SD 4.33Å; K466-M536 HydrophobicContact CG-SD 4.33Å; G467-M536 WeakPolarHBondContact O-CE 3.37Å; M536-G538 PolarHBondContact O-N 3Å
537	E	79.9	Confident	87.9	Confident	168 Å²	168	63.5 Å²	63.5	79%	0.785	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-7.7	-167.5	-52.6	-162.2	141.5	0	0	116.5	K466	K466-E537 WeakPolarHBondContact O-CA 3.47Å; K466-E537 PolarHBondContact O-N 2.76Å
538	G	84.6	Confident	86.4	Confident	22 Å²	22	65.8 Å²	65.8	23%	0.227	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-63.3	138.8	176.1	0	0	0	0	0	112.7	K466 K535 M536	K466-G538 WeakPolarHBondContact CB-O 3.3Å; K466-G538 PolarHBondContact N-O 2.93Å; K535-G538 WeakPolarHBondContact O-CA 3.37Å; K535-G538 PolarHBondContact O-N 3.44Å; M536-G538 PolarHBondContact O-N 3Å
539	T	89.2	Confident	84.2	Confident	66 Å²	66	71.6 Å²	71.6	41%	0.405	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.6	173.6	-50.1	0	0	0	0	110.4	Q463	Q463-T539 HydrophobicContact CB-CG2 3.87Å; Q463-T539 HydrophobicContact CG-CG2 4.43Å
540	V	92.8	Very high	81.5	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.7	168.7	-180	0	0	0	0	109.1	Q463 L464 L471 V514 N515 L531 T534 L542	Q463-V540 CarbonylContact C-O 3.51Å; Q463-V540 WeakPolarHBondContact CA-O 3.37Å; L464-V540 PolarHBondContact N-O 2.92Å; L464-V540 PolarHBondContact O-N 2.84Å; L471-V540 HydrophobicContact CD1-CG2 4.05Å; L471-V540 HydrophobicContact CD2-CB 4.19Å; L471-V540 HydrophobicContact CD2-CG2 3.76Å; V514-V540 HydrophobicContact CG1-CG1 4.06Å; N515-V540 VanDerWaalsContact OD1-CA 3.3Å; N515-V540 WeakPolarHBondContact OD1-CA 3.15Å; L531-V540 HydrophobicContact CD2-CG1 3.94Å; T534-V540 HydrophobicContact CG2-CG2 3.69Å; V540-L542 HydrophobicContact CG1-CD2 3.61Å; V540-L542 HydrophobicContact CG1-CG 4.14Å
541	S	92.7	Very high	78.8	Confident	36 Å²	36	79.3 Å²	79.3	25%	0.252	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.1	171.1	-173.8	0	0	0	0	109.4	N461 V514 N515	N461-S541 PolarHBondContact ND2-OG 3.21Å; N461-S541 VanDerWaalsContact ND2-OG 3.12Å; V514-S541 CarbonylContact C-O 3.57Å; V514-S541 WeakPolarHBondContact CA-O 3.43Å; N515-S541 PolarHBondContact N-O 2.94Å; N515-S541 PolarHBondContact OD1-N 2.87Å
542	L	94.8	Very high	76.3	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.2	179.8	-57	176.6	0	0	0	108.9	N461 I462 L464 F473 L511 V514 L531 V540	N461-L542 WeakPolarHBondContact CA-O 3.5Å; I462-L542 HydrophobicContact CB-CB 4.45Å; I462-L542 PolarHBondContact N-O 3.04Å; I462-L542 PolarHBondContact O-N 3.02Å; L464-L542 HydrophobicContact CD1-CD1 3.77Å; L464-L542 HydrophobicContact CG-CD1 4.27Å; F473-L542 HydrophobicContact CE1-CD1 3.9Å; F473-L542 HydrophobicContact CZ-CD1 3.82Å; F473-L542 HydrophobicContact CZ-CD2 4.43Å; L511-L542 HydrophobicContact CD2-CB 4.31Å; L511-L542 HydrophobicContact CD2-CD1 4.49Å; L511-L542 HydrophobicContact CD2-CD2 4.07Å; V514-L542 HydrophobicContact CB-CD2 4.48Å; V514-L542 HydrophobicContact CG1-CD2 4.33Å; V514-L542 HydrophobicContact CG2-CD2 3.84Å; L531-L542 HydrophobicContact CD2-CD2 3.9Å; V540-L542 HydrophobicContact CG1-CD2 3.61Å; V540-L542 HydrophobicContact CG1-CG 4.14Å
543	L	94.3	Very high	73.6	Confident	24 Å²	24	82 Å²	82	13%	0.126	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.1	163	-164.8	72.1	0	0	0	108.6	R459 N461 I512 E513	R459-L543 HydrophobicContact CB-CD1 4.4Å; N461-L543 HydrophobicContact CB-CD1 4.39Å; I512-L543 HydrophobicContact CB-CB 4.37Å; I512-L543 HydrophobicContact CB-CD2 4.25Å; I512-L543 HydrophobicContact CB-CG 4.42Å; I512-L543 HydrophobicContact CD1-CD2 3.9Å; I512-L543 HydrophobicContact CD1-CG 4Å; I512-L543 PolarHBondContact N-O 3.16Å; E513-L543 HydrophobicContact CB-CB 3.76Å; E513-L543 VanDerWaalsContact CD-CD2 3.42Å; E513-L543 HydrophobicContact CG-CB 4.11Å; E513-L543 HydrophobicContact CG-CD2 4.11Å; E513-L543 PolarHBondContact N-O 2.93Å; E513-L543 PolarHBondContact O-N 2.52Å; E513-L543 WeakPolarHBondContact OE1-CD2 3.45Å
544	V	94.1	Very high	71	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.9	178.7	-95.3	0	0	0	0	111.1	R459 L460 I462 L505 D509 R510 L511	R459-V544 CarbonylContact C-O 3.57Å; R459-V544 WeakPolarHBondContact CA-O 3.42Å; L460-V544 HydrophobicContact CB-CG2 4.09Å; L460-V544 PolarHBondContact N-O 2.87Å; L460-V544 WeakPolarHBondContact O-CG2 3.46Å; L460-V544 PolarHBondContact O-N 2.84Å; I462-V544 HydrophobicContact CD1-CG2 3.56Å; I462-V544 HydrophobicContact CG1-CG2 4.08Å; L505-V544 HydrophobicContact CD1-CG1 4.01Å; L505-V544 HydrophobicContact CD1-CG2 4.12Å; D509-V544 HydrophobicContact CB-CB 4.14Å; D509-V544 HydrophobicContact CB-CG1 3.82Å; R510-V544 CarbonylContact O-C 3.58Å; R510-V544 VanDerWaalsContact O-CA 3.32Å; R510-V544 WeakPolarHBondContact O-CA 3.27Å; L511-V544 HydrophobicContact CB-CG1 4.49Å; L511-V544 HydrophobicContact CD2-CG1 3.72Å; L511-V544 HydrophobicContact CG-CG1 3.89Å
545	F	92.6	Very high	68.7	Low	58 Å²	58	96.3 Å²	96.3	25%	0.254	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	113.8	168.5	-172.8	-103.1	0	0	0	109.1	G457 R459 R510 I512 Q547	G457-F545 WeakPolarHBondContact O-CE2 3.29Å; R459-F545 HydrophobicContact CG-CD2 4.32Å; R510-F545 HydrophobicContact CB-CB 4.39Å; R510-F545 PolarHBondContact N-O 3.14Å; R510-F545 VanDerWaalsContact N-O 3.13Å; R510-F545 PolarHBondContact O-N 2.84Å; I512-F545 HydrophobicContact CD1-CB 3.76Å; I512-F545 HydrophobicContact CG1-CB 3.98Å; F545-Q547 HydrophobicContact CE1-CB 4.12Å
546	R	87.7	Confident	66.3	Low	66 Å²	66	96.4 Å²	96.4	25%	0.249	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	111.7	166.2	-172.4	172.2	-64.3	150.8	7.1	108	G457 K458 L460 R504 D509 E548	G457-R546 CarbonylContact C-O 3.58Å; G457-R546 VanDerWaalsContact CA-O 3.26Å; G457-R546 WeakPolarHBondContact CA-O 3.29Å; K458-R546 PolarHBondContact N-O 3.4Å; K458-R546 PolarHBondContact O-N 3.09Å; L460-R546 HydrophobicContact CD1-CB 4.1Å; L460-R546 VanDerWaalsContact CD1-CZ 3.5Å; R504-R546 PolarHBondContact O-NH2 2.78Å; D509-R546 VanDerWaalsContact CG-NH2 3.31Å; D509-R546 IonicContact OD1-CZ 3.76Å; D509-R546 IonicContact OD1-NE 2.67Å; D509-R546 PolarHBondContact OD1-NE 3.48Å; D509-R546 IonicContact OD1-NH2 3.24Å; D509-R546 PolarHBondContact OD1-NH2 3.18Å; D509-R546 VanDerWaalsContact OD1-NH2 3.11Å; D509-R546 IonicContact OD2-CZ 3.79Å; D509-R546 IonicContact OD2-NE 3.32Å; D509-R546 IonicContact OD2-NH2 3.74Å; D509-R546 PolarHBondContact OD2-NH2 3.32Å; R546-E548 PolarHBondContact O-N 3.1Å
547	Q	71.6	Confident	64	Low	150 Å²	150	98.2 Å²	98.2	70%	0.701	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	125.1	166.9	-174.9	165.6	-11.2	0	0	107.4	F545 E549	F545-Q547 HydrophobicContact CE1-CB 4.12Å; Q547-E549 PolarHBondContact O-N 2.96Å
548	E	59.4	Low	61.6	Low	48 Å²	48	94.3 Å²	94.3	22%	0.224	49%	0.488	C	S	.	.			trans	-90.5	100.8	-179.4	-175.4	158.9	-152.6	0	0	107.2	K458 R546 A550 H552	K458-E548 VanDerWaalsContact CD-OE2 3.22Å; K458-E548 WeakPolarHBondContact CD-OE2 3.09Å; K458-E548 WeakPolarHBondContact CE-OE2 3.34Å; K458-E548 IonicContact NZ-OE1 3.01Å; K458-E548 PolarHBondContact NZ-OE1 2.76Å; K458-E548 IonicContact NZ-OE2 2.86Å; K458-E548 PolarHBondContact NZ-OE2 2.87Å; R546-E548 PolarHBondContact O-N 3.1Å; E548-A550 PolarHBondContact O-N 3.45Å; E548-A550 VanDerWaalsContact O-N 3.14Å; E548-H552 IonicContact OE1-CD2 2.83Å; E548-H552 IonicContact OE1-CE1 2.73Å; E548-H552 IonicContact OE1-NE2 3.83Å; E548-H552 PolarHBondContact OE1-NE2 3.21Å
549	E	44.2	Very low	59.1	Low	156 Å²	156	101.3 Å²	101.3	73%	0.729	52%	0.515	S	S	*	.			trans	-60.7	117.4	168.6	-74.9	-168.5	178.1	0	0	108.1	Q547 F551	Q547-E549 PolarHBondContact O-N 2.96Å; E549-F551 HydrophobicContact CB-CD2 4.47Å; E549-F551 PolarHBondContact O-N 3.28Å
550	A	34.1	Very low	56.6	Low	86 Å²	86	103.5 Å²	103.5	71%	0.711	53%	0.53	S	S	*	.			trans	-81.9	51.6	-164.3	0	0	0	0	0	113.1	E548 H552	E548-A550 PolarHBondContact O-N 3.45Å; E548-A550 VanDerWaalsContact O-N 3.14Å; A550-H552 PolarHBondContact O-N 3.01Å
551	F	33.8	Very low	53.5	Low	185 Å²	185	108.1 Å²	108.1	81%	0.811	56%	0.562	S	S	*	*			trans	-86.3	67.2	165.8	-71.6	-73	0	0	0	110.3	E549	E549-F551 HydrophobicContact CB-CD2 4.47Å; E549-F551 PolarHBondContact O-N 3.28Å
552	H	38.6	Very low	50.6	Low	127 Å²	127	114.9 Å²	114.9	59%	0.588	59%	0.59	S	S	*	*			trans	-123.9	107.7	171.8	-73.6	-71	0	0	0	110.6	E548 A550	E548-H552 IonicContact OE1-CD2 2.83Å; E548-H552 IonicContact OE1-CE1 2.73Å; E548-H552 IonicContact OE1-NE2 3.83Å; E548-H552 PolarHBondContact OE1-NE2 3.21Å; A550-H552 PolarHBondContact O-N 3.01Å
553	P	32.3	Very low	47.8	Very low	133 Å²	133	122.1 Å²	122.1	86%	0.864	63%	0.625	S	S	*	*			trans	-71.3	132.6	146.4	-12.8	30.2	0	0	0	108.4
554	R	32.3	Very low	44.9	Very low	227 Å²	227	128.3 Å²	128.3	86%	0.857	65%	0.654	S	S	*	*			trans	-114.2	136	-169.6	-166	177.2	-174.3	-178.3	1	112.5
555	E	34.3	Very low	42	Very low	183 Å²	183	134.6 Å²	134.6	86%	0.855	69%	0.692	S	S	*	*			trans	-35.8	139	178.7	-59	147.8	-178.8	0	0	116.8
556	M	32.7	Very low	39.2	Very low	175 Å²	175	137.5 Å²	137.5	86%	0.862	72%	0.717	S	S	*	*			trans	-154.8	118.9	156.1	-150.7	168.6	-171.7	0	0	114
557	N	28.5	Very low	36.7	Very low	152 Å²	152	142 Å²	142	81%	0.813	74%	0.738	S	S	*	*			trans	5.4	156.4	154.5	-55.4	-5.8	0	0	0	122.8
558	A	27.9	Very low	34.8	Very low	86 Å²	86	141.8 Å²	141.8	71%	0.711	74%	0.737	S	S	*	*			cis	-178.7	148.7	-20.5	0	0	0	0	0	111.8
559	E	32.8	Very low	33.6	Very low	170 Å²	170	145 Å²	145	79%	0.794	76%	0.761	S	S	*	*			trans	60.8	161	158.2	-80.2	-77.1	89	0	0	120.3
560	P	36.4	Very low	33.2	Very low	112 Å²	112	147.2 Å²	147.2	73%	0.727	77%	0.768	S	S	*	*			cis	-124	-178.1	-10	40.8	-25.6	0	0	0	115.1
561	S	28.8	Very low	33.1	Very low	97 Å²	97	147 Å²	147	68%	0.678	77%	0.766	S	S	*	*			trans	-75	132.7	179.9	-67.7	0	0	0	0	115.6
562	Q	31.5	Very low	33.1	Very low	178 Å²	178	147 Å²	147	83%	0.832	77%	0.769	S	S	*	*				-176	129.2	115.9	-100.2	164.4	103.4	0	0	116.3
563	M	36	Very low	33.2	Very low	151 Å²	151	149 Å²	149	74%	0.744	78%	0.784	S	S	*	*			trans	60.9	111.2	146.7	-59.9	-144.3	178.5	0	0	123.8
564	Q	32.8	Very low	33.7	Very low	154 Å²	154	151 Å²	151	72%	0.72	78%	0.781	S	S	*	*				86.9	92.1	127.4	-65.1	-172.8	59.8	0	0	123
565	T	32.8	Very low	34.4	Very low	132 Å²	132	146.1 Å²	146.1	81%	0.81	77%	0.772	S	S	*	*				87.6	146.2	128.9	61.1	0	0	0	0	122.2
566	P	35.2	Very low	35.2	Very low	119 Å²	119	142.4 Å²	142.4	77%	0.773	76%	0.762	S	S	*	*			trans	-138.3	165	-157.1	41.7	-22.3	0	0	0	118
567	K	33.8	Very low	36.3	Very low	160 Å²	160	137.5 Å²	137.5	70%	0.696	74%	0.742	S	S	*	*			trans	-173.3	138.2	147	-116.5	172.1	169.3	-77.5	0	113.5
568	E	31.9	Very low	37.8	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	72%	0.721	S	S	*	*			trans	51.6	143.6	144.9	-74.2	148.8	-151.7	0	0	120.3
569	T	35.3	Very low	39.4	Very low	117 Å²	117	130.5 Å²	130.5	72%	0.718	69%	0.692	S	S	*	*			cis	-159.9	160.3	10.6	-12.6	0	0	0	0	111.9
570	K	34.5	Very low	40.5	Very low	201 Å²	201	129.1 Å²	129.1	87%	0.874	70%	0.698	S	S	*	*			trans	65.1	146.2	158	-71	-173	174.2	-173.4	0	118
571	A	33.4	Very low	41.6	Very low	82 Å²	82	128 Å²	128	68%	0.678	69%	0.686	S	S	*	*			cis	-160.4	-149.1	-16.6	0	0	0	0	0	106.3
572	E	32.9	Very low	43.3	Very low	186 Å²	186	124.3 Å²	124.3	87%	0.869	66%	0.663	S	S	*	*			cis	-148.5	136.6	9.1	-66.9	178.8	149	0	0	108.5
573	D	42.1	Very low	45.2	Very low	169 Å²	169	118.6 Å²	118.6	90%	0.904	64%	0.641	S	S	*	*			trans	-162.2	131.4	172.4	-141.7	-13.1	0	0	0	109
574	E	41.3	Very low	47.4	Very low	173 Å²	173	115.2 Å²	115.2	81%	0.808	62%	0.62	S	S	*	*			trans	-116.5	151.5	-158.8	-73.4	-86.1	109.6	0	0	115.4	V576	E574-V576 PolarHBondContact O-N 3.11Å
575	D	46.8	Very low	49.9	Very low	125 Å²	125	110.1 Å²	110.1	67%	0.668	60%	0.596	S	S	*	*			trans	57	44.2	154.6	-149.3	41.4	0	0	0	120.7	V577	D575-V577 PolarHBondContact O-N 3.14Å; D575-V577 WeakPolarHBondContact OD1-CG2 3.49Å
576	V	50.8	Low	52.6	Low	106 Å²	106	106.1 Å²	106.1	64%	0.642	57%	0.567	S	S	*	*			trans	-88.5	82.6	155.9	-174.2	0	0	0	0	110	E574 L578	E574-V576 PolarHBondContact O-N 3.11Å; V576-L578 HydrophobicContact CG1-CD2 3.94Å; V576-L578 HydrophobicContact CG1-CG 4.38Å; V576-L578 PolarHBondContact O-N 3.04Å; V576-L578 VanDerWaalsContact O-N 3.14Å
577	V	56.6	Low	55.2	Low	72 Å²	72	102.5 Å²	102.5	44%	0.436	54%	0.541	S	S	.	.			trans	-70.2	109.9	175.4	-171.2	0	0	0	0	110	D575 F586	D575-V577 PolarHBondContact O-N 3.14Å; D575-V577 WeakPolarHBondContact OD1-CG2 3.49Å; V577-F586 HydrophobicContact CB-CB 4.25Å; V577-F586 HydrophobicContact CB-CD2 4.49Å; V577-F586 HydrophobicContact CG1-CD2 3.98Å; V577-F586 WeakPolarHBondContact O-CB 3.39Å; V577-F586 PolarHBondContact O-N 2.88Å
578	L	60.6	Low	58	Low	73 Å²	73	98.1 Å²	98.1	38%	0.382	53%	0.528	S	S	.	.	B	Isolated β-bridge	trans	-88.4	150.6	177.1	-62.7	173.4	0	0	0	111.3	V576 I684 R686	V576-L578 HydrophobicContact CG1-CD2 3.94Å; V576-L578 HydrophobicContact CG1-CG 4.38Å; V576-L578 PolarHBondContact O-N 3.04Å; V576-L578 VanDerWaalsContact O-N 3.14Å; L578-I684 HydrophobicContact CD2-CD1 3.35Å; L578-R686 VanDerWaalsContact CD1-NH2 3.3Å
579	T	60.8	Low	60.8	Low	17 Å²	17	91.9 Å²	91.9	10%	0.104	50%	0.499	C	S	.	.			trans	-63.3	151.3	161.7	40.3	0	0	0	0	111	D581 G582 R584 F586	T579-D581 WeakPolarHBondContact CB-OD1 3.14Å; T579-D581 PolarHBondContact O-N 3.5Å; T579-D581 VanDerWaalsContact O-N 3.09Å; T579-D581 PolarHBondContact OG1-OD1 3.2Å; T579-G582 WeakPolarHBondContact O-CA 3.24Å; T579-G582 PolarHBondContact O-N 2.94Å; T579-R584 HydrophobicContact CG2-CB 3.9Å; T579-R584 PolarHBondContact N-O 3.02Å; T579-R584 WeakPolarHBondContact OG1-CB 3.08Å; T579-R584 PolarHBondContact OG1-N 2.93Å; T579-R584 PolarHBondContact OG1-O 3.15Å; T579-F586 HydrophobicContact CG2-CD2 4.23Å; T579-F586 HydrophobicContact CG2-CE1 4.24Å; T579-F586 HydrophobicContact CG2-CE2 3.38Å; T579-F586 HydrophobicContact CG2-CZ 3.39Å
580	P	56.4	Low	63.5	Low	141 Å²	141	89.9 Å²	89.9	92%	0.916	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20	176.3	-26.2	35.4	0	0	0	115	G582	P580-G582 VanDerWaalsContact C-N 3.32Å
581	D	59.2	Low	66	Low	88 Å²	88	80.3 Å²	80.3	47%	0.471	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-4.2	173.2	72.6	-5	0	0	0	113.4	T579 T583 R584	T579-D581 WeakPolarHBondContact CB-OD1 3.14Å; T579-D581 PolarHBondContact O-N 3.5Å; T579-D581 VanDerWaalsContact O-N 3.09Å; T579-D581 PolarHBondContact OG1-OD1 3.2Å; D581-T583 HydrophobicContact CB-CG2 4.19Å; D581-T583 WeakPolarHBondContact O-CG2 3.45Å; D581-T583 PolarHBondContact O-N 3.35Å; D581-T583 VanDerWaalsContact O-N 3.07Å; D581-T583 PolarHBondContact OD1-N 2.61Å; D581-T583 PolarHBondContact OD1-OG1 2.99Å; D581-T583 VanDerWaalsContact OD1-OG1 3.05Å; D581-T583 WeakPolarHBondContact OD2-CG2 3.45Å; D581-T583 PolarHBondContact OD2-OG1 3.36Å; D581-R584 IonicContact OD2-NH2 2.99Å
582	G	63.7	Low	68.6	Low	20 Å²	20	78.8 Å²	78.8	21%	0.206	42%	0.423	C	S	.	.	S	Bend	trans	66	-1.9	-175	0	0	0	0	0	115.7	T579 P580 R686	T579-G582 WeakPolarHBondContact O-CA 3.24Å; T579-G582 PolarHBondContact O-N 2.94Å; P580-G582 VanDerWaalsContact C-N 3.32Å; G582-R686 PolarHBondContact O-NE 2.94Å; G582-R686 PolarHBondContact O-NH2 3.38Å
583	T	73.2	Confident	70.9	Confident	58 Å²	58	71 Å²	71	36%	0.356	39%	0.387	S	S	.	.	S	Bend	trans	-81.3	-16	-170.9	74.9	0	0	0	0	114	D581 R683 I684	D581-T583 HydrophobicContact CB-CG2 4.19Å; D581-T583 WeakPolarHBondContact O-CG2 3.45Å; D581-T583 PolarHBondContact O-N 3.35Å; D581-T583 VanDerWaalsContact O-N 3.07Å; D581-T583 PolarHBondContact OD1-N 2.61Å; D581-T583 PolarHBondContact OD1-OG1 2.99Å; D581-T583 VanDerWaalsContact OD1-OG1 3.05Å; D581-T583 WeakPolarHBondContact OD2-CG2 3.45Å; D581-T583 PolarHBondContact OD2-OG1 3.36Å; T583-R683 WeakPolarHBondContact O-CA 3.13Å; T583-I684 PolarHBondContact O-N 3.22Å
584	R	80.5	Confident	72.1	Confident	81 Å²	81	68.5 Å²	68.5	31%	0.306	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.9	-176.1	-66.3	166.2	-118.7	-157.8	2.9	112.4	T579 D581 A681 R682 R683 I684	T579-R584 HydrophobicContact CG2-CB 3.9Å; T579-R584 PolarHBondContact N-O 3.02Å; T579-R584 WeakPolarHBondContact OG1-CB 3.08Å; T579-R584 PolarHBondContact OG1-N 2.93Å; T579-R584 PolarHBondContact OG1-O 3.15Å; D581-R584 IonicContact OD2-NH2 2.99Å; R584-A681 HydrophobicContact CB-CB 4.35Å; R584-R682 CarbonylContact C-O 3.6Å; R584-R682 WeakPolarHBondContact CA-O 3.45Å; R584-R682 VanDerWaalsContact CB-O 3.29Å; R584-R682 WeakPolarHBondContact CB-O 3.34Å; R584-R683 HydrophobicContact CG-CG 4.13Å; R584-I684 VanDerWaalsContact C-CD1 3.46Å
585	E	86.5	Confident	73.1	Confident	47 Å²	47	65.2 Å²	65.2	22%	0.22	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.1	164.9	55.6	-170.8	-165.3	0	0	107.3	L587 A681 R682 I684	E585-L587 HydrophobicContact CG-CD1 4.16Å; E585-L587 HydrophobicContact CG-CD2 4.46Å; E585-L587 HydrophobicContact CG-CG 4.13Å; E585-A681 WeakPolarHBondContact O-CA 3.43Å; E585-R682 HydrophobicContact CG-CB 3.85Å; E585-R682 PolarHBondContact N-O 3.08Å; E585-R682 PolarHBondContact O-N 3.49Å; E585-R682 VanDerWaalsContact OE1-CD 3.31Å; E585-R682 WeakPolarHBondContact OE1-CD 3.31Å; E585-R682 IonicContact OE1-NH1 2.82Å; E585-I684 HydrophobicContact CB-CD1 3.9Å; E585-I684 HydrophobicContact CB-CG1 3.77Å; E585-I684 HydrophobicContact CG-CG1 3.96Å
586	F	88.6	Confident	73.7	Confident	47 Å²	47	59.6 Å²	59.6	21%	0.206	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.7	162.3	-66.6	-74.5	0	0	0	108.9	V577 T579 I643 I679 V680 A681	V577-F586 HydrophobicContact CB-CB 4.25Å; V577-F586 HydrophobicContact CB-CD2 4.49Å; V577-F586 HydrophobicContact CG1-CD2 3.98Å; V577-F586 WeakPolarHBondContact O-CB 3.39Å; V577-F586 PolarHBondContact O-N 2.88Å; T579-F586 HydrophobicContact CG2-CD2 4.23Å; T579-F586 HydrophobicContact CG2-CE1 4.24Å; T579-F586 HydrophobicContact CG2-CE2 3.38Å; T579-F586 HydrophobicContact CG2-CZ 3.39Å; F586-I643 HydrophobicContact CD1-CG1 4.06Å; F586-I643 HydrophobicContact CD1-CG2 4.31Å; F586-I643 HydrophobicContact CE1-CB 4.44Å; F586-I643 HydrophobicContact CE1-CD1 4.08Å; F586-I643 HydrophobicContact CE1-CG1 3.84Å; F586-I643 HydrophobicContact CE1-CG2 3.91Å; F586-I679 HydrophobicContact CD1-CG2 4.34Å; F586-V680 CarbonylContact C-O 3.52Å; F586-V680 VanDerWaalsContact CA-O 3.27Å; F586-V680 WeakPolarHBondContact CA-O 3.31Å; F586-A681 HydrophobicContact CD1-CB 3.94Å; F586-A681 HydrophobicContact CE1-CB 3.92Å
587	L	90.9	Very high	73.8	Confident	43 Å²	43	57.6 Å²	57.6	23%	0.225	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133	-179.4	-59.9	172.9	0	0	0	108.9	E585 F589 V680	E585-L587 HydrophobicContact CG-CD1 4.16Å; E585-L587 HydrophobicContact CG-CD2 4.46Å; E585-L587 HydrophobicContact CG-CG 4.13Å; L587-F589 HydrophobicContact CB-CE1 3.8Å; L587-F589 HydrophobicContact CB-CE2 4.18Å; L587-F589 HydrophobicContact CB-CZ 3.54Å; L587-F589 HydrophobicContact CD1-CE1 4.39Å; L587-F589 HydrophobicContact CD1-CZ 3.77Å; L587-F589 HydrophobicContact CG-CZ 4.3Å; L587-V680 PolarHBondContact N-O 3.39Å; L587-V680 PolarHBondContact O-N 3.27Å
588	T	92.2	Very high	73.8	Confident	68 Å²	68	60.8 Å²	60.8	42%	0.417	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.2	178.1	-58.6	0	0	0	0	109.8	Q677 L678 I679	T588-Q677 HydrophobicContact CG2-CG 3.88Å; T588-L678 WeakPolarHBondContact CA-O 3.47Å; T588-I679 HydrophobicContact CG2-CG1 4.46Å
589	F	91.5	Very high	73.9	Confident	15 Å²	15	60 Å²	60	7%	0.066	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	121.4	179	-51.7	-46.3	0	0	0	110.4	L587 V591 R635 L636 Q677 L678 V680	L587-F589 HydrophobicContact CB-CE1 3.8Å; L587-F589 HydrophobicContact CB-CE2 4.18Å; L587-F589 HydrophobicContact CB-CZ 3.54Å; L587-F589 HydrophobicContact CD1-CE1 4.39Å; L587-F589 HydrophobicContact CD1-CZ 3.77Å; L587-F589 HydrophobicContact CG-CZ 4.3Å; F589-V591 HydrophobicContact CB-CG2 4.16Å; F589-R635 HydrophobicContact CD1-CB 3.69Å; F589-R635 HydrophobicContact CD1-CG 4.39Å; F589-R635 HydrophobicContact CD2-CB 4.47Å; F589-R635 HydrophobicContact CE1-CB 3.61Å; F589-R635 HydrophobicContact CE1-CG 4.46Å; F589-R635 HydrophobicContact CE2-CB 4.39Å; F589-R635 HydrophobicContact CG-CB 4.14Å; F589-R635 HydrophobicContact CZ-CB 3.97Å; F589-R635 WeakPolarHBondContact CZ-O 3.38Å; F589-L636 HydrophobicContact CD2-CD1 3.93Å; F589-L636 HydrophobicContact CE2-CD1 4.08Å; F589-Q677 CarbonylContact O-C 3.56Å; F589-Q677 WeakPolarHBondContact O-CA 3.47Å; F589-L678 PolarHBondContact N-O 2.92Å; F589-L678 PolarHBondContact O-N 3Å; F589-V680 HydrophobicContact CD2-CB 4.43Å; F589-V680 HydrophobicContact CD2-CG2 3.82Å; F589-V680 HydrophobicContact CE2-CB 4.06Å; F589-V680 HydrophobicContact CE2-CG1 4.36Å; F589-V680 HydrophobicContact CE2-CG2 3.88Å
590	E	90.5	Very high	74.8	Confident	75 Å²	75	60.6 Å²	60.6	35%	0.35	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.5	169.6	-174.5	162.2	-144.4	0	0	109.4	R635 M675	E590-R635 PolarHBondContact O-NH2 3.36Å; E590-M675 HydrophobicContact CG-CB 3.88Å; E590-M675 HydrophobicContact CG-CE 4.22Å; E590-M675 HydrophobicContact CG-SD 4.04Å; E590-M675 WeakPolarHBondContact OE1-CE 3.04Å
591	V	88.6	Confident	76.3	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.3	-168.2	-179.3	0	0	0	0	110.3	F589 L593 L601 A629 D633 M675 I676 L678	F589-V591 HydrophobicContact CB-CG2 4.16Å; V591-L593 PolarHBondContact O-N 3.24Å; V591-L601 HydrophobicContact CB-CD1 4.31Å; V591-L601 HydrophobicContact CG1-CD1 3.89Å; V591-A629 HydrophobicContact CG1-CB 3.68Å; V591-D633 HydrophobicContact CG1-CB 4.04Å; V591-D633 HydrophobicContact CG2-CB 4.36Å; V591-M675 CarbonylContact O-C 3.55Å; V591-M675 WeakPolarHBondContact O-CA 3.3Å; V591-I676 HydrophobicContact CB-CG2 4.1Å; V591-I676 PolarHBondContact N-O 2.84Å; V591-I676 PolarHBondContact O-N 3.39Å; V591-L678 HydrophobicContact CG2-CD1 4.38Å
592	P	86.1	Confident	77.7	Confident	50 Å²	50	50 Å²	50	33%	0.325	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.9	177.9	28.7	-33.8	0	0	0	111.6	A629 M675	P592-A629 WeakPolarHBondContact O-CB 3.41Å; P592-M675 HydrophobicContact CB-CG 4.43Å
593	L	82.5	Confident	78.9	Confident	22 Å²	22	50.5 Å²	50.5	12%	0.115	31%	0.307	C	S	.	.			trans	-89	-22.4	176.3	-66.1	-169.6	0	0	0	112.9	V591 D595 S596 L601 A629 M666 G674 I676	V591-L593 PolarHBondContact O-N 3.24Å; L593-D595 PolarHBondContact O-N 2.94Å; L593-S596 WeakPolarHBondContact O-CB 3.44Å; L593-S596 PolarHBondContact O-N 3.34Å; L593-L601 HydrophobicContact CD2-CB 3.86Å; L593-L601 HydrophobicContact CD2-CD1 4Å; L593-A629 HydrophobicContact CD2-CB 3.78Å; L593-M666 HydrophobicContact CD1-CB 4.39Å; L593-M666 HydrophobicContact CD1-CG 4.24Å; L593-G674 PolarHBondContact N-O 2.84Å; L593-I676 HydrophobicContact CD1-CB 4.06Å; L593-I676 HydrophobicContact CD1-CG2 4.01Å; L593-I676 HydrophobicContact CD2-CG2 3.75Å; L593-I676 HydrophobicContact CG-CB 4.23Å; L593-I676 HydrophobicContact CG-CG2 3.83Å
594	N	67.7	Low	79.7	Confident	116 Å²	116	50 Å²	50	62%	0.62	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-56.4	-46.7	-174.7	-64.6	-10.2	0	0	0	112.9	S596 G674	N594-S596 PolarHBondContact O-N 3.38Å; N594-S596 VanDerWaalsContact O-N 3.13Å; N594-G674 WeakPolarHBondContact OD1-CA 3.48Å; N594-G674 PolarHBondContact OD1-O 2.93Å
595	D	61.9	Low	80.2	Confident	104 Å²	104	47.3 Å²	47.3	56%	0.556	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-79.4	3.7	-170.8	-44.5	-67.5	0	0	0	113.9	L593 K632	L593-D595 PolarHBondContact O-N 2.94Å; D595-K632 PolarHBondContact O-NZ 2.95Å
596	S	58.3	Low	80.3	Confident	8 Å²	8	50 Å²	50	6%	0.056	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-101.1	3.6	-162.5	-60.4	0	0	0	0	114.8	L593 N594 A599 G600 A629	L593-S596 WeakPolarHBondContact O-CB 3.44Å; L593-S596 PolarHBondContact O-N 3.34Å; N594-S596 PolarHBondContact O-N 3.38Å; N594-S596 VanDerWaalsContact O-N 3.13Å; S596-A599 PolarHBondContact O-N 2.82Å; S596-G600 WeakPolarHBondContact CB-O 3.28Å; S596-A629 WeakPolarHBondContact OG-CA 3.16Å; S596-A629 WeakPolarHBondContact OG-CB 3.25Å; S596-A629 PolarHBondContact OG-N 3.46Å
597	G	53.9	Low	80.2	Confident	63 Å²	63	49.2 Å²	49.2	65%	0.649	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	52.4	-149.4	179.7	0	0	0	0	0	113.3	A599 G600	G597-A599 PolarHBondContact O-N 2.81Å; G597-G600 PolarHBondContact O-N 2.94Å
598	S	56.1	Low	79.9	Confident	139 Å²	139	49.4 Å²	49.4	97%	0.972	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-67.4	5.1	-174.9	-36.2	0	0	0	0	115.6
599	A	63.7	Low	79.4	Confident	57 Å²	57	53.9 Å²	53.9	47%	0.471	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-97.9	-18.6	-177.1	0	0	0	0	0	114.4	S596 G597 G602	S596-A599 PolarHBondContact O-N 2.82Å; G597-A599 PolarHBondContact O-N 2.81Å; A599-G602 PolarHBondContact O-N 3.03Å
600	G	79.4	Confident	78.7	Confident	30 Å²	30	54.3 Å²	54.3	31%	0.309	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-140.8	-173.7	0	0	0	0	0	112.4	S596 G597 G602 A629	S596-G600 WeakPolarHBondContact CB-O 3.28Å; G597-G600 PolarHBondContact O-N 2.94Å; G600-G602 PolarHBondContact O-N 2.76Å; G600-A629 PolarHBondContact O-N 2.86Å; G600-A629 VanDerWaalsContact O-N 3.1Å
601	L	87.7	Confident	77.8	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.2	-177.6	-175.6	56	0	0	0	114.1	V591 L593 V603 A629 A630 L662 M666 I676 L678	V591-L601 HydrophobicContact CB-CD1 4.31Å; V591-L601 HydrophobicContact CG1-CD1 3.89Å; L593-L601 HydrophobicContact CD2-CB 3.86Å; L593-L601 HydrophobicContact CD2-CD1 4Å; L601-V603 HydrophobicContact CB-CG2 4.28Å; L601-V603 HydrophobicContact CD2-CG2 3.64Å; L601-V603 HydrophobicContact CG-CG1 4.11Å; L601-V603 HydrophobicContact CG-CG2 3.74Å; L601-V603 PolarHBondContact O-N 2.9Å; L601-A629 HydrophobicContact CD1-CB 4.17Å; L601-A629 PolarHBondContact O-N 2.93Å; L601-A630 HydrophobicContact CD1-CB 4.21Å; L601-A630 WeakPolarHBondContact O-CB 3.37Å; L601-A630 PolarHBondContact O-N 3.33Å; L601-L662 HydrophobicContact CD2-CD1 4.32Å; L601-M666 HydrophobicContact CB-CG 4.44Å; L601-M666 HydrophobicContact CB-SD 3.49Å; L601-M666 WeakPolarHBondContact CB-SD 3.32Å; L601-M666 HydrophobicContact CD2-SD 3.92Å; L601-M666 HydrophobicContact CG-SD 4.37Å; L601-I676 HydrophobicContact CD1-CG2 3.87Å; L601-I676 HydrophobicContact CD2-CD1 4.5Å; L601-I676 HydrophobicContact CD2-CG2 4.48Å; L601-L678 HydrophobicContact CD1-CD1 4.28Å; L601-L678 HydrophobicContact CD2-CD1 4.13Å
602	G	87.6	Confident	77.1	Confident	3 Å²	3	68.6 Å²	68.6	3%	0.031	39%	0.394	C	S	.	.			trans	70.2	27.4	174.9	0	0	0	0	0	114.7	A599 G600 I625	A599-G602 PolarHBondContact O-N 3.03Å; G600-G602 PolarHBondContact O-N 2.76Å; G602-I625 VanDerWaalsContact O-CB 3.32Å; G602-I625 WeakPolarHBondContact O-CB 3.26Å; G602-I625 WeakPolarHBondContact O-CG1 3.18Å; G602-I625 PolarHBondContact O-N 2.82Å
603	V	90.5	Very high	76.6	Confident	29 Å²	29	72.2 Å²	72.2	18%	0.176	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.2	-179.9	-63.7	0	0	0	0	112.3	L601 V605 A630 L636	L601-V603 HydrophobicContact CB-CG2 4.28Å; L601-V603 HydrophobicContact CD2-CG2 3.64Å; L601-V603 HydrophobicContact CG-CG1 4.11Å; L601-V603 HydrophobicContact CG-CG2 3.74Å; L601-V603 PolarHBondContact O-N 2.9Å; V603-V605 HydrophobicContact CB-CG2 4.19Å; V603-V605 HydrophobicContact CG2-CG2 3.74Å; V603-A630 HydrophobicContact CG1-CB 3.46Å; V603-A630 VanDerWaalsContact CG1-CB 3.46Å; V603-L636 HydrophobicContact CG1-CD2 3.52Å
604	S	89.3	Confident	76	Confident	47 Å²	47	78.2 Å²	78.2	33%	0.329	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.7	163.5	-169.4	0	0	0	0	108.6	K622 S623	S604-K622 PolarHBondContact O-N 3.43Å; S604-S623 WeakPolarHBondContact CB-OG 3.27Å; S604-S623 PolarHBondContact N-O 3.36Å; S604-S623 PolarHBondContact O-N 3.27Å
605	V	91.8	Very high	76.3	Confident	26 Å²	26	75 Å²	75	16%	0.158	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	139.6	-171.3	177.8	0	0	0	0	109.5	V603 I619 F620 L642 M659 L662	V603-V605 HydrophobicContact CB-CG2 4.19Å; V603-V605 HydrophobicContact CG2-CG2 3.74Å; V605-I619 HydrophobicContact CG1-CG2 3.21Å; V605-F620 CarbonylContact C-O 3.51Å; V605-F620 WeakPolarHBondContact CA-O 3.36Å; V605-L642 HydrophobicContact CG1-CD1 4.39Å; V605-L642 HydrophobicContact CG2-CD1 4.24Å; V605-M659 HydrophobicContact CB-CE 4.31Å; V605-M659 HydrophobicContact CB-SD 4.13Å; V605-M659 HydrophobicContact CG1-CE 4.45Å; V605-M659 HydrophobicContact CG1-SD 3.64Å; V605-L662 HydrophobicContact CG1-CD2 4.47Å; V605-L662 HydrophobicContact CG2-CD2 4.17Å
606	K	88.1	Confident	77.1	Confident	104 Å²	104	73.3 Å²	73.3	45%	0.452	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	113.3	-179.9	-174.5	-155.5	177.5	-157.8	0	109.3	N608 F620 K622	K606-N608 PolarHBondContact NZ-OD1 2.95Å; K606-N608 PolarHBondContact O-N 2.82Å; K606-F620 PolarHBondContact N-O 3.1Å; K606-F620 PolarHBondContact O-N 2.95Å; K606-K622 HydrophobicContact CB-CB 4.13Å; K606-K622 HydrophobicContact CB-CD 4.46Å
607	G	87.1	Confident	78.1	Confident	30 Å²	30	76.9 Å²	76.9	31%	0.309	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	125.2	160	0	0	0	0	0	110.1	N655	G607-N655 WeakPolarHBondContact CA-OD1 3.49Å
608	N	83.1	Confident	79.6	Confident	47 Å²	47	74.6 Å²	74.6	25%	0.251	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.4	-177.5	-155.4	43.3	0	0	0	109.4	K606 L617 G618 F620 N655	K606-N608 PolarHBondContact NZ-OD1 2.95Å; K606-N608 PolarHBondContact O-N 2.82Å; N608-L617 HydrophobicContact CB-CB 4.21Å; N608-L617 PolarHBondContact O-N 2.74Å; N608-G618 PolarHBondContact N-O 3.05Å; N608-F620 HydrophobicContact CB-CD2 3.69Å; N608-F620 HydrophobicContact CB-CE2 3.7Å; N608-N655 PolarHBondContact O-ND2 3.26Å
609	R	81.8	Confident	81.2	Confident	161 Å²	161	68 Å²	68	61%	0.608	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	141.9	178	-63.4	-161.5	-70.3	-175.2	-1.1	109.8	A615 D616 N655	R609-A615 CarbonylContact C-O 3.58Å; R609-A615 VanDerWaalsContact CA-O 3.3Å; R609-A615 WeakPolarHBondContact CA-O 3.45Å; R609-D616 WeakPolarHBondContact CD-OD1 3.5Å; R609-D616 WeakPolarHBondContact CG-OD1 3.47Å; R609-N655 VanDerWaalsContact CG-ND2 3.33Å; R609-N655 WeakPolarHBondContact CG-ND2 3.47Å
610	S	76.8	Confident	82.6	Confident	24 Å²	24	67.7 Å²	67.7	17%	0.168	35%	0.354	C	S	.	.			trans	-67.1	139	172.2	65.5	0	0	0	0	109.6	E612 N613 H614 A615	S610-E612 PolarHBondContact O-N 2.94Å; S610-N613 PolarHBondContact OG-N 2.84Å; S610-H614 WeakPolarHBondContact O-CA 3.36Å; S610-H614 PolarHBondContact O-N 3.07Å; S610-H614 PolarHBondContact OG-N 3.2Å; S610-A615 PolarHBondContact N-O 3.41Å; S610-A615 PolarHBondContact OG-N 3.04Å; S610-A615 VanDerWaalsContact OG-N 3.12Å
611	K	71.8	Confident	83.3	Confident	207 Å²	207	66.3 Å²	66.3	90%	0.9	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-20.9	176.8	-79	-171.4	173.3	-175.3	0	112.9
612	E	74.4	Confident	83.5	Confident	170 Å²	170	72.8 Å²	72.8	79%	0.794	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-53.7	-168.1	-168.8	176.1	-167.3	0	0	111.4	S610	S610-E612 PolarHBondContact O-N 2.94Å
613	N	75.1	Confident	83.8	Confident	125 Å²	125	75 Å²	75	67%	0.668	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	5.1	-175.1	-61	-7.8	0	0	0	113.4	S610 A615	S610-N613 PolarHBondContact OG-N 2.84Å; N613-A615 HydrophobicContact CB-CB 4.47Å; N613-A615 PolarHBondContact O-N 2.93Å
614	H	70.9	Confident	83.8	Confident	149 Å²	149	75.6 Å²	75.6	69%	0.69	39%	0.385	S	S	*	.			trans	53.4	4.5	-170.7	-67.5	-61.6	0	0	0	116.8	S610	S610-H614 WeakPolarHBondContact O-CA 3.36Å; S610-H614 PolarHBondContact O-N 3.07Å; S610-H614 PolarHBondContact OG-N 3.2Å
615	A	73.1	Confident	83.7	Confident	49 Å²	49	76.8 Å²	76.8	41%	0.405	39%	0.386	S	S	.	.			trans	-64	138.7	-174.7	0	0	0	0	0	112.3	R609 S610 N613 L617	R609-A615 CarbonylContact C-O 3.58Å; R609-A615 VanDerWaalsContact CA-O 3.3Å; R609-A615 WeakPolarHBondContact CA-O 3.45Å; S610-A615 PolarHBondContact N-O 3.41Å; S610-A615 PolarHBondContact OG-N 3.04Å; S610-A615 VanDerWaalsContact OG-N 3.12Å; N613-A615 HydrophobicContact CB-CB 4.47Å; N613-A615 PolarHBondContact O-N 2.93Å; A615-L617 PolarHBondContact O-N 2.93Å
616	D	79.2	Confident	83.5	Confident	68 Å²	68	80.3 Å²	80.3	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	107.7	174.4	-76.1	-21.2	0	0	0	109.7	R609 G618 A654 N655	R609-D616 WeakPolarHBondContact CD-OD1 3.5Å; R609-D616 WeakPolarHBondContact CG-OD1 3.47Å; D616-G618 PolarHBondContact O-N 3.09Å; D616-A654 WeakPolarHBondContact OD2-CA 3.3Å; D616-N655 WeakPolarHBondContact CB-ND2 3.33Å; D616-N655 PolarHBondContact OD1-ND2 3.03Å; D616-N655 PolarHBondContact OD2-N 2.78Å
617	L	78.2	Confident	83.2	Confident	83 Å²	83	77.7 Å²	77.7	44%	0.435	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	5.4	179.9	-62.9	174.2	0	0	0	112.8	N608 A615 F620	N608-L617 HydrophobicContact CB-CB 4.21Å; N608-L617 PolarHBondContact O-N 2.74Å; A615-L617 PolarHBondContact O-N 2.93Å; L617-F620 WeakPolarHBondContact O-CE2 3.44Å; L617-F620 WeakPolarHBondContact O-CZ 3.32Å
618	G	85.3	Confident	83.1	Confident	14 Å²	14	76.3 Å²	76.3	14%	0.144	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	92.1	-172.9	-177.8	0	0	0	0	0	115.1	N608 D616 F620 N655	N608-G618 PolarHBondContact N-O 3.05Å; D616-G618 PolarHBondContact O-N 3.09Å; G618-F620 WeakPolarHBondContact O-CD2 3.38Å; G618-F620 WeakPolarHBondContact O-CE2 3.5Å; G618-N655 PolarHBondContact O-OD1 3.32Å
619	I	91.3	Very high	83.4	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.01	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.8	-165.9	-61.7	-65.1	0	0	0	109.4	V605 Q641 L642 L650 N655 A658 M659	V605-I619 HydrophobicContact CG1-CG2 3.21Å; I619-Q641 CarbonylContact O-C 3.56Å; I619-Q641 WeakPolarHBondContact O-CA 3.44Å; I619-L642 HydrophobicContact CB-CB 4.33Å; I619-L642 HydrophobicContact CG2-CB 3.99Å; I619-L642 HydrophobicContact CG2-CD1 3.97Å; I619-L642 HydrophobicContact CG2-CG 4.22Å; I619-L642 PolarHBondContact O-N 3.07Å; I619-L650 HydrophobicContact CB-CD1 4.33Å; I619-L650 HydrophobicContact CG1-CD1 4.34Å; I619-L650 HydrophobicContact CG2-CD1 4.29Å; I619-N655 VanDerWaalsContact CD1-OD1 3.23Å; I619-N655 WeakPolarHBondContact CD1-OD1 3.17Å; I619-A658 HydrophobicContact CD1-CB 3.9Å; I619-A658 HydrophobicContact CG1-CB 3.69Å; I619-M659 HydrophobicContact CD1-CG 3.86Å; I619-M659 HydrophobicContact CD1-SD 4.2Å; I619-M659 HydrophobicContact CG2-SD 4.43Å
620	F	92.7	Very high	83.8	Confident	50 Å²	50	66.5 Å²	66.5	22%	0.219	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.9	-174.3	-61.4	-95.6	0	0	0	113.2	V605 K606 N608 L617 G618 K622 D640 Q641	V605-F620 CarbonylContact C-O 3.51Å; V605-F620 WeakPolarHBondContact CA-O 3.36Å; K606-F620 PolarHBondContact N-O 3.1Å; K606-F620 PolarHBondContact O-N 2.95Å; N608-F620 HydrophobicContact CB-CD2 3.69Å; N608-F620 HydrophobicContact CB-CE2 3.7Å; L617-F620 WeakPolarHBondContact O-CE2 3.44Å; L617-F620 WeakPolarHBondContact O-CZ 3.32Å; G618-F620 WeakPolarHBondContact O-CD2 3.38Å; G618-F620 WeakPolarHBondContact O-CE2 3.5Å; F620-K622 PolarHBondContact O-N 2.81Å; F620-D640 CarbonylContact C-O 3.48Å; F620-D640 WeakPolarHBondContact CA-O 3.39Å; F620-Q641 HydrophobicContact CD1-CB 3.8Å; F620-Q641 HydrophobicContact CD1-CG 4.09Å; F620-Q641 HydrophobicContact CE1-CB 3.62Å; F620-Q641 HydrophobicContact CE1-CG 3.68Å; F620-Q641 HydrophobicContact CZ-CB 4.37Å; F620-Q641 HydrophobicContact CZ-CG 3.91Å
621	V	93.2	Very high	84.4	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	112.5	173.4	-178	0	0	0	0	109.5	I624 L636 R637 N639 D640 L642	V621-I624 HydrophobicContact CG1-CG1 3.99Å; V621-L636 HydrophobicContact CG1-CD2 4.26Å; V621-L636 HydrophobicContact CG2-CD1 4.4Å; V621-L636 HydrophobicContact CG2-CD2 3.9Å; V621-L636 HydrophobicContact CG2-CG 4.17Å; V621-R637 WeakPolarHBondContact CB-O 3.1Å; V621-R637 WeakPolarHBondContact CG1-O 3.31Å; V621-N639 PolarHBondContact O-N 3.15Å; V621-D640 HydrophobicContact CB-CB 4.31Å; V621-D640 HydrophobicContact CG2-CB 3.98Å; V621-D640 PolarHBondContact N-O 3.12Å; V621-L642 HydrophobicContact CG2-CD2 3.97Å; V621-L642 HydrophobicContact CG2-CG 4.31Å
622	K	93.3	Very high	85.2	Confident	140 Å²	140	63.8 Å²	63.8	61%	0.609	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	-36.3	-179.9	-179.7	175.9	176.7	-177.6	0	112.9	S604 K606 F620 V638	S604-K622 PolarHBondContact O-N 3.43Å; K606-K622 HydrophobicContact CB-CB 4.13Å; K606-K622 HydrophobicContact CB-CD 4.46Å; F620-K622 PolarHBondContact O-N 2.81Å; K622-V638 WeakPolarHBondContact O-CG1 3.42Å
623	S	92	Very high	85.9	Confident	49 Å²	49	57.4 Å²	57.4	34%	0.343	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	154.7	173.6	67.8	0	0	0	0	110.4	S604	S604-S623 WeakPolarHBondContact CB-OG 3.27Å; S604-S623 PolarHBondContact N-O 3.36Å; S604-S623 PolarHBondContact O-N 3.27Å
624	I	91.5	Very high	86.6	Confident	42 Å²	42	54 Å²	54	22%	0.215	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.1	172.9	-59.2	172.6	0	0	0	107.5	V621 A630 L636	V621-I624 HydrophobicContact CG1-CG1 3.99Å; I624-A630 HydrophobicContact CG2-CB 4.21Å; I624-L636 HydrophobicContact CD1-CB 4.12Å; I624-L636 HydrophobicContact CD1-CD2 4.41Å; I624-L636 HydrophobicContact CD1-CG 4.43Å; I624-L636 WeakPolarHBondContact CD1-O 3.47Å
625	I	88	Confident	87.6	Confident	71 Å²	71	52 Å²	52	36%	0.364	30%	0.295	S	S	.	.			trans	-100.5	118.2	-174.2	-54.9	173.6	0	0	0	107.9	G602 G627 G628 S631	G602-I625 VanDerWaalsContact O-CB 3.32Å; G602-I625 WeakPolarHBondContact O-CB 3.26Å; G602-I625 WeakPolarHBondContact O-CG1 3.18Å; G602-I625 PolarHBondContact O-N 2.82Å; I625-G627 PolarHBondContact O-N 2.74Å; I625-G628 PolarHBondContact O-N 2.82Å; I625-S631 VanDerWaalsContact O-CB 3.24Å; I625-S631 WeakPolarHBondContact O-CB 3.38Å
626	N	87.3	Confident	88.5	Confident	101 Å²	101	50 Å²	50	54%	0.54	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	134.2	179.5	-61.2	103.1	0	0	0	111.7	S631 R710	N626-S631 WeakPolarHBondContact CA-OG 2.92Å; N626-R710 PolarHBondContact ND2-NH2 3.18Å
627	G	81.2	Confident	89.1	Confident	49 Å²	49	53.9 Å²	53.9	51%	0.505	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-16.7	-178.1	0	0	0	0	0	116.1	I625	I625-G627 PolarHBondContact O-N 2.74Å
628	G	85.4	Confident	89.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-86.3	169.8	172.2	0	0	0	0	0	113.2	I625 A630 S631 K632	I625-G628 PolarHBondContact O-N 2.82Å; G628-A630 PolarHBondContact O-N 2.82Å; G628-S631 WeakPolarHBondContact O-CA 3.28Å; G628-S631 WeakPolarHBondContact O-CB 3.46Å; G628-S631 PolarHBondContact O-N 2.86Å; G628-K632 PolarHBondContact O-N 2.75Å; G628-K632 VanDerWaalsContact O-N 3.16Å
629	A	88.9	Confident	90	Very high	2 Å²	2	59 Å²	59	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-52.1	-51.8	-165	0	0	0	0	0	114.8	V591 P592 L593 S596 G600 L601 S631 K632 D633	V591-A629 HydrophobicContact CG1-CB 3.68Å; P592-A629 WeakPolarHBondContact O-CB 3.41Å; L593-A629 HydrophobicContact CD2-CB 3.78Å; S596-A629 WeakPolarHBondContact OG-CA 3.16Å; S596-A629 WeakPolarHBondContact OG-CB 3.25Å; S596-A629 PolarHBondContact OG-N 3.46Å; G600-A629 PolarHBondContact O-N 2.86Å; G600-A629 VanDerWaalsContact O-N 3.1Å; L601-A629 HydrophobicContact CD1-CB 4.17Å; L601-A629 PolarHBondContact O-N 2.93Å; A629-S631 PolarHBondContact O-N 2.71Å; A629-K632 WeakPolarHBondContact O-CA 3.44Å; A629-K632 WeakPolarHBondContact O-CB 3.27Å; A629-K632 PolarHBondContact O-N 2.92Å; A629-D633 WeakPolarHBondContact O-CB 3.49Å; A629-D633 PolarHBondContact O-N 3.08Å
630	A	90.7	Very high	90.1	Very high	1 Å²	1	59 Å²	59	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-19.9	179.9	0	0	0	0	0	113.6	L601 V603 I624 G628 G634 L636	L601-A630 HydrophobicContact CD1-CB 4.21Å; L601-A630 WeakPolarHBondContact O-CB 3.37Å; L601-A630 PolarHBondContact O-N 3.33Å; V603-A630 HydrophobicContact CG1-CB 3.46Å; V603-A630 VanDerWaalsContact CG1-CB 3.46Å; I624-A630 HydrophobicContact CG2-CB 4.21Å; G628-A630 PolarHBondContact O-N 2.82Å; A630-G634 PolarHBondContact O-N 2.71Å; A630-G634 VanDerWaalsContact O-N 3.1Å; A630-L636 HydrophobicContact CB-CB 4.38Å; A630-L636 HydrophobicContact CB-CD2 3.89Å
631	S	89	Confident	90.1	Very high	40 Å²	40	57.4 Å²	57.4	28%	0.28	31%	0.308	S	S	.	.	H	α-helix	trans	-84.6	-19.5	171.2	-174.1	0	0	0	0	113.4	I625 N626 G628 A629	I625-S631 VanDerWaalsContact O-CB 3.24Å; I625-S631 WeakPolarHBondContact O-CB 3.38Å; N626-S631 WeakPolarHBondContact CA-OG 2.92Å; G628-S631 WeakPolarHBondContact O-CA 3.28Å; G628-S631 WeakPolarHBondContact O-CB 3.46Å; G628-S631 PolarHBondContact O-N 2.86Å; A629-S631 PolarHBondContact O-N 2.71Å
632	K	87.9	Confident	90.2	Very high	133 Å²	133	57.6 Å²	57.6	58%	0.578	31%	0.308	S	S	*	.	H	α-helix	trans	-82.9	-36.9	169.7	-68.1	-172.1	169.1	-165.9	0	111	D595 G628 A629	D595-K632 PolarHBondContact O-NZ 2.95Å; G628-K632 PolarHBondContact O-N 2.75Å; G628-K632 VanDerWaalsContact O-N 3.16Å; A629-K632 WeakPolarHBondContact O-CA 3.44Å; A629-K632 WeakPolarHBondContact O-CB 3.27Å; A629-K632 PolarHBondContact O-N 2.92Å
633	D	89.4	Confident	90.1	Very high	36 Å²	36	51.7 Å²	51.7	19%	0.193	28%	0.283	C	S	.	.	H	α-helix	trans	-72.9	-39.1	178.8	-175.6	92.7	0	0	0	113.8	V591 A629 R635	V591-D633 HydrophobicContact CG1-CB 4.04Å; V591-D633 HydrophobicContact CG2-CB 4.36Å; A629-D633 WeakPolarHBondContact O-CB 3.49Å; A629-D633 PolarHBondContact O-N 3.08Å; D633-R635 PolarHBondContact O-N 3.07Å; D633-R635 IonicContact OD1-CZ 3.06Å; D633-R635 IonicContact OD1-NE 2.75Å; D633-R635 PolarHBondContact OD1-NE 2.56Å; D633-R635 IonicContact OD1-NH2 2.67Å; D633-R635 PolarHBondContact OD1-NH2 3.39Å; D633-R635 VanDerWaalsContact OD2-CB 3.27Å; D633-R635 WeakPolarHBondContact OD2-CB 3.39Å; D633-R635 WeakPolarHBondContact OD2-CG 3.43Å; D633-R635 IonicContact OD2-CZ 3.72Å; D633-R635 PolarHBondContact OD2-N 2.98Å; D633-R635 IonicContact OD2-NE 3.66Å; D633-R635 PolarHBondContact OD2-NE 3.37Å; D633-R635 IonicContact OD2-NH2 3.67Å
634	G	89.6	Confident	90.1	Very high	55 Å²	55	49.8 Å²	49.8	57%	0.567	27%	0.271	S	S	*	.			trans	71.4	-14.8	172.8	0	0	0	0	0	117	A630	A630-G634 PolarHBondContact O-N 2.71Å; A630-G634 VanDerWaalsContact O-N 3.1Å
635	R	92.1	Very high	90.1	Very high	106 Å²	106	47.8 Å²	47.8	40%	0.4	26%	0.261	S	S	.	.			trans	-73.3	-28.5	-177.1	-58.5	178.1	-73.5	-174.5	-8.4	113.3	F589 E590 D633 R682	F589-R635 HydrophobicContact CD1-CB 3.69Å; F589-R635 HydrophobicContact CD1-CG 4.39Å; F589-R635 HydrophobicContact CD2-CB 4.47Å; F589-R635 HydrophobicContact CE1-CB 3.61Å; F589-R635 HydrophobicContact CE1-CG 4.46Å; F589-R635 HydrophobicContact CE2-CB 4.39Å; F589-R635 HydrophobicContact CG-CB 4.14Å; F589-R635 HydrophobicContact CZ-CB 3.97Å; F589-R635 WeakPolarHBondContact CZ-O 3.38Å; E590-R635 PolarHBondContact O-NH2 3.36Å; D633-R635 PolarHBondContact O-N 3.07Å; D633-R635 IonicContact OD1-CZ 3.06Å; D633-R635 IonicContact OD1-NE 2.75Å; D633-R635 PolarHBondContact OD1-NE 2.56Å; D633-R635 IonicContact OD1-NH2 2.67Å; D633-R635 PolarHBondContact OD1-NH2 3.39Å; D633-R635 VanDerWaalsContact OD2-CB 3.27Å; D633-R635 WeakPolarHBondContact OD2-CB 3.39Å; D633-R635 WeakPolarHBondContact OD2-CG 3.43Å; D633-R635 IonicContact OD2-CZ 3.72Å; D633-R635 PolarHBondContact OD2-N 2.98Å; D633-R635 IonicContact OD2-NE 3.66Å; D633-R635 PolarHBondContact OD2-NE 3.37Å; D633-R635 IonicContact OD2-NH2 3.67Å; R635-R682 PolarHBondContact O-NH2 3.47Å
636	L	92.5	Very high	90.2	Very high	7 Å²	7	47.1 Å²	47.1	4%	0.037	26%	0.258	C	S	.	.			trans	-74.9	140.5	177.2	-157.1	78	0	0	0	111.1	F589 V603 V621 I624 A630 L642 L678 V680	F589-L636 HydrophobicContact CD2-CD1 3.93Å; F589-L636 HydrophobicContact CE2-CD1 4.08Å; V603-L636 HydrophobicContact CG1-CD2 3.52Å; V621-L636 HydrophobicContact CG1-CD2 4.26Å; V621-L636 HydrophobicContact CG2-CD1 4.4Å; V621-L636 HydrophobicContact CG2-CD2 3.9Å; V621-L636 HydrophobicContact CG2-CG 4.17Å; I624-L636 HydrophobicContact CD1-CB 4.12Å; I624-L636 HydrophobicContact CD1-CD2 4.41Å; I624-L636 HydrophobicContact CD1-CG 4.43Å; I624-L636 WeakPolarHBondContact CD1-O 3.47Å; A630-L636 HydrophobicContact CB-CB 4.38Å; A630-L636 HydrophobicContact CB-CD2 3.89Å; L636-L642 HydrophobicContact CD1-CD2 4.39Å; L636-L678 HydrophobicContact CD1-CD1 4.44Å; L636-V680 HydrophobicContact CD1-CG2 3.79Å
637	R	92.5	Very high	90.1	Very high	149 Å²	149	45.2 Å²	45.2	56%	0.562	26%	0.262	S	S	*	.			trans	-125.6	164.1	-178.7	-62.5	-178.7	-174.1	163.3	0.6	111.9	V621 D640	V621-R637 WeakPolarHBondContact CB-O 3.1Å; V621-R637 WeakPolarHBondContact CG1-O 3.31Å; R637-D640 PolarHBondContact N-OD2 2.88Å; R637-D640 VanDerWaalsContact O-CB 3.29Å; R637-D640 WeakPolarHBondContact O-CB 3.49Å; R637-D640 PolarHBondContact O-N 2.92Å
638	V	91.9	Very high	90.5	Very high	72 Å²	72	46.3 Å²	46.3	44%	0.436	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	139.5	174.5	-178	0	0	0	0	109.9	K622 D640	K622-V638 WeakPolarHBondContact O-CG1 3.42Å; V638-D640 VanDerWaalsContact C-N 3.29Å
639	N	90.4	Very high	90.7	Very high	132 Å²	132	49 Å²	49	71%	0.706	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	3.7	-169.6	-43.8	-74.6	0	0	0	115.9	V621	V621-N639 PolarHBondContact O-N 3.15Å
640	D	93.6	Very high	90.8	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-58.4	135.3	166.2	-80.8	0.4	0	0	0	110.6	F620 V621 R637 V638 V680 R682	F620-D640 CarbonylContact C-O 3.48Å; F620-D640 WeakPolarHBondContact CA-O 3.39Å; V621-D640 HydrophobicContact CB-CB 4.31Å; V621-D640 HydrophobicContact CG2-CB 3.98Å; V621-D640 PolarHBondContact N-O 3.12Å; R637-D640 PolarHBondContact N-OD2 2.88Å; R637-D640 VanDerWaalsContact O-CB 3.29Å; R637-D640 WeakPolarHBondContact O-CB 3.49Å; R637-D640 PolarHBondContact O-N 2.92Å; V638-D640 VanDerWaalsContact C-N 3.29Å; D640-V680 HydrophobicContact CB-CG1 3.54Å; D640-R682 IonicContact OD1-CZ 3.71Å; D640-R682 IonicContact OD1-NE 3.58Å; D640-R682 PolarHBondContact OD1-NE 3.23Å; D640-R682 IonicContact OD1-NH2 2.71Å; D640-R682 IonicContact OD2-CZ 3.89Å; D640-R682 IonicContact OD2-NE 2.87Å; D640-R682 IonicContact OD2-NH2 2.65Å; D640-R682 PolarHBondContact OD2-NH2 3.45Å
641	Q	92.7	Very high	90.5	Very high	17 Å²	17	53.2 Å²	53.2	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.8	175.6	-173.9	178.6	-8	0	0	109.5	I619 F620 I643 V680 A681	I619-Q641 CarbonylContact O-C 3.56Å; I619-Q641 WeakPolarHBondContact O-CA 3.44Å; F620-Q641 HydrophobicContact CD1-CB 3.8Å; F620-Q641 HydrophobicContact CD1-CG 4.09Å; F620-Q641 HydrophobicContact CE1-CB 3.62Å; F620-Q641 HydrophobicContact CE1-CG 3.68Å; F620-Q641 HydrophobicContact CZ-CB 4.37Å; F620-Q641 HydrophobicContact CZ-CG 3.91Å; Q641-I643 HydrophobicContact CG-CD1 4.01Å; Q641-V680 CarbonylContact O-C 3.51Å; Q641-V680 VanDerWaalsContact O-CA 3.28Å; Q641-V680 WeakPolarHBondContact O-CA 3.32Å; Q641-A681 HydrophobicContact CB-CB 4.31Å; Q641-A681 WeakPolarHBondContact CB-O 3.32Å; Q641-A681 PolarHBondContact N-O 3.19Å; Q641-A681 PolarHBondContact O-N 2.91Å
642	L	93.6	Very high	90	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.8	174.2	-55.8	-174.7	0	0	0	109.8	V605 I619 V621 L636 L650 L662 V680	V605-L642 HydrophobicContact CG1-CD1 4.39Å; V605-L642 HydrophobicContact CG2-CD1 4.24Å; I619-L642 HydrophobicContact CB-CB 4.33Å; I619-L642 HydrophobicContact CG2-CB 3.99Å; I619-L642 HydrophobicContact CG2-CD1 3.97Å; I619-L642 HydrophobicContact CG2-CG 4.22Å; I619-L642 PolarHBondContact O-N 3.07Å; V621-L642 HydrophobicContact CG2-CD2 3.97Å; V621-L642 HydrophobicContact CG2-CG 4.31Å; L636-L642 HydrophobicContact CD1-CD2 4.39Å; L642-L650 HydrophobicContact CB-CD1 3.75Å; L642-L662 HydrophobicContact CD1-CD2 4.02Å; L642-V680 HydrophobicContact CD2-CG2 3.98Å
643	I	92.1	Very high	89.9	Confident	16 Å²	16	51.3 Å²	51.3	8%	0.082	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-41.1	-170.8	-61.4	-63.5	0	0	0	111.5	F586 Q641 L650 L651 I679 A681	F586-I643 HydrophobicContact CD1-CG1 4.06Å; F586-I643 HydrophobicContact CD1-CG2 4.31Å; F586-I643 HydrophobicContact CE1-CB 4.44Å; F586-I643 HydrophobicContact CE1-CD1 4.08Å; F586-I643 HydrophobicContact CE1-CG1 3.84Å; F586-I643 HydrophobicContact CE1-CG2 3.91Å; Q641-I643 HydrophobicContact CG-CD1 4.01Å; I643-L650 PolarHBondContact O-N 3.16Å; I643-L651 HydrophobicContact CD1-CD1 4.26Å; I643-L651 HydrophobicContact CD1-CD2 3.84Å; I643-L651 HydrophobicContact CD1-CG 4.17Å; I643-L651 HydrophobicContact CG2-CD1 3.87Å; I643-L651 HydrophobicContact CG2-CG 4.09Å; I643-L651 PolarHBondContact O-N 3.42Å; I643-I679 HydrophobicContact CB-CB 4.3Å; I643-I679 HydrophobicContact CB-CG2 4.11Å; I643-I679 WeakPolarHBondContact CB-O 3.15Å; I643-I679 HydrophobicContact CG2-CG2 4.13Å; I643-I679 PolarHBondContact N-O 3.05Å; I643-A681 HydrophobicContact CD1-CB 3.71Å; I643-A681 HydrophobicContact CG1-CB 3.68Å
644	A	91.8	Very high	89.8	Confident	10 Å²	10	51.9 Å²	51.9	8%	0.083	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.1	174.2	0	0	0	0	0	111.3	E648 I679	A644-E648 CarbonylContact C-O 3.59Å; A644-E648 VanDerWaalsContact CA-O 3.22Å; A644-E648 WeakPolarHBondContact CA-O 3.44Å; A644-E648 WeakPolarHBondContact CB-O 3.13Å; A644-I679 HydrophobicContact CB-CB 4.02Å; A644-I679 HydrophobicContact CB-CD1 4Å; A644-I679 HydrophobicContact CB-CG1 4.08Å; A644-I679 PolarHBondContact N-O 3.19Å; A644-I679 PolarHBondContact O-N 3.3Å
645	V	91.9	Very high	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	120	-179.3	-175.7	0	0	0	0	109.7	G647 E648 L650 L662 S665 I676 Q677 L678	V645-G647 PolarHBondContact O-N 2.99Å; V645-E648 PolarHBondContact N-O 3.24Å; V645-E648 WeakPolarHBondContact O-CB 3.27Å; V645-E648 PolarHBondContact O-N 3.09Å; V645-L650 HydrophobicContact CG2-CD1 3.76Å; V645-L650 HydrophobicContact CG2-CD2 4.04Å; V645-L650 HydrophobicContact CG2-CG 3.98Å; V645-L662 HydrophobicContact CG1-CD1 4.13Å; V645-L662 HydrophobicContact CG2-CD1 3.94Å; V645-S665 VanDerWaalsContact CG1-CB 3.49Å; V645-I676 HydrophobicContact CG1-CD1 3.65Å; V645-I676 HydrophobicContact CG1-CG1 3.79Å; V645-Q677 CarbonylContact C-O 3.53Å; V645-Q677 VanDerWaalsContact CA-O 3.3Å; V645-Q677 WeakPolarHBondContact CA-O 3.36Å; V645-L678 HydrophobicContact CB-CD2 4.46Å; V645-L678 HydrophobicContact CG1-CD2 4.07Å; V645-L678 HydrophobicContact CG2-CD2 3.97Å
646	N	89.1	Confident	89.4	Confident	56 Å²	56	50.6 Å²	50.6	30%	0.299	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	38.6	-175.7	-68	-1.5	0	0	0	113.3	E648 I676 Q677	N646-E648 VanDerWaalsContact C-N 3.27Å; N646-E648 PolarHBondContact O-N 2.95Å; N646-I676 WeakPolarHBondContact OD1-CA 3.46Å; N646-I676 WeakPolarHBondContact OD1-CG1 3.34Å; N646-Q677 PolarHBondContact N-O 2.79Å; N646-Q677 PolarHBondContact OD1-N 2.71Å
647	G	86.7	Confident	89.2	Confident	62 Å²	62	54.3 Å²	54.3	64%	0.639	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-15.7	-174.7	0	0	0	0	0	115.6	V645 S649	V645-G647 PolarHBondContact O-N 2.99Å; G647-S649 PolarHBondContact O-N 3.18Å
648	E	89.3	Confident	89.1	Confident	71 Å²	71	47.2 Å²	47.2	33%	0.332	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	114.8	171.8	-72.1	-157.8	-121.9	0	0	110.8	A644 V645 N646 L650 K653 T661 R664	A644-E648 CarbonylContact C-O 3.59Å; A644-E648 VanDerWaalsContact CA-O 3.22Å; A644-E648 WeakPolarHBondContact CA-O 3.44Å; A644-E648 WeakPolarHBondContact CB-O 3.13Å; V645-E648 PolarHBondContact N-O 3.24Å; V645-E648 WeakPolarHBondContact O-CB 3.27Å; V645-E648 PolarHBondContact O-N 3.09Å; N646-E648 VanDerWaalsContact C-N 3.27Å; N646-E648 PolarHBondContact O-N 2.95Å; E648-L650 PolarHBondContact O-N 2.96Å; E648-K653 IonicContact OE2-NZ 3.35Å; E648-K653 PolarHBondContact OE2-NZ 3.13Å; E648-T661 HydrophobicContact CB-CG2 3.67Å; E648-T661 HydrophobicContact CG-CG2 4.26Å; E648-T661 WeakPolarHBondContact OE2-CG2 3.47Å; E648-R664 IonicContact OE1-NH1 2.7Å
649	S	90	Very high	89	Confident	56 Å²	56	45.9 Å²	45.9	39%	0.392	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	138.1	170.1	-179.9	0	0	0	0	111.6	G647 L651 K653	G647-S649 PolarHBondContact O-N 3.18Å; S649-L651 PolarHBondContact OG-N 2.86Å; S649-L651 PolarHBondContact OG-O 3.14Å; S649-L651 VanDerWaalsContact OG-O 3.14Å; S649-K653 VanDerWaalsContact O-CD 3.22Å; S649-K653 WeakPolarHBondContact O-CD 3.5Å; S649-K653 VanDerWaalsContact O-CE 3.26Å; S649-K653 WeakPolarHBondContact O-CE 3.29Å; S649-K653 PolarHBondContact O-NZ 2.94Å
650	L	89.6	Confident	88.9	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	27%	0.266	C	S	.	.			trans	-99.1	-14	164.9	-55.5	-169	0	0	0	112.1	I619 L642 I643 V645 E648 A658 T661	I619-L650 HydrophobicContact CB-CD1 4.33Å; I619-L650 HydrophobicContact CG1-CD1 4.34Å; I619-L650 HydrophobicContact CG2-CD1 4.29Å; L642-L650 HydrophobicContact CB-CD1 3.75Å; I643-L650 PolarHBondContact O-N 3.16Å; V645-L650 HydrophobicContact CG2-CD1 3.76Å; V645-L650 HydrophobicContact CG2-CD2 4.04Å; V645-L650 HydrophobicContact CG2-CG 3.98Å; E648-L650 PolarHBondContact O-N 2.96Å; L650-A658 HydrophobicContact CB-CB 4.16Å; L650-A658 HydrophobicContact CD2-CB 4.06Å; L650-T661 HydrophobicContact CD2-CG2 3.72Å
651	L	84.3	Confident	88.7	Confident	87 Å²	87	43.4 Å²	43.4	46%	0.455	27%	0.266	S	S	.	.	S	Bend	trans	-69.6	136.5	171.6	-66.7	179.9	0	0	0	110.1	I643 S649 K653	I643-L651 HydrophobicContact CD1-CD1 4.26Å; I643-L651 HydrophobicContact CD1-CD2 3.84Å; I643-L651 HydrophobicContact CD1-CG 4.17Å; I643-L651 HydrophobicContact CG2-CD1 3.87Å; I643-L651 HydrophobicContact CG2-CG 4.09Å; I643-L651 PolarHBondContact O-N 3.42Å; S649-L651 PolarHBondContact OG-N 2.86Å; S649-L651 PolarHBondContact OG-O 3.14Å; S649-L651 VanDerWaalsContact OG-O 3.14Å; L651-K653 PolarHBondContact O-N 2.82Å
652	G	80	Confident	88.5	Confident	91 Å²	91	42.9 Å²	42.9	94%	0.938	26%	0.263	S	S	*	.	S	Bend	trans	80.2	-23.2	-178.4	0	0	0	0	0	114.9
653	K	85.1	Confident	88.3	Confident	41 Å²	41	47.7 Å²	47.7	18%	0.178	28%	0.281	C	S	.	.	S	Bend	trans	-68.3	147.3	172	-70.8	-167.2	171.5	162.8	0	111.6	E648 S649 L651 E657 A658 T661	E648-K653 IonicContact OE2-NZ 3.35Å; E648-K653 PolarHBondContact OE2-NZ 3.13Å; S649-K653 VanDerWaalsContact O-CD 3.22Å; S649-K653 WeakPolarHBondContact O-CD 3.5Å; S649-K653 VanDerWaalsContact O-CE 3.26Å; S649-K653 WeakPolarHBondContact O-CE 3.29Å; S649-K653 PolarHBondContact O-NZ 2.94Å; L651-K653 PolarHBondContact O-N 2.82Å; K653-E657 WeakPolarHBondContact CA-OE2 3.28Å; K653-E657 HydrophobicContact CB-CB 4.45Å; K653-E657 HydrophobicContact CB-CG 4.43Å; K653-E657 WeakPolarHBondContact CB-OE2 3.28Å; K653-E657 HydrophobicContact CD-CG 4.16Å; K653-E657 VanDerWaalsContact CD-OE1 3.26Å; K653-E657 WeakPolarHBondContact CD-OE1 3.44Å; K653-E657 VanDerWaalsContact CE-OE1 3.27Å; K653-E657 WeakPolarHBondContact CE-OE1 3.4Å; K653-E657 HydrophobicContact CG-CG 4.48Å; K653-E657 VanDerWaalsContact CG-OE1 3.31Å; K653-E657 WeakPolarHBondContact CG-OE1 3.22Å; K653-A658 HydrophobicContact CB-CB 4.04Å; K653-T661 PolarHBondContact NZ-OG1 3.41Å
654	A	86	Confident	88	Confident	48 Å²	48	53.2 Å²	53.2	40%	0.397	30%	0.301	S	S	.	.			trans	-65	149.8	175	0	0	0	0	0	111.1	D616 Q656 E657 A658	D616-A654 WeakPolarHBondContact OD2-CA 3.3Å; A654-Q656 PolarHBondContact O-N 3.09Å; A654-E657 HydrophobicContact CB-CB 4.16Å; A654-E657 PolarHBondContact N-OE2 3.27Å; A654-E657 WeakPolarHBondContact O-CB 3.26Å; A654-E657 PolarHBondContact O-N 3.4Å; A654-A658 PolarHBondContact O-N 3.01Å
655	N	87.5	Confident	87.8	Confident	20 Å²	20	53 Å²	53	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-55.5	-28.1	-177.6	-102.9	-46.4	0	0	0	113.7	G607 N608 R609 D616 G618 I619 M659	G607-N655 WeakPolarHBondContact CA-OD1 3.49Å; N608-N655 PolarHBondContact O-ND2 3.26Å; R609-N655 VanDerWaalsContact CG-ND2 3.33Å; R609-N655 WeakPolarHBondContact CG-ND2 3.47Å; D616-N655 WeakPolarHBondContact CB-ND2 3.33Å; D616-N655 PolarHBondContact OD1-ND2 3.03Å; D616-N655 PolarHBondContact OD2-N 2.78Å; G618-N655 PolarHBondContact O-OD1 3.32Å; I619-N655 VanDerWaalsContact CD1-OD1 3.23Å; I619-N655 WeakPolarHBondContact CD1-OD1 3.17Å; N655-M659 WeakPolarHBondContact O-CB 3.37Å; N655-M659 WeakPolarHBondContact O-CG 3.33Å
656	Q	87.3	Confident	87.3	Confident	114 Å²	114	56.1 Å²	56.1	53%	0.533	31%	0.314	S	S	.	.	H	α-helix	trans	-76.6	-47.7	172.2	178.6	64.4	17.1	0	0	111.8	A654 M659 E660	A654-Q656 PolarHBondContact O-N 3.09Å; Q656-M659 CarbonylContact O-C 3.58Å; Q656-M659 WeakPolarHBondContact O-CB 3.38Å; Q656-M659 PolarHBondContact O-N 3.32Å; Q656-E660 PolarHBondContact NE2-OE1 2.8Å; Q656-E660 WeakPolarHBondContact O-CG 3.31Å; Q656-E660 PolarHBondContact O-N 2.83Å
657	E	88.8	Confident	86.7	Confident	86 Å²	86	56.2 Å²	56.2	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-64	-40.9	-178.5	-172.6	-154.3	160.8	0	0	112.2	K653 A654 M659 E660 T661	K653-E657 WeakPolarHBondContact CA-OE2 3.28Å; K653-E657 HydrophobicContact CB-CB 4.45Å; K653-E657 HydrophobicContact CB-CG 4.43Å; K653-E657 WeakPolarHBondContact CB-OE2 3.28Å; K653-E657 HydrophobicContact CD-CG 4.16Å; K653-E657 VanDerWaalsContact CD-OE1 3.26Å; K653-E657 WeakPolarHBondContact CD-OE1 3.44Å; K653-E657 VanDerWaalsContact CE-OE1 3.27Å; K653-E657 WeakPolarHBondContact CE-OE1 3.4Å; K653-E657 HydrophobicContact CG-CG 4.48Å; K653-E657 VanDerWaalsContact CG-OE1 3.31Å; K653-E657 WeakPolarHBondContact CG-OE1 3.22Å; A654-E657 HydrophobicContact CB-CB 4.16Å; A654-E657 PolarHBondContact N-OE2 3.27Å; A654-E657 WeakPolarHBondContact O-CB 3.26Å; A654-E657 PolarHBondContact O-N 3.4Å; E657-M659 VanDerWaalsContact C-N 3.32Å; E657-M659 PolarHBondContact O-N 2.72Å; E657-E660 CarbonylContact O-C 3.57Å; E657-E660 PolarHBondContact O-N 3.45Å; E657-E660 VanDerWaalsContact O-N 3.15Å; E657-T661 WeakPolarHBondContact O-CB 2.97Å; E657-T661 PolarHBondContact O-N 2.85Å; E657-T661 PolarHBondContact O-OG1 2.88Å
658	A	90.3	Very high	85.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.2	-36.5	174	0	0	0	0	0	111.6	I619 L650 K653 A654 E660 T661 L662	I619-A658 HydrophobicContact CD1-CB 3.9Å; I619-A658 HydrophobicContact CG1-CB 3.69Å; L650-A658 HydrophobicContact CB-CB 4.16Å; L650-A658 HydrophobicContact CD2-CB 4.06Å; K653-A658 HydrophobicContact CB-CB 4.04Å; A654-A658 PolarHBondContact O-N 3.01Å; A658-E660 VanDerWaalsContact C-N 3.34Å; A658-T661 WeakPolarHBondContact O-CB 3.42Å; A658-L662 WeakPolarHBondContact O-CB 3.29Å; A658-L662 PolarHBondContact O-N 2.83Å
659	M	88.1	Confident	84.4	Confident	43 Å²	43	64.2 Å²	64.2	21%	0.212	35%	0.35	C	S	.	.	H	α-helix	trans	-72.8	-24.2	172.3	-73	-68.3	-67.6	0	0	113.1	V605 I619 N655 Q656 E657 L662 R663	V605-M659 HydrophobicContact CB-CE 4.31Å; V605-M659 HydrophobicContact CB-SD 4.13Å; V605-M659 HydrophobicContact CG1-CE 4.45Å; V605-M659 HydrophobicContact CG1-SD 3.64Å; I619-M659 HydrophobicContact CD1-CG 3.86Å; I619-M659 HydrophobicContact CD1-SD 4.2Å; I619-M659 HydrophobicContact CG2-SD 4.43Å; N655-M659 WeakPolarHBondContact O-CB 3.37Å; N655-M659 WeakPolarHBondContact O-CG 3.33Å; Q656-M659 CarbonylContact O-C 3.58Å; Q656-M659 WeakPolarHBondContact O-CB 3.38Å; Q656-M659 PolarHBondContact O-N 3.32Å; E657-M659 VanDerWaalsContact C-N 3.32Å; E657-M659 PolarHBondContact O-N 2.72Å; M659-L662 HydrophobicContact SD-CD2 4.48Å; M659-R663 VanDerWaalsContact O-CG 3.27Å; M659-R663 WeakPolarHBondContact O-CG 3.29Å; M659-R663 PolarHBondContact O-N 3.44Å; M659-R663 PolarHBondContact O-NE 3.47Å; M659-R663 PolarHBondContact O-NH1 3.11Å; M659-R663 VanDerWaalsContact O-NH1 3.12Å
660	E	88.1	Confident	83	Confident	82 Å²	82	63.1 Å²	63.1	38%	0.383	35%	0.347	S	S	.	.	H	α-helix	trans	-78.2	-40.6	171.1	-74.7	176.1	-171.9	0	0	111.9	Q656 E657 A658 R663 R664	Q656-E660 PolarHBondContact NE2-OE1 2.8Å; Q656-E660 WeakPolarHBondContact O-CG 3.31Å; Q656-E660 PolarHBondContact O-N 2.83Å; E657-E660 CarbonylContact O-C 3.57Å; E657-E660 PolarHBondContact O-N 3.45Å; E657-E660 VanDerWaalsContact O-N 3.15Å; A658-E660 VanDerWaalsContact C-N 3.34Å; E660-R663 PolarHBondContact O-N 3.43Å; E660-R663 VanDerWaalsContact O-N 3.17Å; E660-R663 IonicContact OE1-NH2 2.69Å; E660-R664 WeakPolarHBondContact O-CB 3.49Å; E660-R664 PolarHBondContact O-N 2.75Å
661	T	89.7	Confident	82.2	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-53.2	-57	170	-57.5	0	0	0	0	109.8	E648 L650 K653 E657 A658 R663 R664 S665	E648-T661 HydrophobicContact CB-CG2 3.67Å; E648-T661 HydrophobicContact CG-CG2 4.26Å; E648-T661 WeakPolarHBondContact OE2-CG2 3.47Å; L650-T661 HydrophobicContact CD2-CG2 3.72Å; K653-T661 PolarHBondContact NZ-OG1 3.41Å; E657-T661 WeakPolarHBondContact O-CB 2.97Å; E657-T661 PolarHBondContact O-N 2.85Å; E657-T661 PolarHBondContact O-OG1 2.88Å; A658-T661 WeakPolarHBondContact O-CB 3.42Å; T661-R663 VanDerWaalsContact C-N 3.26Å; T661-R663 PolarHBondContact O-N 2.85Å; T661-R664 PolarHBondContact O-N 3.43Å; T661-S665 PolarHBondContact O-N 3.31Å; T661-S665 PolarHBondContact O-OG 2.89Å; T661-S665 VanDerWaalsContact O-OG 3.12Å
662	L	89.7	Confident	81.4	Confident	5 Å²	5	69 Å²	69	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-57.1	-37.1	177.5	178.7	61.8	0	0	0	112.6	L601 V605 L642 V645 A658 M659 M666 I676 L678	L601-L662 HydrophobicContact CD2-CD1 4.32Å; V605-L662 HydrophobicContact CG1-CD2 4.47Å; V605-L662 HydrophobicContact CG2-CD2 4.17Å; L642-L662 HydrophobicContact CD1-CD2 4.02Å; V645-L662 HydrophobicContact CG1-CD1 4.13Å; V645-L662 HydrophobicContact CG2-CD1 3.94Å; A658-L662 WeakPolarHBondContact O-CB 3.29Å; A658-L662 PolarHBondContact O-N 2.83Å; M659-L662 HydrophobicContact SD-CD2 4.48Å; L662-M666 HydrophobicContact CD1-SD 4.48Å; L662-M666 HydrophobicContact CG-CE 4.12Å; L662-M666 WeakPolarHBondContact O-CE 3.46Å; L662-M666 VanDerWaalsContact O-CG 3.3Å; L662-M666 WeakPolarHBondContact O-CG 3.43Å; L662-M666 PolarHBondContact O-N 2.89Å; L662-I676 HydrophobicContact CD1-CD1 4.32Å; L662-L678 HydrophobicContact CD1-CD2 4.46Å
663	R	87.9	Confident	80.9	Confident	106 Å²	106	74 Å²	74	40%	0.4	36%	0.36	S	S	.	.	H	α-helix	trans	-68.8	-40.6	174.8	-78.9	-174.3	-64.7	-94.4	14.1	112.9	M659 E660 T661 M666 S667	M659-R663 VanDerWaalsContact O-CG 3.27Å; M659-R663 WeakPolarHBondContact O-CG 3.29Å; M659-R663 PolarHBondContact O-N 3.44Å; M659-R663 PolarHBondContact O-NE 3.47Å; M659-R663 PolarHBondContact O-NH1 3.11Å; M659-R663 VanDerWaalsContact O-NH1 3.12Å; E660-R663 PolarHBondContact O-N 3.43Å; E660-R663 VanDerWaalsContact O-N 3.17Å; E660-R663 IonicContact OE1-NH2 2.69Å; T661-R663 VanDerWaalsContact C-N 3.26Å; T661-R663 PolarHBondContact O-N 2.85Å; R663-M666 PolarHBondContact O-N 3.16Å; R663-S667 PolarHBondContact O-N 3.01Å; R663-S667 PolarHBondContact O-OG 3.07Å
664	R	87.5	Confident	80.6	Confident	131 Å²	131	72.4 Å²	72.4	49%	0.494	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-49.5	178.1	-167.6	-173.7	-63	131.1	-1	110.2	E648 E660 T661 M666 S667 G670	E648-R664 IonicContact OE1-NH1 2.7Å; E660-R664 WeakPolarHBondContact O-CB 3.49Å; E660-R664 PolarHBondContact O-N 2.75Å; T661-R664 PolarHBondContact O-N 3.43Å; R664-M666 PolarHBondContact O-N 3.45Å; R664-S667 WeakPolarHBondContact O-CB 3.33Å; R664-S667 PolarHBondContact O-N 3.38Å; R664-G670 WeakPolarHBondContact O-CA 3.49Å
665	S	86.2	Confident	80.6	Confident	5 Å²	5	73.4 Å²	73.4	4%	0.035	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.9	178.2	-49.5	0	0	0	0	114.9	V645 T661	V645-S665 VanDerWaalsContact CG1-CB 3.49Å; T661-S665 PolarHBondContact O-N 3.31Å; T661-S665 PolarHBondContact O-OG 2.89Å; T661-S665 VanDerWaalsContact O-OG 3.12Å
666	M	82	Confident	80.7	Confident	66 Å²	66	72.5 Å²	72.5	33%	0.325	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-12.2	169	-73.5	-172.8	-57	0	0	113.8	L593 L601 L662 R663 R664 I676	L593-M666 HydrophobicContact CD1-CB 4.39Å; L593-M666 HydrophobicContact CD1-CG 4.24Å; L601-M666 HydrophobicContact CB-CG 4.44Å; L601-M666 HydrophobicContact CB-SD 3.49Å; L601-M666 WeakPolarHBondContact CB-SD 3.32Å; L601-M666 HydrophobicContact CD2-SD 3.92Å; L601-M666 HydrophobicContact CG-SD 4.37Å; L662-M666 HydrophobicContact CD1-SD 4.48Å; L662-M666 HydrophobicContact CG-CE 4.12Å; L662-M666 WeakPolarHBondContact O-CE 3.46Å; L662-M666 VanDerWaalsContact O-CG 3.3Å; L662-M666 WeakPolarHBondContact O-CG 3.43Å; L662-M666 PolarHBondContact O-N 2.89Å; R663-M666 PolarHBondContact O-N 3.16Å; R664-M666 PolarHBondContact O-N 3.45Å; M666-I676 HydrophobicContact CG-CD1 3.53Å
667	S	76.5	Confident	80.8	Confident	58 Å²	58	70.6 Å²	70.6	41%	0.406	34%	0.339	S	S	.	.	S	Bend	trans	-82	154.9	-179.5	-62.1	0	0	0	0	110.8	R663 R664 E669 G670 N671	R663-S667 PolarHBondContact O-N 3.01Å; R663-S667 PolarHBondContact O-OG 3.07Å; R664-S667 WeakPolarHBondContact O-CB 3.33Å; R664-S667 PolarHBondContact O-N 3.38Å; S667-E669 PolarHBondContact O-N 2.89Å; S667-E669 VanDerWaalsContact O-N 3.12Å; S667-G670 CarbonylContact O-C 3.53Å; S667-G670 PolarHBondContact O-N 2.69Å; S667-N671 PolarHBondContact O-N 3.29Å
668	T	64.1	Low	81.1	Confident	140 Å²	140	66.6 Å²	66.6	86%	0.859	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.7	179.4	45	0	0	0	0	113.8
669	E	62.9	Low	81.2	Confident	162 Å²	162	69 Å²	69	76%	0.757	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-38.8	174.4	-174.3	177.4	-158.6	0	0	113.1	S667	S667-E669 PolarHBondContact O-N 2.89Å; S667-E669 VanDerWaalsContact O-N 3.12Å
670	G	61.1	Low	81.4	Confident	32 Å²	32	67 Å²	67	33%	0.33	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-13.3	-176.8	0	0	0	0	0	115.2	R664 S667	R664-G670 WeakPolarHBondContact O-CA 3.49Å; S667-G670 CarbonylContact O-C 3.53Å; S667-G670 PolarHBondContact O-N 2.69Å
671	N	72.4	Confident	81.6	Confident	20 Å²	20	63.2 Å²	63.2	11%	0.107	31%	0.305	C	S	.	.			trans	-119.5	83.9	173.6	-175.3	9.1	0	0	0	112.1	S667 R673 G674 M675	S667-N671 PolarHBondContact O-N 3.29Å; N671-R673 VanDerWaalsContact C-N 3.29Å; N671-R673 PolarHBondContact O-N 3.46Å; N671-R673 PolarHBondContact OD1-N 3.46Å; N671-R673 VanDerWaalsContact OD1-N 3.09Å; N671-G674 VanDerWaalsContact ND2-C 3.28Å; N671-G674 PolarHBondContact OD1-N 3.31Å; N671-M675 PolarHBondContact ND2-N 2.86Å; N671-M675 PolarHBondContact ND2-O 2.83Å; N671-M675 PolarHBondContact OD1-N 3.42Å; N671-M675 PolarHBondContact OD1-O 3.4Å
672	K	67.6	Low	81.6	Confident	196 Å²	196	64.4 Å²	64.4	85%	0.852	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-9	173	-60.3	-177.1	-179	-179.1	0	114
673	R	70.8	Confident	81.3	Confident	198 Å²	198	74.1 Å²	74.1	75%	0.747	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-12.6	-176.7	-69.8	-173.4	176	-171.1	-0.7	113.8	N671 M675	N671-R673 VanDerWaalsContact C-N 3.29Å; N671-R673 PolarHBondContact O-N 3.46Å; N671-R673 PolarHBondContact OD1-N 3.46Å; N671-R673 VanDerWaalsContact OD1-N 3.09Å; R673-M675 PolarHBondContact O-N 2.83Å
674	G	78.8	Confident	80.4	Confident	7 Å²	7	71.3 Å²	71.3	7%	0.072	34%	0.338	C	S	.	.	S	Bend	trans	71.8	2.2	-169.9	0	0	0	0	0	114.6	L593 N594 N671	L593-G674 PolarHBondContact N-O 2.84Å; N594-G674 WeakPolarHBondContact OD1-CA 3.48Å; N594-G674 PolarHBondContact OD1-O 2.93Å; N671-G674 VanDerWaalsContact ND2-C 3.28Å; N671-G674 PolarHBondContact OD1-N 3.31Å
675	M	85.2	Confident	79.1	Confident	69 Å²	69	70.8 Å²	70.8	34%	0.34	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.2	-179	-56.7	-166.9	-71	0	0	110.6	E590 V591 P592 N671 R673	E590-M675 HydrophobicContact CG-CB 3.88Å; E590-M675 HydrophobicContact CG-CE 4.22Å; E590-M675 HydrophobicContact CG-SD 4.04Å; E590-M675 WeakPolarHBondContact OE1-CE 3.04Å; V591-M675 CarbonylContact O-C 3.55Å; V591-M675 WeakPolarHBondContact O-CA 3.3Å; P592-M675 HydrophobicContact CB-CG 4.43Å; N671-M675 PolarHBondContact ND2-N 2.86Å; N671-M675 PolarHBondContact ND2-O 2.83Å; N671-M675 PolarHBondContact OD1-N 3.42Å; N671-M675 PolarHBondContact OD1-O 3.4Å; R673-M675 PolarHBondContact O-N 2.83Å
676	I	89.2	Confident	77.2	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.3	175.8	-167.1	169.4	0	0	0	110	V591 L593 L601 V645 N646 L662 M666 L678	V591-I676 HydrophobicContact CB-CG2 4.1Å; V591-I676 PolarHBondContact N-O 2.84Å; V591-I676 PolarHBondContact O-N 3.39Å; L593-I676 HydrophobicContact CD1-CB 4.06Å; L593-I676 HydrophobicContact CD1-CG2 4.01Å; L593-I676 HydrophobicContact CD2-CG2 3.75Å; L593-I676 HydrophobicContact CG-CB 4.23Å; L593-I676 HydrophobicContact CG-CG2 3.83Å; L601-I676 HydrophobicContact CD1-CG2 3.87Å; L601-I676 HydrophobicContact CD2-CD1 4.5Å; L601-I676 HydrophobicContact CD2-CG2 4.48Å; V645-I676 HydrophobicContact CG1-CD1 3.65Å; V645-I676 HydrophobicContact CG1-CG1 3.79Å; N646-I676 WeakPolarHBondContact OD1-CA 3.46Å; N646-I676 WeakPolarHBondContact OD1-CG1 3.34Å; L662-I676 HydrophobicContact CD1-CD1 4.32Å; M666-I676 HydrophobicContact CG-CD1 3.53Å; I676-L678 HydrophobicContact CD1-CD2 4.3Å; I676-L678 HydrophobicContact CG1-CD2 4.14Å
677	Q	91.1	Very high	74.8	Confident	75 Å²	75	79.4 Å²	79.4	35%	0.35	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.4	174.9	-167.4	-174.5	44.8	0	0	108.9	T588 F589 V645 N646	T588-Q677 HydrophobicContact CG2-CG 3.88Å; F589-Q677 CarbonylContact O-C 3.56Å; F589-Q677 WeakPolarHBondContact O-CA 3.47Å; V645-Q677 CarbonylContact C-O 3.53Å; V645-Q677 VanDerWaalsContact CA-O 3.3Å; V645-Q677 WeakPolarHBondContact CA-O 3.36Å; N646-Q677 PolarHBondContact N-O 2.79Å; N646-Q677 PolarHBondContact OD1-N 2.71Å
678	L	93.2	Very high	72.7	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.005	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.2	179.4	-58.3	175.3	0	0	0	108.7	T588 F589 V591 L601 L636 V645 L662 I676 V680	T588-L678 WeakPolarHBondContact CA-O 3.47Å; F589-L678 PolarHBondContact N-O 2.92Å; F589-L678 PolarHBondContact O-N 3Å; V591-L678 HydrophobicContact CG2-CD1 4.38Å; L601-L678 HydrophobicContact CD1-CD1 4.28Å; L601-L678 HydrophobicContact CD2-CD1 4.13Å; L636-L678 HydrophobicContact CD1-CD1 4.44Å; V645-L678 HydrophobicContact CB-CD2 4.46Å; V645-L678 HydrophobicContact CG1-CD2 4.07Å; V645-L678 HydrophobicContact CG2-CD2 3.97Å; L662-L678 HydrophobicContact CD1-CD2 4.46Å; I676-L678 HydrophobicContact CD1-CD2 4.3Å; I676-L678 HydrophobicContact CG1-CD2 4.14Å; L678-V680 HydrophobicContact CB-CG2 4.3Å
679	I	93.5	Very high	71.1	Confident	51 Å²	51	81.5 Å²	81.5	26%	0.262	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.1	165.3	-54	-176.7	0	0	0	107.6	F586 T588 I643 A644	F586-I679 HydrophobicContact CD1-CG2 4.34Å; T588-I679 HydrophobicContact CG2-CG1 4.46Å; I643-I679 HydrophobicContact CB-CB 4.3Å; I643-I679 HydrophobicContact CB-CG2 4.11Å; I643-I679 WeakPolarHBondContact CB-O 3.15Å; I643-I679 HydrophobicContact CG2-CG2 4.13Å; I643-I679 PolarHBondContact N-O 3.05Å; A644-I679 HydrophobicContact CB-CB 4.02Å; A644-I679 HydrophobicContact CB-CD1 4Å; A644-I679 HydrophobicContact CB-CG1 4.08Å; A644-I679 PolarHBondContact N-O 3.19Å; A644-I679 PolarHBondContact O-N 3.3Å
680	V	93.1	Very high	69.8	Low	0 Å²	0	80.9 Å²	80.9	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.6	-168.6	175	0	0	0	0	110.3	F586 L587 F589 L636 D640 Q641 L642 L678	F586-V680 CarbonylContact C-O 3.52Å; F586-V680 VanDerWaalsContact CA-O 3.27Å; F586-V680 WeakPolarHBondContact CA-O 3.31Å; L587-V680 PolarHBondContact N-O 3.39Å; L587-V680 PolarHBondContact O-N 3.27Å; F589-V680 HydrophobicContact CD2-CB 4.43Å; F589-V680 HydrophobicContact CD2-CG2 3.82Å; F589-V680 HydrophobicContact CE2-CB 4.06Å; F589-V680 HydrophobicContact CE2-CG1 4.36Å; F589-V680 HydrophobicContact CE2-CG2 3.88Å; L636-V680 HydrophobicContact CD1-CG2 3.79Å; D640-V680 HydrophobicContact CB-CG1 3.54Å; Q641-V680 CarbonylContact O-C 3.51Å; Q641-V680 VanDerWaalsContact O-CA 3.28Å; Q641-V680 WeakPolarHBondContact O-CA 3.32Å; L642-V680 HydrophobicContact CD2-CG2 3.98Å; L678-V680 HydrophobicContact CB-CG2 4.3Å
681	A	91.2	Very high	68.2	Low	4 Å²	4	90.2 Å²	90.2	3%	0.033	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.7	167.3	0	0	0	0	0	110.6	R584 E585 F586 Q641 I643	R584-A681 HydrophobicContact CB-CB 4.35Å; E585-A681 WeakPolarHBondContact O-CA 3.43Å; F586-A681 HydrophobicContact CD1-CB 3.94Å; F586-A681 HydrophobicContact CE1-CB 3.92Å; Q641-A681 HydrophobicContact CB-CB 4.31Å; Q641-A681 WeakPolarHBondContact CB-O 3.32Å; Q641-A681 PolarHBondContact N-O 3.19Å; Q641-A681 PolarHBondContact O-N 2.91Å; I643-A681 HydrophobicContact CD1-CB 3.71Å; I643-A681 HydrophobicContact CG1-CB 3.68Å
682	R	90.1	Very high	66.2	Low	27 Å²	27	94.9 Å²	94.9	10%	0.102	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.6	175.9	-172.4	178.4	-61.3	145.9	-3.1	109.4	R584 E585 R635 D640 I684	R584-R682 CarbonylContact C-O 3.6Å; R584-R682 WeakPolarHBondContact CA-O 3.45Å; R584-R682 VanDerWaalsContact CB-O 3.29Å; R584-R682 WeakPolarHBondContact CB-O 3.34Å; E585-R682 HydrophobicContact CG-CB 3.85Å; E585-R682 PolarHBondContact N-O 3.08Å; E585-R682 PolarHBondContact O-N 3.49Å; E585-R682 VanDerWaalsContact OE1-CD 3.31Å; E585-R682 WeakPolarHBondContact OE1-CD 3.31Å; E585-R682 IonicContact OE1-NH1 2.82Å; R635-R682 PolarHBondContact O-NH2 3.47Å; D640-R682 IonicContact OD1-CZ 3.71Å; D640-R682 IonicContact OD1-NE 3.58Å; D640-R682 PolarHBondContact OD1-NE 3.23Å; D640-R682 IonicContact OD1-NH2 2.71Å; D640-R682 IonicContact OD2-CZ 3.89Å; D640-R682 IonicContact OD2-NE 2.87Å; D640-R682 IonicContact OD2-NH2 2.65Å; D640-R682 PolarHBondContact OD2-NH2 3.45Å; R682-I684 PolarHBondContact O-N 2.71Å
683	R	82.2	Confident	64.7	Low	209 Å²	209	91.8 Å²	91.8	79%	0.789	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.9	178.6	-75.3	-178.2	67.4	179.6	1.2	110.4	T583 R584	T583-R683 WeakPolarHBondContact O-CA 3.13Å; R584-R683 HydrophobicContact CG-CG 4.13Å
684	I	70.4	Confident	62.7	Low	46 Å²	46	85.7 Å²	85.7	24%	0.236	46%	0.458	C	S	.	.			trans	-83.5	123.7	175.1	-54.5	165	0	0	0	108.4	L578 T583 R584 E585 R682 R686	L578-I684 HydrophobicContact CD2-CD1 3.35Å; T583-I684 PolarHBondContact O-N 3.22Å; R584-I684 VanDerWaalsContact C-CD1 3.46Å; E585-I684 HydrophobicContact CB-CD1 3.9Å; E585-I684 HydrophobicContact CB-CG1 3.77Å; E585-I684 HydrophobicContact CG-CG1 3.96Å; R682-I684 PolarHBondContact O-N 2.71Å; I684-R686 HydrophobicContact CB-CG 4.21Å; I684-R686 HydrophobicContact CG2-CG 3.62Å; I684-R686 PolarHBondContact O-N 2.8Å
685	S	59.1	Low	60.4	Low	121 Å²	121	91.2 Å²	91.2	85%	0.846	50%	0.495	S	S	*	.			trans	-78.5	68.8	169.3	-63.7	0	0	0	0	110.5	C687	S685-C687 PolarHBondContact O-N 2.79Å; S685-C687 VanDerWaalsContact O-N 3.07Å
686	R	46.4	Very low	58	Low	118 Å²	118	93.8 Å²	93.8	45%	0.445	52%	0.517	S	S	.	.			trans	-64.1	109.3	178	-67.8	-167.2	-166.4	-105.5	-5.8	110.7	L578 G582 I684	L578-R686 VanDerWaalsContact CD1-NH2 3.3Å; G582-R686 PolarHBondContact O-NE 2.94Å; G582-R686 PolarHBondContact O-NH2 3.38Å; I684-R686 HydrophobicContact CB-CG 4.21Å; I684-R686 HydrophobicContact CG2-CG 3.62Å; I684-R686 PolarHBondContact O-N 2.8Å
687	C	31.7	Very low	55	Low	133 Å²	133	98.2 Å²	98.2	90%	0.899	55%	0.554	S	S	*	*			trans	-105	124.5	153.4	-157.8	0	0	0	0	106.4	S685	S685-C687 PolarHBondContact O-N 2.79Å; S685-C687 VanDerWaalsContact O-N 3.07Å
688	N	31.8	Very low	52.4	Low	97 Å²	97	99.3 Å²	99.3	52%	0.519	58%	0.576	S	S	.	*			trans	-121.3	109	-145.2	-170.6	96.6	0	0	0	114.6
689	E	31.3	Very low	49.6	Very low	145 Å²	145	104.6 Å²	104.6	68%	0.678	61%	0.61	S	S	*	*			trans	58.3	150.4	144.6	-51.1	-179.8	176.8	0	0	118.2
690	L	35.4	Very low	46.6	Very low	150 Å²	150	110.3 Å²	110.3	79%	0.785	64%	0.636	S	S	*	*				-152.1	110.7	60.7	-76.8	164.9	0	0	0	114.4
691	R	28.3	Very low	43.8	Very low	227 Å²	227	117.4 Å²	117.4	86%	0.857	67%	0.673	S	S	*	*				48.3	114.8	121.7	-167.8	178.9	-167	161.4	4.5	121.4
692	S	30	Very low	41.1	Very low	119 Å²	119	121.5 Å²	121.5	83%	0.832	70%	0.699	S	S	*	*				-167.1	154.3	121.3	-80.3	0	0	0	0	112.6
693	P	35.9	Very low	38.5	Very low	131 Å²	131	127.4 Å²	127.4	85%	0.851	73%	0.731	S	S	*	*			trans	-128.1	160.6	-161.4	40.2	-24.6	0	0	0	117.7
694	G	28.3	Very low	36.2	Very low	70 Å²	70	124.9 Å²	124.9	72%	0.722	73%	0.728	S	S	*	*			trans	165.8	96.9	160.9	0	0	0	0	0	120.5
695	S	30.2	Very low	34.6	Very low	122 Å²	122	126.9 Å²	126.9	85%	0.853	74%	0.743	S	S	*	*			trans	74.6	167	142.2	-43.8	0	0	0	0	119.5
696	P	34.8	Very low	33.6	Very low	123 Å²	123	129 Å²	129	80%	0.799	74%	0.74	S	S	*	*				-143.1	176.1	-93.6	38.6	-16.5	0	0	0	119.1
697	A	27.9	Very low	33.2	Very low	94 Å²	94	130.6 Å²	130.6	78%	0.777	76%	0.756	S	S	*	*			trans	64.9	121.9	160.8	0	0	0	0	0	119.2
698	A	35.4	Very low	33.5	Very low	97 Å²	97	132.1 Å²	132.1	80%	0.802	76%	0.755	S	S	*	*				86.3	147.9	55.8	0	0	0	0	0	113.6
699	P	35.6	Very low	33.9	Very low	113 Å²	113	133.3 Å²	133.3	73%	0.734	76%	0.762	S	S	*	*			cis	-134.2	163.5	18.3	42.9	-26.2	0	0	0	118.7
700	E	30.4	Very low	34.4	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.794	76%	0.758	S	S	*	*			trans	51.4	119.4	139.7	-66.2	-168.6	163.2	0	0	122.3
701	L	34.1	Very low	34.5	Very low	149 Å²	149	133 Å²	133	78%	0.78	75%	0.749	S	S	*	*				100.8	166.3	58.8	-88.4	-173.2	0	0	0	112
702	P	33.7	Very low	35.1	Very low	91 Å²	91	132.5 Å²	132.5	59%	0.591	75%	0.747	S	S	*	*			cis	-140.3	166.9	-16.4	34.3	-14.5	0	0	0	117.9
703	I	36.4	Very low	35.5	Very low	150 Å²	150	138.6 Å²	138.6	77%	0.769	75%	0.752	S	S	*	*			trans	64.9	153.7	140.4	-69.8	167.8	0	0	0	119.2
704	E	32.8	Very low	35.3	Very low	156 Å²	156	139 Å²	139	73%	0.729	75%	0.746	S	S	*	*			cis	-176.7	176.6	-26.5	-89.1	-147	83.1	0	0	107.9
705	T	37.3	Very low	35.3	Very low	88 Å²	88	140.3 Å²	140.3	54%	0.54	74%	0.744	S	S	.	*			cis	-167.3	-139.3	-29.9	-74.2	0	0	0	0	106.6	L707	T705-L707 HydrophobicContact CG2-CD1 4.15Å
706	E	38.2	Very low	35.7	Very low	166 Å²	166	144 Å²	144	78%	0.776	75%	0.748	S	S	*	*			trans	62.4	112.8	174.4	-50.9	-63.2	74.7	0	0	118.2
707	L	37.4	Very low	35.5	Very low	151 Å²	151	143.2 Å²	143.2	79%	0.791	75%	0.745	S	S	*	*			cis	89	132.9	15.9	-54.5	177.3	0	0	0	118.6	T705	T705-L707 HydrophobicContact CG2-CD1 4.15Å
708	D	38.2	Very low	36	Very low	165 Å²	165	146.8 Å²	146.8	88%	0.882	75%	0.75	S	S	*	*			trans	-151.7	164	157.5	-167.8	15.4	0	0	0	109.3
709	D	40.6	Very low	35.8	Very low	122 Å²	122	153 Å²	153	65%	0.652	75%	0.754	S	S	*	*			trans	-134.2	175.7	-144.2	-169.3	20.6	0	0	0	116
710	R	41	Very low	35.6	Very low	158 Å²	158	153.4 Å²	153.4	60%	0.596	76%	0.76	S	S	*	*			trans	87.9	64.7	154.4	-85.4	157.3	-163.9	-158.1	-11.4	122.8	N626	N626-R710 PolarHBondContact ND2-NH2 3.18Å
711	E	37.5	Very low	36	Very low	131 Å²	131	147.8 Å²	147.8	61%	0.612	75%	0.748	S	S	*	*			trans	-46.7	160.4	134.9	-168.3	-166.4	-109.4	0	0	115
712	R	41.7	Very low	36.4	Very low	216 Å²	216	148.9 Å²	148.9	82%	0.815	75%	0.752	S	S	*	*			trans	116.9	112.7	145	-63	-176.3	-179.9	137.2	27.8	120.2
713	R	39.1	Very low	36.6	Very low	247 Å²	247	154.1 Å²	154.1	93%	0.932	77%	0.769	S	S	*	*				-164.6	108.7	128	-124.5	176.4	174.6	135.1	0.2	114.2
714	I	30.4	Very low	36.9	Very low	139 Å²	139	150.6 Å²	150.6	71%	0.713	77%	0.77	S	S	*	*			trans	-134.8	162	160.9	-43.5	179	0	0	0	109.1
715	S	29.3	Very low	37.3	Very low	99 Å²	99	151.1 Å²	151.1	69%	0.692	78%	0.776	S	S	*	*			trans	-54.4	158.5	-172.9	56.5	0	0	0	0	117.5
716	H	37.7	Very low	37.1	Very low	200 Å²	200	153.6 Å²	153.6	93%	0.926	79%	0.787	S	S	*	*			trans	-107	125.7	144.2	-78	-71.3	0	0	0	109.5
717	S	30.6	Very low	37	Very low	105 Å²	105	153.8 Å²	153.8	73%	0.734	79%	0.787	S	S	*	*			trans	-132.1	126.8	155	174.9	0	0	0	0	107.3
718	L	37.8	Very low	36.7	Very low	170 Å²	170	150.9 Å²	150.9	89%	0.89	78%	0.78	S	S	*	*			trans	-160.9	130.4	152.6	-85.8	-164.8	0	0	0	108.8
719	Y	32.5	Very low	36.6	Very low	227 Å²	227	148.6 Å²	148.6	89%	0.89	77%	0.774	S	S	*	*			trans	-138.5	122	146.4	-159.9	-86.8	0	0	0	107.2
720	S	31.2	Very low	36.3	Very low	122 Å²	122	149.1 Å²	149.1	85%	0.853	78%	0.782	S	S	*	*			trans	-153.4	122.9	165.5	-167.8	0	0	0	0	109.6
721	G	38.2	Very low	36	Very low	52 Å²	52	151.6 Å²	151.6	54%	0.536	79%	0.791	S	S	.	*			trans	-152.3	158.4	160.5	0	0	0	0	0	105
722	I	43.8	Very low	35.5	Very low	172 Å²	172	151.5 Å²	151.5	88%	0.882	80%	0.795	S	S	*	*			cis	-149.5	168.8	15.8	42	174.7	0	0	0	109.3
723	E	37.6	Very low	34.9	Very low	201 Å²	201	145.9 Å²	145.9	94%	0.939	80%	0.795	S	S	*	*			trans	-82.9	159.6	179	-62.1	166.3	131.1	0	0	112
724	G	41.4	Very low	34.5	Very low	76 Å²	76	138.3 Å²	138.3	78%	0.784	79%	0.785	S	S	*	*			trans	-176.6	101.5	177.6	0	0	0	0	0	114.2
725	L	41.7	Very low	34.7	Very low	166 Å²	166	139.3 Å²	139.3	87%	0.869	79%	0.791	S	S	*	*			trans	-10.4	130.5	162.8	-60.7	158.3	0	0	0	116.9
726	D	33.2	Very low	34.8	Very low	141 Å²	141	138.4 Å²	138.4	75%	0.754	79%	0.785	S	S	*	*			cis	90.5	106.1	49.4	-174.2	31.7	0	0	0	114.3
727	E	35.4	Very low	34.9	Very low	169 Å²	169	139.4 Å²	139.4	79%	0.79	78%	0.78	S	S	*	*			trans	-165.2	146.2	135.1	-121.6	-150.8	81.1	0	0	114.6
728	S	31.9	Very low	35.3	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	78%	0.777	S	S	*	*			trans	44.4	111.1	144.3	-65	0	0	0	0	123.1
729	P	36.7	Very low	35.2	Very low	117 Å²	117	138.9 Å²	138.9	76%	0.76	77%	0.766	S	S	*	*			trans	-108.4	138.2	169.6	36.8	-28.8	0	0	0	114.5
730	T	33.4	Very low	35.5	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	76%	0.762	S	S	*	*			trans	-162.6	148.6	154.7	-7.8	0	0	0	0	117
731	R	33.9	Very low	35.9	Very low	209 Å²	209	132.6 Å²	132.6	79%	0.789	75%	0.75	S	S	*	*			trans	64.7	123.8	149.1	-90.6	-179	141.1	80.1	0.4	122
732	N	28.8	Very low	35.7	Very low	129 Å²	129	136 Å²	136	69%	0.69	76%	0.764	S	S	*	*			trans	76.1	82.6	131.6	-65.5	5.3	0	0	0	121
733	A	29	Very low	35.3	Very low	99 Å²	99	135.1 Å²	135.1	82%	0.818	76%	0.756	S	S	*	*				62.7	166.9	100.2	0	0	0	0	0	121.8
734	A	30.3	Very low	35.1	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	75%	0.746	S	S	*	*			trans	84.5	102.8	163.2	0	0	0	0	0	119.3
735	L	33.8	Very low	34.6	Very low	159 Å²	159	132.3 Å²	132.3	83%	0.832	74%	0.735	S	S	*	*			trans	76	99.7	130.5	-59.3	173.9	0	0	0	120.1
736	S	31.4	Very low	34.4	Very low	80 Å²	80	129.9 Å²	129.9	56%	0.559	73%	0.729	S	S	*	*				115.8	134.2	93.9	-83.9	0	0	0	0	120.7
737	R	39.7	Very low	34.3	Very low	221 Å²	221	129.1 Å²	129.1	83%	0.834	73%	0.73	S	S	*	*			trans	78.5	145.9	141.6	-72	-179.2	-75.8	-150.9	-1.4	119.6
738	I	39.6	Very low	34.2	Very low	130 Å²	130	127.2 Å²	127.2	67%	0.667	73%	0.73	S	S	*	*			cis	-163.1	140.8	-35.1	-126.2	173.7	0	0	0	111.9
739	M	35.2	Very low	34.3	Very low	134 Å²	134	130.1 Å²	130.1	66%	0.66	74%	0.738	S	S	*	*			trans	31.3	116.4	157.5	-59.7	-178.8	-75.1	0	0	123.9	K741	M739-K741 WeakPolarHBondContact O-CE 3.41Å; M739-K741 PolarHBondContact O-NZ 2.91Å
740	G	39.7	Very low	34.8	Very low	78 Å²	78	132.6 Å²	132.6	80%	0.804	74%	0.742	S	S	*	*				73.7	-170.6	121.9	0	0	0	0	0	119.2
741	K	39.4	Very low	35.3	Very low	140 Å²	140	130.7 Å²	130.7	61%	0.609	73%	0.731	S	S	*	*			cis	-135.8	-178.1	1.2	-60.4	84	-175.2	158.4	0	109.4	M739	M739-K741 WeakPolarHBondContact O-CE 3.41Å; M739-K741 PolarHBondContact O-NZ 2.91Å
742	C	34.7	Very low	35.5	Very low	122 Å²	122	128.1 Å²	128.1	82%	0.824	73%	0.728	S	S	*	*	S	Bend		-163.3	135.2	74.6	-83.5	0	0	0	0	110.1
743	Q	35.2	Very low	35.8	Very low	154 Å²	154	128.2 Å²	128.2	72%	0.72	73%	0.729	S	S	*	*	S	Bend	cis	-142.3	173.8	-9.3	-66.4	-154.5	80	0	0	107.6
744	L	33.7	Very low	36.1	Very low	138 Å²	138	131.4 Å²	131.4	72%	0.723	73%	0.732	S	S	*	*			cis	-111.7	-178.3	4.5	-76	166.1	0	0	0	109.8
745	S	29.3	Very low	36.3	Very low	80 Å²	80	132 Å²	132	56%	0.559	73%	0.727	S	S	*	*			cis	85.2	146	21	-30.8	0	0	0	0	113.8
746	P	37.8	Very low	36.6	Very low	115 Å²	115	131.3 Å²	131.3	75%	0.747	73%	0.729	S	S	*	*				-143.8	166.7	-95.1	35.3	-13.7	0	0	0	119
747	T	31.8	Very low	36.7	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	74%	0.737	S	S	*	*			trans	36.4	116.3	138.5	-50	0	0	0	0	121.6
748	V	33.6	Very low	36.6	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	73%	0.734	S	S	*	*			trans	62.1	107.9	151.1	178.3	0	0	0	0	118.2
749	N	33.2	Very low	36.7	Very low	153 Å²	153	133.4 Å²	133.4	82%	0.818	74%	0.741	S	S	*	*				-157	158.6	111.7	-128.7	-11.7	0	0	0	111.5
750	M	48.1	Very low	36.9	Very low	169 Å²	169	132 Å²	132	83%	0.833	74%	0.736	S	S	*	*			trans	-146	121.2	174.1	-178.6	69.6	73.5	0	0	109
751	P	43.5	Very low	36.8	Very low	92 Å²	92	135.6 Å²	135.6	60%	0.597	74%	0.737	S	S	*	*			trans	-142.7	138.4	142.8	29.2	-11	0	0	0	114.6
752	H	37.6	Very low	36.4	Very low	155 Å²	155	137.3 Å²	137.3	72%	0.718	74%	0.74	S	S	*	*			trans	49.4	124.4	139.6	-57.2	98	0	0	0	121.4
753	D	34.4	Very low	36.7	Very low	132 Å²	132	138.5 Å²	138.5	71%	0.706	74%	0.737	S	S	*	*				51	115.8	128.3	-44.3	-26.4	0	0	0	119
754	D	37.2	Very low	36.8	Very low	166 Å²	166	136.7 Å²	136.7	89%	0.888	74%	0.739	S	S	*	*				-137.8	148.1	108.8	-141.1	-24.9	0	0	0	111
755	T	33.8	Very low	36.7	Very low	100 Å²	100	135.1 Å²	135.1	61%	0.613	74%	0.735	S	S	*	*			trans	-109.2	118.1	-171.2	-65.4	0	0	0	0	111.3	M757	T755-M757 HydrophobicContact CG2-CG 3.79Å
756	V	40.4	Very low	36.7	Very low	145 Å²	145	138.9 Å²	138.9	88%	0.879	75%	0.748	S	S	*	*			trans	-123.4	116.4	157.4	-171.9	0	0	0	0	108.5
757	M	33	Very low	36.9	Very low	150 Å²	150	138.6 Å²	138.6	74%	0.739	75%	0.746	S	S	*	*			trans	-84.9	-165.1	177.5	-65.7	-100.6	-72.5	0	0	110.2	T755	T755-M757 HydrophobicContact CG2-CG 3.79Å
758	I	37.2	Very low	37.4	Very low	147 Å²	147	136.9 Å²	136.9	75%	0.754	74%	0.737	S	S	*	*			trans	83.1	111	168.3	-51.9	162.5	0	0	0	111.9
759	E	42	Very low	37.3	Very low	178 Å²	178	138.4 Å²	138.4	83%	0.832	74%	0.735	S	S	*	*			cis	-148.6	149.8	2.3	-135.4	147.7	-145.2	0	0	113
760	D	39.9	Very low	37.2	Very low	103 Å²	103	139 Å²	139	55%	0.551	74%	0.737	S	S	*	*			trans	-97.5	113.7	172.4	164.1	33.6	0	0	0	108.1	R762	D760-R762 WeakPolarHBondContact OD1-CG 3.32Å; D760-R762 IonicContact OD1-NE 3.82Å; D760-R762 IonicContact OD2-CZ 3.28Å; D760-R762 VanDerWaalsContact OD2-CZ 3.28Å; D760-R762 IonicContact OD2-NE 2.78Å; D760-R762 PolarHBondContact OD2-NE 3.28Å; D760-R762 IonicContact OD2-NH2 2.86Å; D760-R762 PolarHBondContact OD2-NH2 2.86Å
761	D	37.7	Very low	36.4	Very low	154 Å²	154	134.9 Å²	134.9	82%	0.824	73%	0.726	S	S	*	*			trans	-137.4	65.3	171.4	-137.7	13.3	0	0	0	113.2
762	R	29.7	Very low	36	Very low	176 Å²	176	136.7 Å²	136.7	66%	0.664	73%	0.73	S	S	*	*				36.8	122.2	118.9	-57	-176.1	177.7	-152.1	-5.1	119.3	D760	D760-R762 WeakPolarHBondContact OD1-CG 3.32Å; D760-R762 IonicContact OD1-NE 3.82Å; D760-R762 IonicContact OD2-CZ 3.28Å; D760-R762 VanDerWaalsContact OD2-CZ 3.28Å; D760-R762 IonicContact OD2-NE 2.78Å; D760-R762 PolarHBondContact OD2-NE 3.28Å; D760-R762 IonicContact OD2-NH2 2.86Å; D760-R762 PolarHBondContact OD2-NH2 2.86Å
763	L	41.6	Very low	35.8	Very low	148 Å²	148	137.2 Å²	137.2	78%	0.775	73%	0.733	S	S	*	*				29.2	138	115.3	-56.8	178.8	0	0	0	118.6	V765	L763-V765 HydrophobicContact CD2-CG2 4.3Å
764	P	36.7	Very low	35.6	Very low	116 Å²	116	135 Å²	135	75%	0.753	73%	0.728	S	S	*	*			cis	-141.2	155.8	47.8	39.7	-20.5	0	0	0	114.9
765	V	32.4	Very low	35.3	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.636	72%	0.722	S	S	*	*				44.9	108.3	77.9	-160.4	0	0	0	0	114.5	L763	L763-V765 HydrophobicContact CD2-CG2 4.3Å
766	L	29.8	Very low	35.1	Very low	158 Å²	158	132.5 Å²	132.5	83%	0.827	73%	0.728	S	S	*	*				169.3	156.8	125.4	-86.8	176.5	0	0	0	109.9
767	P	40.4	Very low	34.7	Very low	109 Å²	109	130.8 Å²	130.8	71%	0.708	72%	0.722	S	S	*	*			trans	-118.9	-102	-135.5	20.7	4.2	0	0	0	117.6
768	P	42.8	Very low	34.6	Very low	90 Å²	90	128 Å²	128	58%	0.584	72%	0.718	S	S	*	*			trans	-109.3	-172.5	-135.3	25.2	-4	0	0	0	114
769	H	30.9	Very low	34.6	Very low	161 Å²	161	127.8 Å²	127.8	75%	0.745	71%	0.713	S	S	*	*			trans	104.9	128.1	157	-57.5	-68.9	0	0	0	117.1
770	L	32.8	Very low	34.5	Very low	164 Å²	164	127.7 Å²	127.7	86%	0.859	72%	0.718	S	S	*	*			trans	68.7	151.4	153.6	-61.1	163.5	0	0	0	116
771	S	31.1	Very low	34.3	Very low	84 Å²	84	128.3 Å²	128.3	59%	0.587	72%	0.721	S	S	*	*			cis	-158.4	-179.9	-30.4	-131.9	0	0	0	0	108.9
772	D	33.8	Very low	34.2	Very low	130 Å²	130	127.4 Å²	127.4	70%	0.695	72%	0.721	S	S	*	*			trans	-19.1	135	156	-37.7	-86.1	0	0	0	116.3
773	Q	34.6	Very low	34.4	Very low	165 Å²	165	122.2 Å²	122.2	77%	0.771	72%	0.722	S	S	*	*				-172	113.9	116.6	-93	-49.2	-50.3	0	0	111.8
774	S	30.1	Very low	33.8	Very low	87 Å²	87	124.9 Å²	124.9	61%	0.608	73%	0.728	S	S	*	*			trans	57.5	106.5	132.3	-64.3	0	0	0	0	123.4
775	S	31.1	Very low	33.8	Very low	108 Å²	108	125.8 Å²	125.8	76%	0.755	73%	0.725	S	S	*	*				84.5	159.9	107.8	-58.8	0	0	0	0	122.2
776	S	29.3	Very low	33.9	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	73%	0.733	S	S	*	*			trans	68	130.6	-179.3	-62.3	0	0	0	0	114.6
777	S	30.9	Very low	34.3	Very low	109 Å²	109	126.7 Å²	126.7	76%	0.762	73%	0.728	S	S	*	*			cis	69.6	145.9	42.1	94.9	0	0	0	0	112.5
778	S	31.9	Very low	34.1	Very low	92 Å²	92	130 Å²	130	64%	0.643	73%	0.734	S	S	*	*			cis	-155.3	164.2	14.3	57.7	0	0	0	0	112
779	H	36.9	Very low	33.7	Very low	142 Å²	142	130.5 Å²	130.5	66%	0.657	75%	0.746	S	S	*	*			trans	59	136	156.8	-91.1	-86.4	0	0	0	119.1	D781	H779-D781 IonicContact CE1-OD2 3.87Å; H779-D781 WeakPolarHBondContact ND1-CB 3.5Å
780	D	39.9	Very low	34.3	Very low	175 Å²	175	125.8 Å²	125.8	94%	0.936	74%	0.741	S	S	*	*				-135.6	134.8	105.3	-95.8	-42.6	0	0	0	107.7
781	D	35.3	Very low	34.5	Very low	116 Å²	116	123.5 Å²	123.5	62%	0.62	73%	0.734	S	S	*	*			trans	-142.1	179.5	-179.3	-167.9	9.5	0	0	0	108.5	H779 G783	H779-D781 IonicContact CE1-OD2 3.87Å; H779-D781 WeakPolarHBondContact ND1-CB 3.5Å; D781-G783 PolarHBondContact O-N 3.47Å
782	V	35.6	Very low	34.7	Very low	135 Å²	135	131 Å²	131	82%	0.818	75%	0.75	S	S	*	*	S	Bend	trans	-59.1	113.2	-167.5	-68.4	0	0	0	0	115.7
783	G	35.2	Very low	34.8	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	75%	0.747	S	S	*	*				101.5	141.7	126.4	0	0	0	0	0	120.9	D781	D781-G783 PolarHBondContact O-N 3.47Å
784	F	29.2	Very low	34.6	Very low	204 Å²	204	130.3 Å²	130.3	90%	0.895	75%	0.753	S	S	*	*			trans	73.1	110.7	141	-109.1	-103.9	0	0	0	120.5
785	I	35.5	Very low	34.8	Very low	136 Å²	136	131.1 Å²	131.1	70%	0.697	77%	0.765	S	S	*	*				169	124.3	108.6	-87.1	164.3	0	0	0	111.5
786	M	35.9	Very low	34.6	Very low	163 Å²	163	131.8 Å²	131.8	80%	0.803	76%	0.764	S	S	*	*			trans	56.7	151.4	160.7	-66	161.3	66	0	0	117.8
787	T	38.1	Very low	35	Very low	118 Å²	118	134.5 Å²	134.5	72%	0.724	77%	0.769	S	S	*	*			cis	-147	161.6	28.1	-39.6	0	0	0	0	112.1
788	E	34.3	Very low	35	Very low	178 Å²	178	133.8 Å²	133.8	83%	0.832	76%	0.764	S	S	*	*			trans	-29.7	163.2	176.9	-52.6	176.2	-170	0	0	119.4
789	A	35.4	Very low	35.1	Very low	101 Å²	101	137 Å²	137	84%	0.835	77%	0.774	S	S	*	*			cis	-156.2	169.3	22	0	0	0	0	0	114.8
790	G	42.8	Very low	34.8	Very low	62 Å²	62	135.2 Å²	135.2	64%	0.639	78%	0.778	S	S	*	*			trans	112.6	79.1	162.5	0	0	0	0	0	116
791	T	37.6	Very low	34.8	Very low	117 Å²	117	130.8 Å²	130.8	72%	0.718	77%	0.765	S	S	*	*				52.3	126.8	91.9	68.4	0	0	0	0	114.2
792	W	35.3	Very low	34.6	Very low	240 Å²	240	132.6 Å²	132.6	91%	0.909	78%	0.775	S	S	*	*			cis	-152.3	170.4	27.7	-64.5	78.3	0	0	0	111.3
793	A	36.1	Very low	34.5	Very low	78 Å²	78	131.7 Å²	131.7	65%	0.645	77%	0.773	S	S	*	*			cis	-169.8	115.3	-35.3	0	0	0	0	0	112.2
794	K	30.2	Very low	34.3	Very low	204 Å²	204	133.1 Å²	133.1	89%	0.887	77%	0.773	S	S	*	*				41.2	114.9	128.4	-173.5	-172.4	-178.3	-178.2	0	120.4
795	A	34.3	Very low	34.5	Very low	104 Å²	104	131 Å²	131	86%	0.86	77%	0.77	S	S	*	*			trans	-156.9	130.4	140.2	0	0	0	0	0	112.5
796	T	27.8	Very low	34.3	Very low	121 Å²	121	129.2 Å²	129.2	74%	0.742	77%	0.769	S	S	*	*			trans	-91.5	136.8	179	-54.2	0	0	0	0	111.3
797	I	37.5	Very low	34.5	Very low	163 Å²	163	127.2 Å²	127.2	84%	0.836	77%	0.768	S	S	*	*			trans	-139	131.9	153.1	-65.7	-172.8	0	0	0	108.5
798	S	30.9	Very low	34.1	Very low	94 Å²	94	128.7 Å²	128.7	66%	0.657	77%	0.772	S	S	*	*			trans	-105.7	177.7	161.9	-63.4	0	0	0	0	108.7
799	D	32.4	Very low	34.2	Very low	158 Å²	158	125.9 Å²	125.9	85%	0.845	77%	0.766	S	S	*	*			trans	86.9	148.5	-173.5	-61.2	-26.8	0	0	0	114.3
800	S	31	Very low	34.4	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	76%	0.762	S	S	*	*			cis	-166.7	-178.7	-19	52.9	0	0	0	0	109.6
801	A	39.5	Very low	34.4	Very low	82 Å²	82	129.6 Å²	129.6	68%	0.678	76%	0.763	S	S	*	*			trans	68.9	125.3	176.8	0	0	0	0	0	115.8
802	D	31.9	Very low	34.3	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	76%	0.764	S	S	*	*			cis	93	156.4	33.7	-70.2	-59.7	0	0	0	114.7
803	C	34.2	Very low	34.5	Very low	116 Å²	116	125 Å²	125	78%	0.784	76%	0.755	S	S	*	*			trans	66.5	96.2	179.5	-55.5	0	0	0	0	114.3
804	S	30.2	Very low	34.8	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	76%	0.758	S	S	*	*			cis	71.8	144.9	25.6	105.9	0	0	0	0	115.4
805	L	34.1	Very low	35	Very low	160 Å²	160	122.2 Å²	122.2	84%	0.838	75%	0.745	S	S	*	*			trans	68.8	145.3	-176.2	-46.7	178.4	0	0	0	114.7
806	S	29.9	Very low	35.1	Very low	97 Å²	97	123.4 Å²	123.4	68%	0.678	73%	0.733	S	S	*	*			cis	-159.3	168.5	-14.9	-109.8	0	0	0	0	109.6
807	P	40.9	Very low	35.5	Very low	121 Å²	121	126 Å²	126	79%	0.786	73%	0.729	S	S	*	*			trans	-83.3	-173.2	179.3	37.3	-38.4	0	0	0	113.4
808	D	30	Very low	35.4	Very low	150 Å²	150	124.8 Å²	124.8	80%	0.802	72%	0.72	S	S	*	*			trans	100.2	153.8	161.9	-149.9	9.5	0	0	0	117.3
809	V	36.8	Very low	35.8	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.715	72%	0.721	S	S	*	*			trans	67.1	121.7	177	-170.6	0	0	0	0	115.6
810	D	39.7	Very low	36	Very low	137 Å²	137	125.4 Å²	125.4	73%	0.733	72%	0.723	S	S	*	*			cis	-151.3	139.4	-6.7	-138.7	-15.5	0	0	0	110
811	P	42.5	Very low	36.3	Very low	104 Å²	104	123.3 Å²	123.3	68%	0.675	72%	0.718	S	S	*	*			trans	-85.1	-165.9	159.2	34.8	-32.9	0	0	0	111.4
812	V	35.5	Very low	36.3	Very low	121 Å²	121	130 Å²	130	73%	0.733	73%	0.725	S	S	*	*			trans	80.9	140.8	171.8	-172.4	0	0	0	0	116.8
813	L	39.8	Very low	36.6	Very low	139 Å²	139	130.5 Å²	130.5	73%	0.728	72%	0.723	S	S	*	*			trans	101.5	111.2	180	-60.7	-177.8	0	0	0	112.2	F815	L813-F815 HydrophobicContact CD2-CD2 4.4Å; L813-F815 HydrophobicContact CD2-CE1 3.94Å; L813-F815 HydrophobicContact CD2-CE2 3.61Å; L813-F815 HydrophobicContact CD2-CZ 3.34Å
814	A	41.7	Very low	36.6	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	72%	0.719	S	S	*	*			cis	-161.3	162.3	6.3	0	0	0	0	0	109.1
815	F	33.8	Very low	36.8	Very low	140 Å²	140	132.9 Å²	132.9	61%	0.614	73%	0.725	S	S	*	*			cis	-169.6	149.2	-16.7	-104.7	-41.1	0	0	0	106.9	L813	L813-F815 HydrophobicContact CD2-CD2 4.4Å; L813-F815 HydrophobicContact CD2-CE1 3.94Å; L813-F815 HydrophobicContact CD2-CE2 3.61Å; L813-F815 HydrophobicContact CD2-CZ 3.34Å
816	Q	37.2	Very low	36.9	Very low	130 Å²	130	130.2 Å²	130.2	61%	0.607	72%	0.719	S	S	*	*			trans	59.4	144.5	139.4	-67.8	-179.1	68.8	0	0	119.7
817	R	36	Very low	37.2	Very low	175 Å²	175	132.4 Å²	132.4	66%	0.66	72%	0.719	S	S	*	*			cis	-165.4	129	5.3	156.5	179	-62.2	-87	7.2	110.3
818	E	35.2	Very low	37.4	Very low	138 Å²	138	134.5 Å²	134.5	65%	0.645	72%	0.716	S	S	*	*				47.1	110.5	127.8	-154.8	171.9	-149.9	0	0	117.9	F820	E818-F820 HydrophobicContact CG-CZ 4.43Å
819	G	39.5	Very low	37.6	Very low	67 Å²	67	138.6 Å²	138.6	69%	0.691	72%	0.72	S	S	*	*				121.8	157.5	83.3	0	0	0	0	0	108.2
820	F	36.1	Very low	37.6	Very low	198 Å²	198	138.6 Å²	138.6	87%	0.868	72%	0.72	S	S	*	*			cis	-144	167.4	4.5	-66.5	-104.6	0	0	0	106.9	E818	E818-F820 HydrophobicContact CG-CZ 4.43Å
821	G	37.8	Very low	37.6	Very low	62 Å²	62	140 Å²	140	64%	0.639	72%	0.72	S	S	*	*			cis	167	-179.4	1.2	0	0	0	0	0	110.2
822	R	40.4	Very low	37.2	Very low	223 Å²	223	142.4 Å²	142.4	84%	0.842	72%	0.722	S	S	*	*			trans	79.2	107	-173.9	-50.7	175.3	179.9	-83.4	1.2	113.2
823	Q	36.9	Very low	37.3	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	73%	0.732	S	S	*	*				72.5	137.6	72.5	-69.2	165.3	-59.5	0	0	112.5
824	S	35.5	Very low	36.9	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	74%	0.738	S	S	*	*			cis	-171.7	168.4	-2.4	-88.9	0	0	0	0	108.3
825	M	33	Very low	36.6	Very low	162 Å²	162	148.4 Å²	148.4	80%	0.798	74%	0.739	S	S	*	*			cis	-169.1	151.2	-18.7	-97	-117.7	-66.6	0	0	108.8
826	S	36	Very low	36.9	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	75%	0.751	S	S	*	*			trans	63	155.5	159.1	-71.3	0	0	0	0	119
827	E	37.7	Very low	37.1	Very low	142 Å²	142	144.5 Å²	144.5	66%	0.664	75%	0.75	S	S	*	*			cis	-164.4	172.3	-3.8	151.7	-177.4	165.2	0	0	110.4
828	K	43.9	Very low	37.3	Very low	165 Å²	165	144 Å²	144	72%	0.717	76%	0.755	S	S	*	*			trans	88	105.4	158.9	-92	155.2	-178.1	112.6	0	120.4
829	R	34.4	Very low	37.5	Very low	237 Å²	237	144.6 Å²	144.6	89%	0.894	76%	0.762	S	S	*	*				20.8	137.4	109.6	-82.2	175.7	169	-179.6	-4	117.1
830	T	37.4	Very low	37.3	Very low	118 Å²	118	148.1 Å²	148.1	72%	0.724	77%	0.765	S	S	*	*			cis	-165.5	160.2	10.3	-155.7	0	0	0	0	114.4
831	K	38.4	Very low	37.6	Very low	167 Å²	167	146.1 Å²	146.1	73%	0.726	76%	0.756	S	S	*	*			trans	55.2	121.2	162	-69	-169.4	174.9	-167.8	0	122.1
832	Q	35	Very low	37.8	Very low	153 Å²	153	149.5 Å²	149.5	72%	0.715	76%	0.764	S	S	*	*			trans	53.5	99.5	137.1	-62.4	175.6	-94.9	0	0	119.2
833	F	37.5	Very low	38	Very low	216 Å²	216	148.8 Å²	148.8	95%	0.947	77%	0.767	S	S	*	*				-150.7	154.6	99	-87.9	-68.4	0	0	0	109.2
834	S	30.7	Very low	38.2	Very low	122 Å²	122	145.8 Å²	145.8	85%	0.853	76%	0.76	S	S	*	*			trans	-145.3	71.7	-169	61.3	0	0	0	0	113.7
835	D	36.1	Very low	38.9	Very low	132 Å²	132	150.9 Å²	150.9	71%	0.706	76%	0.763	S	S	*	*			trans	-151	140.1	142.5	-173.6	17	0	0	0	108.9	S837	D835-S837 VanDerWaalsContact CG-OG 3.3Å; D835-S837 VanDerWaalsContact OD2-CB 3.27Å; D835-S837 WeakPolarHBondContact OD2-CB 3.46Å; D835-S837 PolarHBondContact OD2-OG 2.91Å
836	A	40.9	Very low	39.2	Very low	107 Å²	107	151.6 Å²	151.6	88%	0.884	76%	0.762	S	S	*	*			trans	-109.7	35.6	-174.2	0	0	0	0	0	111.8
837	S	41.7	Very low	39.5	Very low	81 Å²	81	152.9 Å²	152.9	57%	0.566	77%	0.771	S	S	*	*			trans	-105.4	-5.2	-170.9	70.5	0	0	0	0	115.1	D835	D835-S837 VanDerWaalsContact CG-OG 3.3Å; D835-S837 VanDerWaalsContact OD2-CB 3.27Å; D835-S837 WeakPolarHBondContact OD2-CB 3.46Å; D835-S837 PolarHBondContact OD2-OG 2.91Å
838	Q	39.1	Very low	40	Very low	165 Å²	165	155.2 Å²	155.2	77%	0.771	78%	0.779	S	S	*	*	S	Bend	trans	-116.6	142.2	-177.5	-58.1	-170.9	25.4	0	0	111.6
839	L	38.5	Very low	39.8	Very low	150 Å²	150	152.9 Å²	152.9	79%	0.785	78%	0.784	S	S	*	*			trans	60	113.9	-170.7	-77.8	70	0	0	0	114.5
840	D	37	Very low	39.9	Very low	141 Å²	141	150.3 Å²	150.3	75%	0.754	78%	0.784	S	S	*	*				-169.5	175.8	91.7	-118	-2	0	0	0	114.9
841	F	42.5	Very low	39.9	Very low	156 Å²	156	151 Å²	151	68%	0.684	78%	0.783	S	S	*	*			trans	-76.6	154.8	-148	-76.6	-96.5	0	0	0	119.4	K843	F841-K843 PolarHBondContact O-N 3.16Å
842	V	41.3	Very low	39.9	Very low	133 Å²	133	149.6 Å²	149.6	81%	0.806	78%	0.783	S	S	*	*			trans	-46.2	123.2	163.3	175.3	0	0	0	0	112.3
843	K	44.9	Very low	39.9	Very low	208 Å²	208	148.4 Å²	148.4	90%	0.904	79%	0.786	S	S	*	*			trans	-114.5	141.1	163.6	-137.8	160.3	-174.7	169.2	0	110	F841	F841-K843 PolarHBondContact O-N 3.16Å
844	T	41.2	Very low	39.7	Very low	101 Å²	101	142.2 Å²	142.2	62%	0.62	77%	0.774	S	S	*	*			trans	-94.5	163	-156.2	61.5	0	0	0	0	114.4
845	R	50.2	Low	40	Very low	208 Å²	208	143.2 Å²	143.2	79%	0.785	77%	0.77	S	S	*	*				147.2	123.2	110.7	-163.7	169.7	-159.5	-167.8	6.7	115.2
846	K	38.5	Very low	40.1	Very low	178 Å²	178	143.4 Å²	143.4	77%	0.774	77%	0.767	S	S	*	*			trans	57.6	115.3	160	-68.1	174.4	177.2	-176.9	0	120.3
847	S	43	Very low	40	Very low	130 Å²	130	144.8 Å²	144.8	91%	0.909	76%	0.764	S	S	*	*				-172.8	158.7	116.9	-88.7	0	0	0	0	116.1
848	K	46.9	Very low	39.9	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	77%	0.771	S	S	*	*			trans	-57.8	158.8	-172.4	-83.8	168.9	162.9	171.1	0	118.1
849	S	40.2	Very low	39.7	Very low	117 Å²	117	148 Å²	148	82%	0.818	77%	0.772	S	S	*	*			trans	63.6	160.5	144.7	52.3	0	0	0	0	119.4
850	M	36.9	Very low	39.5	Very low	182 Å²	182	148.4 Å²	148.4	90%	0.897	78%	0.775	S	S	*	*			cis	-158.6	163.1	-35	-170.2	173.4	84.6	0	0	106.7
851	D	38.4	Very low	39.3	Very low	133 Å²	133	147 Å²	147	71%	0.711	77%	0.772	S	S	*	*			trans	-83.4	171.8	-170	-146.1	-16.1	0	0	0	115.2
852	L	38.3	Very low	39.1	Very low	137 Å²	137	146.5 Å²	146.5	72%	0.717	78%	0.781	S	S	*	*			trans	81	115.2	150.1	-73.8	174.5	0	0	0	123.6
853	V	33.7	Very low	38.8	Very low	128 Å²	128	147 Å²	147	78%	0.776	78%	0.78	S	S	*	*			trans	53.3	126.4	136.9	-68.6	0	0	0	0	125.9
854	A	33.1	Very low	38.6	Very low	86 Å²	86	144.7 Å²	144.7	71%	0.711	78%	0.777	S	S	*	*				83.3	156.1	117.9	0	0	0	0	0	125
855	D	38.4	Very low	38.3	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	78%	0.779	S	S	*	*			trans	72.7	102.9	150.7	-68.7	5.2	0	0	0	123.6
856	E	37.5	Very low	37.6	Very low	135 Å²	135	147.7 Å²	147.7	63%	0.631	78%	0.783	S	S	*	*				51	101.2	102.8	-70.5	-76.7	104.9	0	0	119.3	K858	E856-K858 VanDerWaalsContact OE2-CE 3.31Å; E856-K858 WeakPolarHBondContact OE2-CE 3.32Å
857	T	39.1	Very low	37.4	Very low	136 Å²	136	144 Å²	144	83%	0.834	79%	0.786	S	S	*	*			trans	-145	115.5	138.6	31.2	0	0	0	0	106.3
858	K	39.6	Very low	37.1	Very low	163 Å²	163	141.9 Å²	141.9	71%	0.709	78%	0.784	S	S	*	*				50.8	111.3	55.9	-62.2	-171.4	179.8	175.7	0	113.5	E856	E856-K858 VanDerWaalsContact OE2-CE 3.31Å; E856-K858 WeakPolarHBondContact OE2-CE 3.32Å
859	L	34.1	Very low	36.6	Very low	151 Å²	151	138 Å²	138	79%	0.791	78%	0.781	S	S	*	*				176.5	128.2	111.1	-93	169.8	0	0	0	111.2
860	N	34.6	Very low	37.1	Very low	159 Å²	159	138.3 Å²	138.3	85%	0.85	78%	0.78	S	S	*	*				-172.2	146.1	109.8	-95.7	-12.6	0	0	0	111.5
861	T	32.4	Very low	37.2	Very low	110 Å²	110	134.6 Å²	134.6	68%	0.675	77%	0.772	S	S	*	*			trans	-122.6	140.2	177.1	-56.2	0	0	0	0	108.2
862	V	40.1	Very low	37.3	Very low	147 Å²	147	138.3 Å²	138.3	89%	0.891	78%	0.776	S	S	*	*			trans	-140.8	124.8	158.1	-80.6	0	0	0	0	108.7
863	D	33.5	Very low	37.4	Very low	144 Å²	144	137 Å²	137	77%	0.77	77%	0.77	S	S	*	*			trans	-85.4	150	169.8	-61.6	-94.5	0	0	0	110.6
864	D	40.9	Very low	37.7	Very low	158 Å²	158	137.2 Å²	137.2	85%	0.845	77%	0.771	S	S	*	*			trans	-150.5	171	136.2	-140.5	-31.4	0	0	0	111.1
865	Q	35.5	Very low	37.8	Very low	142 Å²	142	136.1 Å²	136.1	66%	0.664	77%	0.769	S	S	*	*			trans	-121.6	167.2	-150	-49.9	175.7	10.9	0	0	116.1
866	R	35.7	Very low	38	Very low	231 Å²	231	135.2 Å²	135.2	87%	0.872	77%	0.771	S	S	*	*			trans	77.4	151.3	159.2	-58.9	175.4	-176.6	-142.6	-1.7	116.9
867	A	34.4	Very low	38.3	Very low	101 Å²	101	134.8 Å²	134.8	84%	0.835	78%	0.783	S	S	*	*			cis	-168.1	157.6	-21.5	0	0	0	0	0	109.1
868	G	35.5	Very low	38.1	Very low	84 Å²	84	137.1 Å²	137.1	87%	0.866	79%	0.789	S	S	*	*			trans	170.1	54.6	179.9	0	0	0	0	0	118.6
869	S	35.8	Very low	38.2	Very low	111 Å²	111	133 Å²	133	78%	0.776	79%	0.793	S	S	*	*			trans	-71.7	177.3	176.8	53.1	0	0	0	0	115.9
870	P	50.9	Low	38.6	Very low	122 Å²	122	133.6 Å²	133.6	79%	0.792	80%	0.796	S	S	*	*			cis	-146.2	-140.9	-36.1	41.3	-19.9	0	0	0	112.7
871	S	39.3	Very low	39.1	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	80%	0.795	S	S	*	*			trans	99.1	113.3	165	-147.6	0	0	0	0	112.3
872	R	41.3	Very low	39.6	Very low	211 Å²	211	139.1 Å²	139.1	80%	0.796	80%	0.803	S	S	*	*			cis	-148.1	173.5	20.7	-69.5	-171.5	72	172.8	-0.5	109.2
873	D	39.7	Very low	39.3	Very low	109 Å²	109	135.7 Å²	135.7	58%	0.583	79%	0.785	S	S	*	*			cis	-173.3	152	-14.7	-101.1	8.5	0	0	0	106
874	V	39.8	Very low	39.6	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	79%	0.789	S	S	*	*			cis	-139.5	161.3	-10.5	-161.2	0	0	0	0	107.3
875	G	35.1	Very low	39.3	Very low	64 Å²	64	131.4 Å²	131.4	66%	0.66	78%	0.779	S	S	*	*			trans	-98.2	-145	165.7	0	0	0	0	0	112.6
876	P	42.4	Very low	39.8	Very low	125 Å²	125	128.3 Å²	128.3	81%	0.812	77%	0.767	S	S	*	*			cis	-132.2	170.3	-16.5	40.8	-26.6	0	0	0	113.2
877	S	43.9	Very low	40.3	Very low	126 Å²	126	123.7 Å²	123.7	88%	0.881	76%	0.755	S	S	*	*			trans	-163.3	125.7	158.8	-87.5	0	0	0	0	114.5
878	L	34.7	Very low	40.7	Very low	185 Å²	185	123.9 Å²	123.9	97%	0.969	75%	0.75	S	S	*	*			trans	-84.9	124.1	162.3	-68.7	162.6	0	0	0	108.4
879	G	42.6	Very low	41.1	Very low	76 Å²	76	125.7 Å²	125.7	78%	0.784	74%	0.739	S	S	*	*			trans	-156.9	91.1	-172.7	0	0	0	0	0	115.6
880	L	43.4	Very low	41.5	Very low	163 Å²	163	124.4 Å²	124.4	85%	0.853	72%	0.721	S	S	*	*			trans	-71.1	159.9	164.9	-68.3	165.1	0	0	0	111.2
881	K	43.5	Very low	41.5	Very low	191 Å²	191	124.6 Å²	124.6	83%	0.83	72%	0.72	S	S	*	*			trans	97.1	145.2	173.4	-55.6	151.5	-171.9	169.8	0	113.7
882	K	42.6	Very low	41.6	Very low	195 Å²	195	123.3 Å²	123.3	85%	0.848	72%	0.716	S	S	*	*			cis	-156.3	168	-5.3	-119.7	173.2	-177.9	-168.3	0	111.6
883	S	34.5	Very low	42	Very low	75 Å²	75	117.9 Å²	117.9	52%	0.524	71%	0.706	S	S	.	*			trans	-79.1	150.1	-172.7	51.2	0	0	0	0	117.5
884	S	39.2	Very low	42.3	Very low	120 Å²	120	116.7 Å²	116.7	84%	0.839	71%	0.711	S	S	*	*	S	Bend	trans	-170.6	143.6	138.5	-172	0	0	0	0	108.6
885	S	35.4	Very low	42.6	Very low	92 Å²	92	119.1 Å²	119.1	64%	0.643	71%	0.714	S	S	*	*			cis	-67.5	142.4	0.1	-177.2	0	0	0	0	113.1
886	L	45.3	Very low	42.9	Very low	77 Å²	77	121.5 Å²	121.5	40%	0.403	72%	0.715	S	S	.	*			trans	-116.5	-29.7	177.4	-164.6	68.7	0	0	0	111.5	S888 L889 Q890	L886-S888 PolarHBondContact O-N 3.48Å; L886-L889 PolarHBondContact O-N 2.98Å; L886-Q890 VanDerWaalsContact CB-OE1 3.23Å; L886-Q890 HydrophobicContact CD2-CG 4.36Å; L886-Q890 HydrophobicContact CG-CG 3.95Å; L886-Q890 PolarHBondContact O-N 3.45Å; L886-Q890 PolarHBondContact O-OE1 3.45Å
887	E	46.7	Very low	42.6	Very low	133 Å²	133	122.2 Å²	122.2	62%	0.621	72%	0.718	S	S	*	*	H	α-helix	trans	-45.6	-53.2	-178.2	-113.7	73.7	178	0	0	114.9	L889 Q890 T891	E887-L889 PolarHBondContact O-N 2.97Å; E887-L889 VanDerWaalsContact O-N 3.08Å; E887-Q890 PolarHBondContact O-N 3.41Å; E887-T891 PolarHBondContact O-N 3.05Å
888	S	42.2	Very low	42.5	Very low	105 Å²	105	123.6 Å²	123.6	73%	0.734	71%	0.714	S	S	*	*	H	α-helix	trans	-70	-7.8	-174.3	-51.1	0	0	0	0	114.2	L886	L886-S888 PolarHBondContact O-N 3.48Å
889	L	44.7	Very low	42.6	Very low	123 Å²	123	122.2 Å²	122.2	64%	0.644	71%	0.708	S	S	*	*	H	α-helix	trans	-108	-15.5	167.1	-74.5	171.5	0	0	0	112.4	L886 E887 A892 V893	L886-L889 PolarHBondContact O-N 2.98Å; E887-L889 PolarHBondContact O-N 2.97Å; E887-L889 VanDerWaalsContact O-N 3.08Å; L889-A892 PolarHBondContact O-N 3.11Å; L889-V893 WeakPolarHBondContact O-CB 3.21Å; L889-V893 VanDerWaalsContact O-CG2 3.27Å; L889-V893 WeakPolarHBondContact O-CG2 2.9Å; L889-V893 PolarHBondContact O-N 2.86Å
890	Q	45.1	Very low	42.2	Very low	84 Å²	84	121.7 Å²	121.7	39%	0.393	70%	0.702	S	S	.	*	H	α-helix	trans	-69	-40.2	173.7	-78.9	167.3	-87.2	0	0	111.9	L886 E887 A892 V893 A894	L886-Q890 VanDerWaalsContact CB-OE1 3.23Å; L886-Q890 HydrophobicContact CD2-CG 4.36Å; L886-Q890 HydrophobicContact CG-CG 3.95Å; L886-Q890 PolarHBondContact O-N 3.45Å; L886-Q890 PolarHBondContact O-OE1 3.45Å; E887-Q890 PolarHBondContact O-N 3.41Å; Q890-A892 PolarHBondContact O-N 3.14Å; Q890-A892 VanDerWaalsContact O-N 3.09Å; Q890-V893 PolarHBondContact O-N 2.85Å; Q890-A894 WeakPolarHBondContact O-CB 3.26Å; Q890-A894 PolarHBondContact O-N 2.86Å
891	T	49.6	Very low	41.8	Very low	125 Å²	125	121.7 Å²	121.7	77%	0.767	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-19.8	174.8	-36.5	0	0	0	0	113.1	E887	E887-T891 PolarHBondContact O-N 3.05Å
892	A	41.5	Very low	41.8	Very low	78 Å²	78	120.3 Å²	120.3	65%	0.645	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-1.8	176.9	0	0	0	0	0	114.3	L889 Q890	L889-A892 PolarHBondContact O-N 3.11Å; Q890-A892 PolarHBondContact O-N 3.14Å; Q890-A892 VanDerWaalsContact O-N 3.09Å
893	V	49.7	Very low	41.9	Very low	98 Å²	98	116.8 Å²	116.8	59%	0.594	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	-22.2	-175.8	176	0	0	0	0	112.4	L889 Q890 E895 V896	L889-V893 WeakPolarHBondContact O-CB 3.21Å; L889-V893 VanDerWaalsContact O-CG2 3.27Å; L889-V893 WeakPolarHBondContact O-CG2 2.9Å; L889-V893 PolarHBondContact O-N 2.86Å; Q890-V893 PolarHBondContact O-N 2.85Å; V893-E895 VanDerWaalsContact C-N 3.26Å; V893-E895 PolarHBondContact O-N 2.79Å; V893-V896 PolarHBondContact O-N 3.46Å; V893-V896 VanDerWaalsContact O-N 3.16Å
894	A	46.1	Very low	42	Very low	83 Å²	83	122.3 Å²	122.3	69%	0.686	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-11.3	-177.6	0	0	0	0	0	114.9	Q890 V896	Q890-A894 WeakPolarHBondContact O-CB 3.26Å; Q890-A894 PolarHBondContact O-N 2.86Å; A894-V896 VanDerWaalsContact C-N 3.27Å
895	E	45.6	Very low	42.2	Very low	183 Å²	183	125.8 Å²	125.8	86%	0.855	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-8.4	170.6	-64.4	-163.8	150.1	0	0	113.2	V893	V893-E895 VanDerWaalsContact C-N 3.26Å; V893-E895 PolarHBondContact O-N 2.79Å
896	V	41.6	Very low	42.5	Very low	115 Å²	115	132.1 Å²	132.1	70%	0.697	73%	0.728	S	S	*	*	S	Bend	trans	-130.5	60.1	-169.4	-162.6	0	0	0	0	113.4	V893 A894	V893-V896 PolarHBondContact O-N 3.46Å; V893-V896 VanDerWaalsContact O-N 3.16Å; A894-V896 VanDerWaalsContact C-N 3.27Å
897	T	36.2	Very low	42.2	Very low	140 Å²	140	134.1 Å²	134.1	86%	0.859	75%	0.745	S	S	*	*			trans	-171.2	82.2	133.7	41.9	0	0	0	0	111.7
898	L	43.1	Very low	41.8	Very low	155 Å²	155	137.7 Å²	137.7	81%	0.812	75%	0.753	S	S	*	*	S	Bend	trans	-133.9	124.4	151.5	-96.1	169.2	0	0	0	109
899	N	35.9	Very low	41.8	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	76%	0.76	S	S	*	*	S	Bend	trans	60.6	81.5	160.2	-55.9	-7.3	0	0	0	119.3
900	G	34.7	Very low	41.6	Very low	65 Å²	65	143.9 Å²	143.9	67%	0.67	77%	0.769	S	S	*	*				100.7	99.8	107.5	0	0	0	0	0	120.9
901	N	35.4	Very low	41.4	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	79%	0.791	S	S	*	*			trans	77	164.9	143.5	-57.2	-30.8	0	0	0	120.6
902	I	43.5	Very low	41.2	Very low	163 Å²	163	149.7 Å²	149.7	84%	0.836	80%	0.795	S	S	*	*			trans	87	133.2	177.1	-55.3	170.4	0	0	0	113.5
903	P	43.6	Very low	41.3	Very low	121 Å²	121	156.8 Å²	156.8	79%	0.786	81%	0.805	S	S	*	*			trans	-106.4	157.8	-139.6	39.3	-35.3	0	0	0	117.3
904	F	36.9	Very low	40.8	Very low	191 Å²	191	155.5 Å²	155.5	84%	0.838	81%	0.812	S	S	*	*			trans	-84.8	135.2	178.8	-77.5	-100.1	0	0	0	114.1
905	H	43.1	Very low	40.9	Very low	192 Å²	192	161.4 Å²	161.4	89%	0.889	82%	0.816	S	S	*	*			trans	-118.9	117.3	152.6	-121.1	-80.4	0	0	0	109.3
906	R	41.5	Very low	40.8	Very low	226 Å²	226	156.3 Å²	156.3	85%	0.853	81%	0.813	S	S	*	*			trans	-78.7	144	179.3	-67.6	178.9	178.7	144.8	-1.9	110.9
907	P	39.1	Very low	41.3	Very low	118 Å²	118	154.6 Å²	154.6	77%	0.766	81%	0.805	S	S	*	*				-140.5	130.7	114.1	33.4	-19.4	0	0	0	115
908	R	39.7	Very low	42.1	Very low	208 Å²	208	153.1 Å²	153.1	79%	0.785	79%	0.792	S	S	*	*			trans	35.5	105	157.8	-68.6	-175.5	169.7	106.5	-3.6	118.6	R910	R908-R910 PolarHBondContact O-N 3.15Å
909	P	40.5	Very low	42.9	Very low	138 Å²	138	153.9 Å²	153.9	90%	0.896	79%	0.791	S	S	*	*			trans	-64	106.8	151	28.9	-32.2	0	0	0	108.6
910	R	41.6	Very low	44.5	Very low	220 Å²	220	150.5 Å²	150.5	83%	0.83	78%	0.78	S	S	*	*			trans	-72.2	137.8	172.2	-75.9	-176.9	169.9	104.9	-11.5	109.1	R908 I912	R908-R910 PolarHBondContact O-N 3.15Å; R910-I912 PolarHBondContact O-N 3.3Å
911	I	41.5	Very low	45.9	Very low	166 Å²	166	154.1 Å²	154.1	85%	0.851	78%	0.777	S	S	*	*			trans	-39.9	128.7	178.9	-61	159.9	0	0	0	111.2	R913	I911-R913 PolarHBondContact O-N 3.06Å
912	I	45.4	Very low	47.5	Very low	165 Å²	165	151.5 Å²	151.5	85%	0.846	76%	0.755	S	S	*	*			trans	-67.8	99.8	-178.2	-61.8	178.6	0	0	0	109.5	R910 G914	R910-I912 PolarHBondContact O-N 3.3Å; I912-G914 PolarHBondContact O-N 3.14Å; I912-G914 VanDerWaalsContact O-N 3.09Å
913	R	42.5	Very low	48.7	Very low	228 Å²	228	146.2 Å²	146.2	86%	0.86	74%	0.736	S	S	*	*			trans	-78	89.8	178.9	-175.4	173.9	-179.3	160	-2	109.9	I911 R915	I911-R913 PolarHBondContact O-N 3.06Å; R913-R915 PolarHBondContact O-N 3.39Å
914	G	38.9	Very low	49.8	Very low	71 Å²	71	142.9 Å²	142.9	73%	0.732	72%	0.719	S	S	*	*			trans	-52.3	108.8	179.3	0	0	0	0	0	112.7	I912 G916	I912-G914 PolarHBondContact O-N 3.14Å; I912-G914 VanDerWaalsContact O-N 3.09Å; G914-G916 PolarHBondContact O-N 3.4Å
915	R	48.5	Very low	51.3	Low	207 Å²	207	138.1 Å²	138.1	78%	0.781	70%	0.701	S	S	*	*			trans	-83.2	113.6	177.4	-72.9	179.2	174.2	173.8	-1.6	109.9	R913	R913-R915 PolarHBondContact O-N 3.39Å
916	G	44.2	Very low	52.3	Low	76 Å²	76	133.7 Å²	133.7	78%	0.784	68%	0.684	S	S	*	*			trans	-134.7	22.3	167.6	0	0	0	0	0	112.3	G914	G914-G916 PolarHBondContact O-N 3.4Å
917	C	50.7	Low	53.4	Low	78 Å²	78	131.3 Å²	131.3	53%	0.527	68%	0.68	S	S	.	*			trans	-70.3	132.1	-172.7	-48.8	0	0	0	0	111	E919 R922	C917-E919 PolarHBondContact O-N 3.48Å; C917-R922 HydrophobicContact CB-CG 3.48Å; C917-R922 VanDerWaalsContact CB-CG 3.48Å
918	N	53.8	Low	54.4	Low	110 Å²	110	129.5 Å²	129.5	59%	0.588	67%	0.67	S	S	*	*			trans	-54.8	134.3	158.7	-75.5	-26.2	0	0	0	108.8	S920 F921 R922	N918-S920 PolarHBondContact O-N 3.05Å; N918-F921 HydrophobicContact CB-CB 4.41Å; N918-F921 HydrophobicContact CB-CD2 4.45Å; N918-F921 WeakPolarHBondContact O-CA 3.4Å; N918-F921 WeakPolarHBondContact O-CB 3.39Å; N918-F921 PolarHBondContact O-N 3.28Å; N918-R922 PolarHBondContact O-N 2.89Å
919	E	60.3	Low	54.9	Low	171 Å²	171	128.7 Å²	128.7	80%	0.799	67%	0.668	S	S	*	*	H	α-helix	trans	-57.1	-36.6	-179.3	-168.8	159.6	-150.8	0	0	111.8	C917 F921 R922 A923	C917-E919 PolarHBondContact O-N 3.48Å; E919-F921 VanDerWaalsContact C-N 3.31Å; E919-F921 PolarHBondContact O-N 2.99Å; E919-R922 PolarHBondContact O-N 3.13Å; E919-A923 WeakPolarHBondContact O-CB 3.07Å; E919-A923 PolarHBondContact O-N 3.32Å
920	S	68.2	Low	55.5	Low	85 Å²	85	129.6 Å²	129.6	59%	0.594	67%	0.666	S	S	*	*	H	α-helix	trans	-65.8	-21.9	172.5	52.7	0	0	0	0	115.4	N918 A924	N918-S920 PolarHBondContact O-N 3.05Å; S920-A924 WeakPolarHBondContact O-CB 3.38Å; S920-A924 PolarHBondContact O-N 3.23Å
921	F	64.3	Low	56	Low	140 Å²	140	128.5 Å²	128.5	61%	0.614	67%	0.667	S	S	*	*	H	α-helix	trans	-85.8	-33.3	173.4	-103	-90.4	0	0	0	112.1	N918 E919 A924 I925	N918-F921 HydrophobicContact CB-CB 4.41Å; N918-F921 HydrophobicContact CB-CD2 4.45Å; N918-F921 WeakPolarHBondContact O-CA 3.4Å; N918-F921 WeakPolarHBondContact O-CB 3.39Å; N918-F921 PolarHBondContact O-N 3.28Å; E919-F921 VanDerWaalsContact C-N 3.31Å; E919-F921 PolarHBondContact O-N 2.99Å; F921-A924 PolarHBondContact O-N 2.85Å; F921-I925 PolarHBondContact O-N 3.25Å
922	R	68.7	Low	56.2	Low	108 Å²	108	126.7 Å²	126.7	41%	0.408	67%	0.666	S	S	.	*	H	α-helix	trans	-63.7	-51	168.6	-61.4	-167.5	80.8	-157.6	-9.8	109.6	C917 N918 E919 A924 I925 D926	C917-R922 HydrophobicContact CB-CG 3.48Å; C917-R922 VanDerWaalsContact CB-CG 3.48Å; N918-R922 PolarHBondContact O-N 2.89Å; E919-R922 PolarHBondContact O-N 3.13Å; R922-A924 PolarHBondContact O-N 3.1Å; R922-I925 PolarHBondContact O-N 2.92Å; R922-I925 VanDerWaalsContact O-N 3.12Å; R922-D926 VanDerWaalsContact O-CB 3.26Å; R922-D926 WeakPolarHBondContact O-CB 3.41Å; R922-D926 VanDerWaalsContact O-CG 3.25Å; R922-D926 PolarHBondContact O-N 3.46Å
923	A	69.4	Low	56.1	Low	51 Å²	51	126.9 Å²	126.9	42%	0.421	67%	0.665	S	S	.	*	H	α-helix	trans	-64.2	1.5	174.7	0	0	0	0	0	115.8	E919 K927	E919-A923 WeakPolarHBondContact O-CB 3.07Å; E919-A923 PolarHBondContact O-N 3.32Å; A923-K927 WeakPolarHBondContact O-CD 3.26Å
924	A	67.1	Low	56.3	Low	52 Å²	52	120.6 Å²	120.6	43%	0.43	65%	0.652	S	S	.	*	H	α-helix	trans	-105.3	-38.5	170	0	0	0	0	0	112.5	S920 F921 R922 S928	S920-A924 WeakPolarHBondContact O-CB 3.38Å; S920-A924 PolarHBondContact O-N 3.23Å; F921-A924 PolarHBondContact O-N 2.85Å; R922-A924 PolarHBondContact O-N 3.1Å; A924-S928 PolarHBondContact O-OG 3.43Å
925	I	68.9	Low	56.5	Low	91 Å²	91	123.7 Å²	123.7	47%	0.467	65%	0.652	S	S	.	*	H	α-helix	trans	-81.7	-40.2	178.6	-64.6	-179.5	0	0	0	110.9	F921 R922 K927 S928 Y929	F921-I925 PolarHBondContact O-N 3.25Å; R922-I925 PolarHBondContact O-N 2.92Å; R922-I925 VanDerWaalsContact O-N 3.12Å; I925-K927 PolarHBondContact O-N 2.81Å; I925-S928 PolarHBondContact O-N 2.87Å; I925-S928 PolarHBondContact O-OG 2.82Å; I925-Y929 HydrophobicContact CG2-CD2 3.9Å; I925-Y929 HydrophobicContact CG2-CE2 4.3Å; I925-Y929 PolarHBondContact O-N 2.86Å
926	D	64.2	Low	56.3	Low	99 Å²	99	120.7 Å²	120.7	53%	0.529	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.2	9	175.2	-54	-23.3	0	0	0	112.1	R922	R922-D926 VanDerWaalsContact O-CB 3.26Å; R922-D926 WeakPolarHBondContact O-CB 3.41Å; R922-D926 VanDerWaalsContact O-CG 3.25Å; R922-D926 PolarHBondContact O-N 3.46Å
927	K	63.3	Low	56.4	Low	175 Å²	175	123.9 Å²	123.9	76%	0.761	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	8.1	172.9	-101.9	151.7	173.3	170.1	0	113.4	A923 I925	A923-K927 WeakPolarHBondContact O-CD 3.26Å; I925-K927 PolarHBondContact O-N 2.81Å
928	S	60.3	Low	56.3	Low	81 Å²	81	126.6 Å²	126.6	57%	0.566	66%	0.66	S	S	*	*	S	Bend	trans	-137	10.3	-177.8	48.5	0	0	0	0	114.4	A924 I925	A924-S928 PolarHBondContact O-OG 3.43Å; I925-S928 PolarHBondContact O-N 2.87Å; I925-S928 PolarHBondContact O-OG 2.82Å
929	Y	50.4	Low	56.1	Low	190 Å²	190	128.7 Å²	128.7	75%	0.745	67%	0.666	S	S	*	*			trans	-123.3	-6.2	-178.6	-93.1	-85.7	0	0	0	116.8	I925 K931	I925-Y929 HydrophobicContact CG2-CD2 3.9Å; I925-Y929 HydrophobicContact CG2-CE2 4.3Å; I925-Y929 PolarHBondContact O-N 2.86Å; Y929-K931 PolarHBondContact O-N 2.78Å
930	D	53.3	Low	55.5	Low	158 Å²	158	124 Å²	124	85%	0.845	66%	0.663	S	S	*	*			trans	-74.1	116.2	165	-77.5	-43.9	0	0	0	109.9
931	K	51.7	Low	54.6	Low	196 Å²	196	127.4 Å²	127.4	85%	0.852	67%	0.671	S	S	*	*			trans	-117.6	128.2	166.1	-99.3	174.6	175	171.1	0	107.5	Y929	Y929-K931 PolarHBondContact O-N 2.78Å
932	P	47	Very low	53.7	Low	128 Å²	128	129 Å²	129	83%	0.831	68%	0.681	S	S	*	*			trans	-72.6	140.9	-168.6	29.4	-35.5	0	0	0	111.5
933	M	42.9	Very low	52.6	Low	169 Å²	169	129.7 Å²	129.7	83%	0.833	70%	0.697	S	S	*	*			trans	-138.7	111.7	156.5	-101	-168.9	65.5	0	0	108.5
934	V	45.4	Very low	51.3	Low	96 Å²	96	134.8 Å²	134.8	58%	0.582	72%	0.717	S	S	*	*			trans	37.8	121	142.1	-78.2	0	0	0	0	119.9
935	D	45	Very low	50.1	Low	137 Å²	137	140.4 Å²	140.4	73%	0.733	73%	0.734	S	S	*	*			trans	67	146.2	134.5	-38.2	-21.6	0	0	0	117.1
936	D	42.8	Very low	48.8	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	75%	0.75	S	S	*	*			cis	-127.8	165.3	5.6	-59.4	-88.8	0	0	0	111.6
937	D	47.3	Very low	47.6	Very low	143 Å²	143	146.2 Å²	146.2	77%	0.765	76%	0.761	S	S	*	*			trans	-5.1	157.3	140.9	-45.4	-29.6	0	0	0	118.3
938	D	48.6	Very low	46.5	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	76%	0.756	S	S	*	*			cis	-165.9	168.1	31.1	-140.8	-7.4	0	0	0	113
939	E	48.5	Very low	45.5	Very low	154 Å²	154	147.9 Å²	147.9	72%	0.72	77%	0.77	S	S	*	*			trans	42.7	135.4	154.8	-66.4	-68.1	88.6	0	0	123
940	G	47.7	Very low	44.8	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	77%	0.77	S	S	*	*			trans	-171.8	-10.7	175.9	0	0	0	0	0	123.7
941	M	50.9	Low	44	Very low	157 Å²	157	143.3 Å²	143.3	77%	0.773	76%	0.76	S	S	*	*			trans	55.4	109.1	168.5	-60.9	176.7	-170.1	0	0	118.3
942	E	44.4	Very low	43.2	Very low	174 Å²	174	137.7 Å²	137.7	81%	0.813	75%	0.746	S	S	*	*				67.7	94.9	91.5	-72.9	-167.8	166.7	0	0	114.5
943	T	44.8	Very low	42.8	Very low	123 Å²	123	141.9 Å²	141.9	76%	0.755	75%	0.745	S	S	*	*				82.6	105.2	81.9	54	0	0	0	0	116.4
944	L	42.1	Very low	42.2	Very low	158 Å²	158	139 Å²	139	83%	0.827	74%	0.741	S	S	*	*			trans	-167	137.5	145.8	-126.5	70.8	0	0	0	104.8
945	E	42.7	Very low	41.7	Very low	169 Å²	169	137.4 Å²	137.4	79%	0.79	74%	0.744	S	S	*	*			cis	55.9	122.6	46.5	-65.9	178.7	-157	0	0	112.3
946	E	42.2	Very low	41.4	Very low	173 Å²	173	140.7 Å²	140.7	81%	0.808	75%	0.746	S	S	*	*			cis	-150	-178.2	-15	-171.6	167.9	-178.3	0	0	106.1
947	D	39.2	Very low	40.9	Very low	140 Å²	140	139 Å²	139	75%	0.749	73%	0.733	S	S	*	*			trans	67.1	162.8	167.3	-83.2	-31.6	0	0	0	118.5
948	T	39.6	Very low	40.1	Very low	110 Å²	110	136 Å²	136	68%	0.675	72%	0.723	S	S	*	*			cis	-165.1	167.5	-43.5	-104	0	0	0	0	108.3
949	E	39.5	Very low	39.2	Very low	180 Å²	180	136 Å²	136	84%	0.841	73%	0.728	S	S	*	*			trans	84.2	-176.4	174	-45.4	-139.7	116.4	0	0	118.8
950	E	35.9	Very low	38.7	Very low	162 Å²	162	133.1 Å²	133.1	76%	0.757	73%	0.725	S	S	*	*			trans	-48.9	134.2	-149.9	-65.4	-160.3	86.9	0	0	117.8
951	S	36	Very low	37.9	Very low	90 Å²	90	135.7 Å²	135.7	63%	0.629	73%	0.727	S	S	*	*				54.1	104.2	60	175.2	0	0	0	0	114.9
952	S	34.8	Very low	37.1	Very low	79 Å²	79	133 Å²	133	55%	0.552	72%	0.724	S	S	*	*				174.5	147.4	128.6	-90.4	0	0	0	0	114.3
953	R	38.1	Very low	36.5	Very low	216 Å²	216	129.6 Å²	129.6	82%	0.815	72%	0.719	S	S	*	*			trans	56.1	116.2	136	-66.3	176.3	164.5	109.5	-5.1	118.9
954	S	30.2	Very low	36.2	Very low	109 Å²	109	130 Å²	130	76%	0.762	72%	0.717	S	S	*	*			cis	88.2	145.1	47.7	75.9	0	0	0	0	114.5
955	G	34.6	Very low	35.8	Very low	61 Å²	61	130.5 Å²	130.5	63%	0.629	72%	0.715	S	S	*	*			trans	88.9	156.5	175	0	0	0	0	0	112.5
956	R	38.8	Very low	35.6	Very low	206 Å²	206	127 Å²	127	78%	0.777	71%	0.707	S	S	*	*			cis	-134	148.8	1.2	-69.4	-159.5	94.4	151.7	2.3	108.3
957	E	32.3	Very low	35.1	Very low	108 Å²	108	124.2 Å²	124.2	51%	0.505	71%	0.706	S	S	.	*				47.3	134.8	74.8	-38.9	147.7	-127	0	0	112.4
958	S	30.6	Very low	34.6	Very low	80 Å²	80	128.5 Å²	128.5	56%	0.559	71%	0.714	S	S	*	*			cis	-175	160.3	-9.7	-108.6	0	0	0	0	111.1
959	V	30.7	Very low	34.3	Very low	135 Å²	135	128.9 Å²	128.9	82%	0.818	72%	0.721	S	S	*	*			trans	56.7	-174.6	154.3	-57.2	0	0	0	0	119.7
960	S	37.7	Very low	34.1	Very low	95 Å²	95	127.5 Å²	127.5	66%	0.664	72%	0.718	S	S	*	*			trans	68.7	103.5	-178.4	-54	0	0	0	0	114.9
961	T	31.3	Very low	33.8	Very low	124 Å²	124	126.3 Å²	126.3	76%	0.761	71%	0.713	S	S	*	*			cis	67	135.7	50	80.9	0	0	0	0	115.3
962	S	34.9	Very low	34	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	72%	0.717	S	S	*	*			trans	53.5	102.3	150.2	59.2	0	0	0	0	119.2
963	S	31.8	Very low	34.2	Very low	102 Å²	102	134 Å²	134	71%	0.713	72%	0.722	S	S	*	*				73.2	157.6	127.4	-141.1	0	0	0	0	120.6
964	D	37.1	Very low	34.1	Very low	131 Å²	131	130.6 Å²	130.6	70%	0.701	72%	0.717	S	S	*	*			trans	62.3	102.3	155.7	-62.5	-58.9	0	0	0	121.5
965	Q	34.7	Very low	34.2	Very low	169 Å²	169	132.7 Å²	132.7	79%	0.79	72%	0.72	S	S	*	*				76.1	153.8	124.6	-69.5	-74.3	-45.1	0	0	117.2
966	P	37.9	Very low	34.2	Very low	95 Å²	95	134 Å²	134	62%	0.617	73%	0.733	S	S	*	*				-136.9	-172.2	-121.2	44.5	-28.1	0	0	0	115.5
967	S	30.6	Very low	33.9	Very low	115 Å²	115	131.5 Å²	131.5	80%	0.804	74%	0.735	S	S	*	*			trans	63.7	103.4	149.2	-61	0	0	0	0	118.6
968	Y	29.2	Very low	34.2	Very low	230 Å²	230	131 Å²	131	90%	0.902	74%	0.741	S	S	*	*			trans	-118.7	106.6	137.9	73.9	-82.9	0	0	0	110
969	S	34.1	Very low	34.5	Very low	118 Å²	118	133.7 Å²	133.7	83%	0.825	75%	0.745	S	S	*	*			trans	-162.5	100.5	148.3	-174.2	0	0	0	0	105.7	E971	S969-E971 PolarHBondContact O-N 3.07Å
970	L	34.8	Very low	34.8	Very low	151 Å²	151	134.2 Å²	134.2	79%	0.791	74%	0.736	S	S	*	*			trans	-70.9	127	-168.3	-168.4	72.3	0	0	0	110.7
971	E	30.7	Very low	34.5	Very low	137 Å²	137	139.6 Å²	139.6	64%	0.64	74%	0.742	S	S	*	*			trans	23.1	125.6	151.4	-49.2	174	146.5	0	0	118.9	S969	S969-E971 PolarHBondContact O-N 3.07Å
972	R	40.3	Very low	34.7	Very low	191 Å²	191	138.5 Å²	138.5	72%	0.721	73%	0.731	S	S	*	*				-174.5	134.3	91.9	-93.7	164.8	-166.6	-90.1	-4.5	113.1
973	Q	37.1	Very low	34.8	Very low	139 Å²	139	141.3 Å²	141.3	65%	0.65	73%	0.731	S	S	*	*				43.4	138.3	129.2	-53.3	179.8	-89.8	0	0	119.9
974	M	36.2	Very low	35	Very low	144 Å²	144	141.2 Å²	141.2	71%	0.709	73%	0.726	S	S	*	*			cis	-173.5	148.9	-11.8	-117.8	154.9	134.8	0	0	108.1
975	N	32.5	Very low	34.8	Very low	154 Å²	154	141 Å²	141	82%	0.824	72%	0.72	S	S	*	*			trans	38.3	117.5	152	-52.3	-8.5	0	0	0	120.5
976	G	35.7	Very low	35.1	Very low	88 Å²	88	141.2 Å²	141.2	91%	0.907	71%	0.714	S	S	*	*			trans	178.5	107.3	164.2	0	0	0	0	0	115
977	D	32	Very low	35.1	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	72%	0.72	S	S	*	*			trans	-121.3	168.3	174.8	-172.2	56.5	0	0	0	108
978	P	38.9	Very low	35.2	Very low	96 Å²	96	146.2 Å²	146.2	62%	0.623	71%	0.712	S	S	*	*			cis	-113.2	-161.7	-36.4	30.8	-13	0	0	0	111.5
979	E	37.1	Very low	35.8	Very low	137 Å²	137	140.4 Å²	140.4	64%	0.64	70%	0.696	S	S	*	*			trans	118.3	141.8	150	-63.4	-138.2	116.7	0	0	118.4
980	K	35.7	Very low	36.2	Very low	147 Å²	147	143.4 Å²	143.4	64%	0.639	69%	0.694	S	S	*	*			trans	41.1	146.3	136.4	-67.2	172.4	-168	147.4	0	120.4
981	R	32.3	Very low	36.2	Very low	207 Å²	207	141.1 Å²	141.1	78%	0.781	70%	0.697	S	S	*	*			cis	-174.2	157.2	-13.3	-125.1	-175.9	-173.7	171.3	1.4	106.2
982	D	35.9	Very low	36.7	Very low	101 Å²	101	137.7 Å²	137.7	54%	0.54	70%	0.699	S	S	.	*			trans	64.8	132.6	154.3	-78.4	12	0	0	0	117.6
983	K	35.8	Very low	36.6	Very low	162 Å²	162	137.3 Å²	137.3	70%	0.704	70%	0.702	S	S	*	*				60	151.9	89.5	-46.9	-175.3	-167.3	79.2	0	112.6
984	T	36.2	Very low	36.9	Very low	100 Å²	100	135.3 Å²	135.3	61%	0.613	70%	0.696	S	S	*	*			cis	-165.3	159.4	32	-25.1	0	0	0	0	111.1
985	E	33.1	Very low	36.9	Very low	125 Å²	125	137.5 Å²	137.5	58%	0.584	70%	0.701	S	S	*	*			trans	70.8	167.2	144.8	-85.5	175.5	125.3	0	0	118.2
986	R	40.4	Very low	37.3	Very low	175 Å²	175	139 Å²	139	66%	0.66	70%	0.701	S	S	*	*			cis	-150.8	130.4	11.1	-137.6	148.2	-152.6	169.2	23.3	113
987	K	37.8	Very low	37.2	Very low	172 Å²	172	142.7 Å²	142.7	75%	0.748	69%	0.692	S	S	*	*			trans	63.5	169	142.8	-74.4	-178	-173.2	171.5	0	118.9
988	K	33.3	Very low	37.5	Very low	143 Å²	143	140.7 Å²	140.7	62%	0.622	68%	0.681	S	S	*	*			cis	177.3	169	-28.8	-174.8	178.8	157.6	-71.9	0	107.8
989	D	41.7	Very low	37.3	Very low	107 Å²	107	146 Å²	146	57%	0.572	69%	0.689	S	S	*	*			trans	72.1	148.3	166.8	-60.4	-63.9	0	0	0	114.6
990	K	41.9	Very low	37.2	Very low	181 Å²	181	145.6 Å²	145.6	79%	0.787	69%	0.687	S	S	*	*			cis	-155.1	121.2	-6.2	-125.2	161.2	175.1	175.6	0	106.4
991	A	35.2	Very low	37.2	Very low	103 Å²	103	146.1 Å²	146.1	85%	0.851	69%	0.689	S	S	*	*				64.9	110.1	75.6	0	0	0	0	0	116.4
992	G	42.1	Very low	37.4	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	68%	0.68	S	S	*	*			trans	-175	120.4	165.7	0	0	0	0	0	108.3
993	K	38.5	Very low	37.4	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	69%	0.686	S	S	*	*				69.3	130.3	72.1	-71.8	175.4	116.4	-79.7	0	112.1
994	D	43.5	Very low	37.7	Very low	97 Å²	97	142.4 Å²	142.4	52%	0.519	68%	0.681	S	S	.	*			cis	-152.5	136.7	-3.7	-103	-43.9	0	0	0	108.2
995	K	36.2	Very low	37.8	Very low	189 Å²	189	146.3 Å²	146.3	82%	0.822	69%	0.69	S	S	*	*				60.2	143.4	92.9	-73.7	-173.1	-174.7	164.6	0	117.8
996	K	40.2	Very low	38.4	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	70%	0.701	S	S	*	*			trans	71.5	129.8	170.8	-83.7	-179.3	165	-171.3	0	115.5
997	K	32.6	Very low	38.3	Very low	165 Å²	165	148.8 Å²	148.8	72%	0.717	71%	0.71	S	S	*	*			cis	69.1	94.1	31.2	-171.8	-134.8	173	-176.2	0	113.7
998	D	40.1	Very low	38.3	Very low	112 Å²	112	144.9 Å²	144.9	60%	0.599	71%	0.709	S	S	*	*				-162	148.7	116.6	-86.4	-40.5	0	0	0	106.6
999	R	32.7	Very low	38.7	Very low	208 Å²	208	147.6 Å²	147.6	79%	0.785	72%	0.721	S	S	*	*			cis	99.1	144.6	35.2	-158.7	-166.1	-168.4	-163.5	3.4	110.8
1000	E	36.1	Very low	38.5	Very low	128 Å²	128	152.4 Å²	152.4	60%	0.598	74%	0.737	S	S	*	*			trans	80.8	127	174.1	-50.6	-153.2	100.7	0	0	114.3
1001	K	35.5	Very low	38.3	Very low	159 Å²	159	147.5 Å²	147.5	69%	0.691	74%	0.738	S	S	*	*				72.7	148.7	88.8	-64.9	176	-177.2	166.2	0	112.5
1002	E	35.6	Very low	38.4	Very low	124 Å²	124	151 Å²	151	58%	0.579	74%	0.738	S	S	*	*			cis	-156.1	-168.6	6.7	-130.5	168.7	125.4	0	0	110.8
1003	K	37	Very low	38.6	Very low	154 Å²	154	154.8 Å²	154.8	67%	0.67	74%	0.743	S	S	*	*			trans	19.6	139.8	143.1	-69.2	159	178.1	154.5	0	119.2
1004	D	41.6	Very low	39	Very low	114 Å²	114	155.6 Å²	155.6	61%	0.61	75%	0.746	S	S	*	*			cis	-158	148.8	25.6	-105.9	-38.5	0	0	0	108.9
1005	K	39	Very low	39	Very low	181 Å²	181	154.1 Å²	154.1	79%	0.787	75%	0.753	S	S	*	*				58.7	154.7	84.1	-64	-171.9	-170.3	165.7	0	116.8
1006	L	44.5	Very low	39.4	Very low	156 Å²	156	153.6 Å²	153.6	82%	0.817	76%	0.759	S	S	*	*			trans	75.6	97.7	-179.6	-53.2	168.2	0	0	0	112.8
1007	K	38.4	Very low	39.6	Very low	197 Å²	197	147.7 Å²	147.7	86%	0.857	75%	0.751	S	S	*	*				51.1	104.3	72.7	-60.9	-174.5	175.4	-177.6	0	113
1008	A	38.1	Very low	40.4	Very low	89 Å²	89	146.4 Å²	146.4	74%	0.736	75%	0.752	S	S	*	*				163.8	159	91.1	0	0	0	0	0	113.9
1009	K	41.6	Very low	40.6	Very low	200 Å²	200	148.2 Å²	148.2	87%	0.87	76%	0.758	S	S	*	*			trans	61.3	109.4	152.9	-72.4	171.4	-179.5	177.7	0	120.1
1010	K	38.9	Very low	40.9	Very low	209 Å²	209	146.7 Å²	146.7	91%	0.909	76%	0.758	S	S	*	*				83.8	58.6	121.4	-154.2	-174.4	177.3	-175.8	0	119.5
1011	G	37.9	Very low	41.3	Very low	77 Å²	77	150.6 Å²	150.6	79%	0.794	77%	0.767	S	S	*	*				90.2	167.3	108.2	0	0	0	0	0	121.4
1012	M	37.2	Very low	41.4	Very low	177 Å²	177	152.6 Å²	152.6	87%	0.872	78%	0.776	S	S	*	*			trans	71.2	92.2	161.9	-163.7	173.8	74.5	0	0	119.3
1013	L	45.1	Very low	41.9	Very low	145 Å²	145	150.6 Å²	150.6	76%	0.759	79%	0.788	S	S	*	*			trans	-165.3	129.8	132	-124	69.5	0	0	0	110
1014	K	47.7	Very low	42.3	Very low	201 Å²	201	152.7 Å²	152.7	87%	0.874	80%	0.798	S	S	*	*				62.9	140.5	109.6	-78.8	-173.6	178.4	178.3	0	118.4
1015	G	42.9	Very low	42.3	Very low	65 Å²	65	155.6 Å²	155.6	67%	0.67	81%	0.807	S	S	*	*			trans	127.8	61.8	177.7	0	0	0	0	0	111.1
1016	L	45.2	Very low	42.4	Very low	178 Å²	178	157.6 Å²	157.6	93%	0.932	81%	0.81	S	S	*	*				63.1	116.6	105.5	-70.5	167.3	0	0	0	112.5
1017	G	43.6	Very low	42.5	Very low	62 Å²	62	158.6 Å²	158.6	64%	0.639	81%	0.808	S	S	*	*			cis	113.7	103	23	0	0	0	0	0	107.3
1018	D	49.6	Very low	42.5	Very low	138 Å²	138	155.5 Å²	155.5	74%	0.738	80%	0.8	S	S	*	*			cis	66.9	110.8	43.7	-160.2	15.9	0	0	0	113.2
1019	M	44	Very low	42.6	Very low	150 Å²	150	157 Å²	157	74%	0.739	80%	0.796	S	S	*	*	S	Bend	trans	-154.6	112.2	177.1	-75.9	-157	-33.7	0	0	107.1
1020	F	39.9	Very low	42.5	Very low	176 Å²	176	154.8 Å²	154.8	77%	0.772	79%	0.786	S	S	*	*			cis	-142.4	139.3	-5.5	-71.8	-89.8	0	0	0	109.7
1021	R	44.8	Very low	42.6	Very low	210 Å²	210	152.8 Å²	152.8	79%	0.792	78%	0.782	S	S	*	*			trans	-137.5	116.9	161.1	-72.5	-166.8	-164.6	-119	3.6	111.7
1022	F	36.9	Very low	42.8	Very low	202 Å²	202	156.5 Å²	156.5	89%	0.886	78%	0.779	S	S	*	*			trans	35.5	125	150.9	-54.2	-80.4	0	0	0	121.1
1023	G	45.3	Very low	43	Very low	81 Å²	81	155.5 Å²	155.5	84%	0.835	77%	0.77	S	S	*	*			trans	172	117.7	157.4	0	0	0	0	0	115.2
1024	K	46.8	Very low	42.6	Very low	199 Å²	199	157.4 Å²	157.4	87%	0.865	78%	0.777	S	S	*	*			trans	-89.5	133.4	165	-66.8	173.4	178.2	171.1	0	109.3
1025	H	41.6	Very low	42.1	Very low	175 Å²	175	151.4 Å²	151.4	81%	0.81	77%	0.772	S	S	*	*				-169.1	-179.4	112.6	-122.2	-114.2	0	0	0	113.4
1026	R	41.7	Very low	41.8	Very low	223 Å²	223	153.2 Å²	153.2	84%	0.842	76%	0.759	S	S	*	*			trans	-106.9	154.2	-163.7	-60.2	170.1	169.8	151.1	-7.3	113.8
1027	K	44.8	Very low	41.5	Very low	177 Å²	177	152.1 Å²	152.1	77%	0.77	75%	0.753	S	S	*	*				125.3	115.4	123.7	-153.5	176.3	-174.5	-173.5	0	117.1
1028	D	39.7	Very low	41.2	Very low	132 Å²	132	154.6 Å²	154.6	71%	0.706	75%	0.746	S	S	*	*			trans	29.1	145.3	141.7	-29.3	-29.9	0	0	0	120
1029	D	39.7	Very low	40.8	Very low	119 Å²	119	155.5 Å²	155.5	64%	0.636	75%	0.749	S	S	*	*			cis	-169.3	156	30.7	-155.5	-5.5	0	0	0	114
1030	K	39.5	Very low	40.3	Very low	154 Å²	154	157 Å²	157	67%	0.67	75%	0.754	S	S	*	*			trans	55	133.4	156.2	-80.7	149.5	-163.3	144.6	0	127.8
1031	M	40.6	Very low	40.2	Very low	168 Å²	168	155.8 Å²	155.8	83%	0.828	76%	0.756	S	S	*	*			trans	68.4	146.3	136.1	94.7	179.1	84.9	0	0	121.3
1032	E	41.6	Very low	39.9	Very low	154 Å²	154	151 Å²	151	72%	0.72	75%	0.754	S	S	*	*			cis	-159.3	168.3	-14.3	-143.2	-167	-130.9	0	0	112.4
1033	K	41.7	Very low	40.1	Very low	156 Å²	156	151.1 Å²	151.1	68%	0.678	76%	0.755	S	S	*	*			trans	75.9	114.3	151.3	-108.5	-179.7	-165.8	90.7	0	123.8
1034	M	38.1	Very low	40	Very low	185 Å²	185	152.3 Å²	152.3	91%	0.911	75%	0.746	S	S	*	*			trans	55.1	147.5	146.6	-62.8	173.6	-177.9	0	0	120.5
1035	G	36.8	Very low	40.5	Very low	76 Å²	76	145 Å²	145	78%	0.784	72%	0.719	S	S	*	*			cis	-148.5	-170.7	1.5	0	0	0	0	0	112.4
1036	R	36.6	Very low	42.1	Very low	103 Å²	103	144.1 Å²	144.1	39%	0.389	72%	0.716	S	S	.	*			trans	-117.8	139.8	-157.6	-66.5	-177.3	171.1	-129.9	-6.3	118.4	P1330 S1333	R1036-P1330 VanDerWaalsContact CD-O 3.28Å; R1036-P1330 WeakPolarHBondContact CD-O 3.37Å; R1036-P1330 PolarHBondContact NE-O 3.26Å; R1036-S1333 WeakPolarHBondContact CD-OXT 3.27Å; R1036-S1333 PolarHBondContact NH1-OXT 2.96Å
1037	I	38.1	Very low	43.7	Very low	155 Å²	155	139.2 Å²	139.2	80%	0.795	70%	0.703	S	S	*	*			trans	-142.9	89.9	150.3	-52.8	-176.8	0	0	0	112.3
1038	K	36.7	Very low	45.2	Very low	114 Å²	114	134 Å²	134	50%	0.496	68%	0.683	S	S	.	*			trans	-41.1	143.6	152.8	-98	-175.4	-89.6	82	0	110.9	Y1332 S1333	K1038-Y1332 PolarHBondContact NZ-O 3.33Å; K1038-S1333 WeakPolarHBondContact CA-O 3.45Å; K1038-S1333 VanDerWaalsContact CB-C 3.44Å; K1038-S1333 VanDerWaalsContact CB-O 3.3Å; K1038-S1333 WeakPolarHBondContact CB-O 3.22Å; K1038-S1333 WeakPolarHBondContact CE-OXT 3.49Å; K1038-S1333 VanDerWaalsContact CG-O 3.31Å; K1038-S1333 WeakPolarHBondContact CG-O 3.35Å; K1038-S1333 VanDerWaalsContact N-C 3.32Å; K1038-S1333 VanDerWaalsContact N-CA 3.29Å; K1038-S1333 PolarHBondContact N-O 2.99Å; K1038-S1333 PolarHBondContact NZ-OG 2.78Å; K1038-S1333 PolarHBondContact NZ-OXT 2.86Å
1039	I	42.6	Very low	47.1	Very low	157 Å²	157	136.2 Å²	136.2	81%	0.805	68%	0.681	S	S	*	*			trans	-110.7	151.9	137.9	-70.3	178.1	0	0	0	107.7
1040	Q	33.2	Very low	49.3	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	68%	0.676	S	S	*	*			trans	-82.7	125.9	-177.9	168.7	-179.4	-14.3	0	0	109.8
1041	D	38.1	Very low	51.3	Low	151 Å²	151	132.9 Å²	132.9	81%	0.807	67%	0.665	S	S	*	*			trans	-136.1	148.4	172	-133.2	-33.9	0	0	0	110.6
1042	S	38	Very low	53.2	Low	108 Å²	108	131.5 Å²	131.5	76%	0.755	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-76.5	138.9	-153.2	-62	0	0	0	0	114.4	T1044	S1042-T1044 PolarHBondContact O-N 2.92Å
1043	F	40.8	Very low	55.3	Low	206 Å²	206	130.6 Å²	130.6	90%	0.904	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-62.3	131.5	163.3	-71.5	-93.1	0	0	0	109.6	S1045	F1043-S1045 PolarHBondContact O-N 3.44Å
1044	T	44.2	Very low	57.5	Low	105 Å²	105	128.3 Å²	128.3	64%	0.644	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-64.9	132.6	164.2	43.7	0	0	0	0	109	S1042	S1042-T1044 PolarHBondContact O-N 2.92Å
1045	S	56	Low	59.5	Low	45 Å²	45	123.7 Å²	123.7	32%	0.315	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-57.2	147	-179.9	178.5	0	0	0	0	109.9	F1043 E1047 D1048 R1049	F1043-S1045 PolarHBondContact O-N 3.44Å; S1045-E1047 PolarHBondContact O-N 2.79Å; S1045-E1047 PolarHBondContact OG-N 2.87Å; S1045-E1047 VanDerWaalsContact OG-N 3.14Å; S1045-E1047 PolarHBondContact OG-OE2 2.89Å; S1045-D1048 PolarHBondContact O-N 2.77Å; S1045-R1049 PolarHBondContact O-N 2.78Å
1046	E	74.7	Confident	61.8	Low	157 Å²	157	125.9 Å²	125.9	73%	0.734	61%	0.61	S	S	*	*	H	α-helix	trans	-54	-33.4	168.6	-174.9	160.9	-162.3	0	0	110.7	D1048 R1049 V1050	E1046-D1048 PolarHBondContact O-N 3.08Å; E1046-R1049 CarbonylContact O-C 3.59Å; E1046-R1049 WeakPolarHBondContact O-CA 3.39Å; E1046-R1049 WeakPolarHBondContact O-CB 3.07Å; E1046-R1049 PolarHBondContact O-N 2.92Å; E1046-R1049 VanDerWaalsContact O-N 3.11Å; E1046-V1050 WeakPolarHBondContact O-CG2 3.46Å; E1046-V1050 PolarHBondContact O-N 3.46Å
1047	E	75.8	Confident	64.2	Low	121 Å²	121	126.5 Å²	126.5	57%	0.565	62%	0.617	S	S	*	*	H	α-helix	trans	-66.8	-30.1	174.7	-56.2	165	100.6	0	0	113.7	S1045 R1049 V1050 R1051	S1045-E1047 PolarHBondContact O-N 2.79Å; S1045-E1047 PolarHBondContact OG-N 2.87Å; S1045-E1047 VanDerWaalsContact OG-N 3.14Å; S1045-E1047 PolarHBondContact OG-OE2 2.89Å; E1047-R1049 VanDerWaalsContact C-N 3.3Å; E1047-V1050 PolarHBondContact O-N 2.64Å; E1047-R1051 VanDerWaalsContact O-CB 3.29Å; E1047-R1051 WeakPolarHBondContact O-CB 3.49Å; E1047-R1051 VanDerWaalsContact O-CG 3.23Å; E1047-R1051 WeakPolarHBondContact O-CG 3.44Å; E1047-R1051 PolarHBondContact O-N 2.8Å
1048	D	76	Confident	66.7	Low	67 Å²	67	125.2 Å²	125.2	36%	0.358	60%	0.602	S	S	.	*	H	α-helix	trans	-70.2	-32.3	171.8	-79.3	-51.8	0	0	0	111.3	S1045 E1046 R1051 M1052	S1045-D1048 PolarHBondContact O-N 2.77Å; E1046-D1048 PolarHBondContact O-N 3.08Å; D1048-R1051 IonicContact OD1-CZ 3.28Å; D1048-R1051 VanDerWaalsContact OD1-CZ 3.3Å; D1048-R1051 IonicContact OD1-NE 2.74Å; D1048-R1051 PolarHBondContact OD1-NE 3.13Å; D1048-R1051 IonicContact OD1-NH2 3.3Å; D1048-R1051 PolarHBondContact OD1-NH2 2.93Å; D1048-R1051 IonicContact OD2-NH2 3.55Å; D1048-R1051 PolarHBondContact OD2-NH2 2.71Å; D1048-M1052 WeakPolarHBondContact O-CB 3.39Å; D1048-M1052 PolarHBondContact O-N 2.83Å
1049	R	81.1	Confident	68.9	Low	178 Å²	178	124.5 Å²	124.5	67%	0.672	60%	0.603	S	S	*	*	H	α-helix	trans	-71.7	-37.3	173.5	-57.1	-176.2	66.3	-178.6	-1.9	111.3	S1045 E1046 E1047 K1053	S1045-R1049 PolarHBondContact O-N 2.78Å; E1046-R1049 CarbonylContact O-C 3.59Å; E1046-R1049 WeakPolarHBondContact O-CA 3.39Å; E1046-R1049 WeakPolarHBondContact O-CB 3.07Å; E1046-R1049 PolarHBondContact O-N 2.92Å; E1046-R1049 VanDerWaalsContact O-N 3.11Å; E1047-R1049 VanDerWaalsContact C-N 3.3Å; R1049-K1053 WeakPolarHBondContact O-CB 3.26Å; R1049-K1053 PolarHBondContact O-N 3.24Å
1050	V	85.4	Confident	71.2	Confident	85 Å²	85	122.8 Å²	122.8	52%	0.515	59%	0.591	S	S	.	*	H	α-helix	trans	-65	-51.5	171.5	173.4	0	0	0	0	110.7	E1046 E1047 M1052 K1053 E1054	E1046-V1050 WeakPolarHBondContact O-CG2 3.46Å; E1046-V1050 PolarHBondContact O-N 3.46Å; E1047-V1050 PolarHBondContact O-N 2.64Å; V1050-M1052 VanDerWaalsContact C-N 3.31Å; V1050-M1052 PolarHBondContact O-N 3.01Å; V1050-K1053 PolarHBondContact O-N 2.85Å; V1050-K1053 VanDerWaalsContact O-N 3.13Å; V1050-E1054 WeakPolarHBondContact O-CB 3.41Å; V1050-E1054 PolarHBondContact O-N 3.46Å
1051	R	82.1	Confident	73.9	Confident	119 Å²	119	116.8 Å²	116.8	45%	0.449	57%	0.573	S	S	.	*	H	α-helix	trans	-55.2	-43.7	175.9	-77	-175.4	-72.9	-97.7	11.7	112.1	E1047 D1048 E1054 E1055	E1047-R1051 VanDerWaalsContact O-CB 3.29Å; E1047-R1051 WeakPolarHBondContact O-CB 3.49Å; E1047-R1051 VanDerWaalsContact O-CG 3.23Å; E1047-R1051 WeakPolarHBondContact O-CG 3.44Å; E1047-R1051 PolarHBondContact O-N 2.8Å; D1048-R1051 IonicContact OD1-CZ 3.28Å; D1048-R1051 VanDerWaalsContact OD1-CZ 3.3Å; D1048-R1051 IonicContact OD1-NE 2.74Å; D1048-R1051 PolarHBondContact OD1-NE 3.13Å; D1048-R1051 IonicContact OD1-NH2 3.3Å; D1048-R1051 PolarHBondContact OD1-NH2 2.93Å; D1048-R1051 IonicContact OD2-NH2 3.55Å; D1048-R1051 PolarHBondContact OD2-NH2 2.71Å; R1051-E1054 PolarHBondContact O-N 2.76Å; R1051-E1055 WeakPolarHBondContact O-CB 3.4Å; R1051-E1055 PolarHBondContact O-N 3.24Å
1052	M	79.5	Confident	76.3	Confident	139 Å²	139	116.8 Å²	116.8	69%	0.685	57%	0.566	S	S	*	*	H	α-helix	trans	-65.6	-40.8	178	-171.7	-175.9	-57.3	0	0	112.2	D1048 V1050 Q1056	D1048-M1052 WeakPolarHBondContact O-CB 3.39Å; D1048-M1052 PolarHBondContact O-N 2.83Å; V1050-M1052 VanDerWaalsContact C-N 3.31Å; V1050-M1052 PolarHBondContact O-N 3.01Å; M1052-Q1056 WeakPolarHBondContact O-CB 3.43Å; M1052-Q1056 PolarHBondContact O-N 2.91Å; M1052-Q1056 VanDerWaalsContact O-N 3.07Å
1053	K	86	Confident	78.7	Confident	135 Å²	135	116.1 Å²	116.1	59%	0.587	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-44.7	174.3	-173.8	-166.8	171.8	-159.2	0	111.4	R1049 V1050 Q1056 E1057	R1049-K1053 WeakPolarHBondContact O-CB 3.26Å; R1049-K1053 PolarHBondContact O-N 3.24Å; V1050-K1053 PolarHBondContact O-N 2.85Å; V1050-K1053 VanDerWaalsContact O-N 3.13Å; K1053-Q1056 WeakPolarHBondContact O-CB 3.3Å; K1053-Q1056 PolarHBondContact O-N 3.11Å; K1053-E1057 WeakPolarHBondContact O-CB 3.48Å; K1053-E1057 PolarHBondContact O-N 3.3Å
1054	E	87.2	Confident	81.1	Confident	107 Å²	107	115.9 Å²	115.9	50%	0.5	55%	0.55	S	S	.	*	H	α-helix	trans	-64.3	-38.9	179.9	-170.8	-174.8	-167.7	0	0	111.8	V1050 R1051 E1057 R1058	V1050-E1054 WeakPolarHBondContact O-CB 3.41Å; V1050-E1054 PolarHBondContact O-N 3.46Å; R1051-E1054 PolarHBondContact O-N 2.76Å; E1054-E1057 PolarHBondContact O-N 2.78Å; E1054-R1058 VanDerWaalsContact O-CB 3.28Å; E1054-R1058 WeakPolarHBondContact O-CB 3.31Å; E1054-R1058 PolarHBondContact O-N 3.22Å
1055	E	81.1	Confident	83.2	Confident	88 Å²	88	115.2 Å²	115.2	41%	0.411	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-43.4	171.7	-165.1	69.2	-113.2	0	0	111.5	R1051 E1057 R1058 I1059	R1051-E1055 WeakPolarHBondContact O-CB 3.4Å; R1051-E1055 PolarHBondContact O-N 3.24Å; E1055-E1057 VanDerWaalsContact C-N 3.3Å; E1055-E1057 PolarHBondContact O-N 3.41Å; E1055-R1058 PolarHBondContact O-N 3.42Å; E1055-R1058 IonicContact OE1-CZ 2.71Å; E1055-R1058 IonicContact OE1-NH1 2.82Å; E1055-R1058 PolarHBondContact OE1-NH1 3.08Å; E1055-R1058 IonicContact OE2-CZ 3.14Å; E1055-R1058 IonicContact OE2-NH1 2.71Å; E1055-R1058 PolarHBondContact OE2-NH1 2.75Å; E1055-I1059 HydrophobicContact CG-CD1 4.25Å; E1055-I1059 VanDerWaalsContact O-CG1 3.27Å; E1055-I1059 WeakPolarHBondContact O-CG1 3.42Å; E1055-I1059 PolarHBondContact O-N 2.82Å
1056	Q	84.7	Confident	84.5	Confident	123 Å²	123	119.4 Å²	119.4	58%	0.575	55%	0.553	S	S	*	*	H	α-helix	trans	-63.2	-35.9	176.3	-166.7	-172.5	7.1	0	0	112.2	M1052 K1053 Q1060	M1052-Q1056 WeakPolarHBondContact O-CB 3.43Å; M1052-Q1056 PolarHBondContact O-N 2.91Å; M1052-Q1056 VanDerWaalsContact O-N 3.07Å; K1053-Q1056 WeakPolarHBondContact O-CB 3.3Å; K1053-Q1056 PolarHBondContact O-N 3.11Å; Q1056-Q1060 WeakPolarHBondContact O-CG 3.48Å; Q1056-Q1060 PolarHBondContact O-N 3.49Å; Q1056-Q1060 VanDerWaalsContact O-N 3.15Å; Q1056-Q1060 PolarHBondContact O-NE2 3.07Å; Q1056-Q1060 VanDerWaalsContact O-NE2 3.16Å
1057	E	87.3	Confident	85	Confident	116 Å²	116	121.6 Å²	121.6	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-72	-42.5	175.9	-172.5	160.1	-176.7	0	0	111.3	K1053 E1054 E1055 I1059 Q1060 A1061	K1053-E1057 WeakPolarHBondContact O-CB 3.48Å; K1053-E1057 PolarHBondContact O-N 3.3Å; E1054-E1057 PolarHBondContact O-N 2.78Å; E1055-E1057 VanDerWaalsContact C-N 3.3Å; E1055-E1057 PolarHBondContact O-N 3.41Å; E1057-I1059 VanDerWaalsContact C-N 3.33Å; E1057-I1059 PolarHBondContact O-N 2.9Å; E1057-Q1060 PolarHBondContact O-N 3.16Å; E1057-A1061 WeakPolarHBondContact O-CB 3.07Å; E1057-A1061 PolarHBondContact O-N 3.12Å
1058	R	91	Very high	85.6	Confident	128 Å²	128	120.3 Å²	120.3	48%	0.483	55%	0.548	S	S	.	.	H	α-helix	trans	-60.5	-39.9	174	-165.9	-170.8	-55.1	139.4	4.1	112.4	E1054 E1055 K1062	E1054-R1058 VanDerWaalsContact O-CB 3.28Å; E1054-R1058 WeakPolarHBondContact O-CB 3.31Å; E1054-R1058 PolarHBondContact O-N 3.22Å; E1055-R1058 PolarHBondContact O-N 3.42Å; E1055-R1058 IonicContact OE1-CZ 2.71Å; E1055-R1058 IonicContact OE1-NH1 2.82Å; E1055-R1058 PolarHBondContact OE1-NH1 3.08Å; E1055-R1058 IonicContact OE2-CZ 3.14Å; E1055-R1058 IonicContact OE2-NH1 2.71Å; E1055-R1058 PolarHBondContact OE2-NH1 2.75Å; R1058-K1062 WeakPolarHBondContact O-CB 3.01Å; R1058-K1062 PolarHBondContact O-N 2.98Å
1059	I	82.6	Confident	86.1	Confident	99 Å²	99	123.6 Å²	123.6	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-48.6	174.5	-69.6	164.9	0	0	0	110.3	E1055 E1057 A1061 K1062 T1063	E1055-I1059 HydrophobicContact CG-CD1 4.25Å; E1055-I1059 VanDerWaalsContact O-CG1 3.27Å; E1055-I1059 WeakPolarHBondContact O-CG1 3.42Å; E1055-I1059 PolarHBondContact O-N 2.82Å; E1057-I1059 VanDerWaalsContact C-N 3.33Å; E1057-I1059 PolarHBondContact O-N 2.9Å; I1059-A1061 PolarHBondContact O-N 2.79Å; I1059-K1062 PolarHBondContact O-N 3.26Å; I1059-T1063 PolarHBondContact O-N 3.35Å; I1059-T1063 PolarHBondContact O-OG1 2.84Å
1060	Q	90.1	Very high	86.1	Confident	120 Å²	120	120 Å²	120	56%	0.561	55%	0.546	S	S	*	.	H	α-helix	trans	-62.9	-40.7	178	-76.4	175.2	84.5	0	0	113.1	Q1056 E1057 K1062 T1063 R1064	Q1056-Q1060 WeakPolarHBondContact O-CG 3.48Å; Q1056-Q1060 PolarHBondContact O-N 3.49Å; Q1056-Q1060 VanDerWaalsContact O-N 3.15Å; Q1056-Q1060 PolarHBondContact O-NE2 3.07Å; Q1056-Q1060 VanDerWaalsContact O-NE2 3.16Å; E1057-Q1060 PolarHBondContact O-N 3.16Å; Q1060-K1062 VanDerWaalsContact C-N 3.32Å; Q1060-K1062 PolarHBondContact O-N 2.83Å; Q1060-T1063 PolarHBondContact O-N 2.81Å; Q1060-R1064 PolarHBondContact O-N 2.89Å
1061	A	90.2	Very high	86	Confident	56 Å²	56	118 Å²	118	46%	0.463	54%	0.539	S	S	.	.	H	α-helix	trans	-59.8	-43.1	174.6	0	0	0	0	0	111.2	E1057 I1059 R1064 E1065	E1057-A1061 WeakPolarHBondContact O-CB 3.07Å; E1057-A1061 PolarHBondContact O-N 3.12Å; I1059-A1061 PolarHBondContact O-N 2.79Å; A1061-R1064 WeakPolarHBondContact O-CB 3.44Å; A1061-R1064 PolarHBondContact O-N 2.96Å; A1061-E1065 PolarHBondContact O-N 3.33Å
1062	K	89.1	Confident	86.1	Confident	150 Å²	150	118.1 Å²	118.1	65%	0.652	54%	0.54	S	S	*	.	H	α-helix	trans	-67.3	-36.6	176.8	-167	177.9	-177.2	-175.9	0	113.1	R1058 I1059 Q1060 R1064 E1065 F1066	R1058-K1062 WeakPolarHBondContact O-CB 3.01Å; R1058-K1062 PolarHBondContact O-N 2.98Å; I1059-K1062 PolarHBondContact O-N 3.26Å; Q1060-K1062 VanDerWaalsContact C-N 3.32Å; Q1060-K1062 PolarHBondContact O-N 2.83Å; K1062-R1064 VanDerWaalsContact C-N 3.33Å; K1062-E1065 PolarHBondContact O-N 3.01Å; K1062-F1066 WeakPolarHBondContact O-CB 3.39Å; K1062-F1066 PolarHBondContact O-N 2.84Å
1063	T	89	Confident	86	Confident	95 Å²	95	118 Å²	118	58%	0.583	54%	0.537	S	S	*	.	H	α-helix	trans	-64.6	-37.5	171.7	-56.9	0	0	0	0	111.6	I1059 Q1060 R1067	I1059-T1063 PolarHBondContact O-N 3.35Å; I1059-T1063 PolarHBondContact O-OG1 2.84Å; Q1060-T1063 PolarHBondContact O-N 2.81Å; T1063-R1067 PolarHBondContact O-N 2.89Å
1064	R	90.4	Very high	85.7	Confident	200 Å²	200	120.5 Å²	120.5	76%	0.755	54%	0.543	S	S	*	.	H	α-helix	trans	-64.6	-49.4	172.9	-171.1	-172.4	-62.8	-154.5	2.2	111.4	Q1060 A1061 K1062 F1066 R1067 E1068	Q1060-R1064 PolarHBondContact O-N 2.89Å; A1061-R1064 WeakPolarHBondContact O-CB 3.44Å; A1061-R1064 PolarHBondContact O-N 2.96Å; K1062-R1064 VanDerWaalsContact C-N 3.33Å; R1064-F1066 VanDerWaalsContact C-N 3.29Å; R1064-F1066 PolarHBondContact O-N 2.88Å; R1064-R1067 PolarHBondContact O-N 3.12Å; R1064-E1068 WeakPolarHBondContact O-CB 3.46Å; R1064-E1068 PolarHBondContact O-N 3.06Å
1065	E	87.8	Confident	85.4	Confident	92 Å²	92	119.3 Å²	119.3	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-57.8	-40.3	177.7	-166.1	-157.3	157.6	0	0	111.7	A1061 K1062 E1068 R1069	A1061-E1065 PolarHBondContact O-N 3.33Å; K1062-E1065 PolarHBondContact O-N 3.01Å; E1065-E1068 PolarHBondContact O-N 3.22Å; E1065-R1069 VanDerWaalsContact O-CB 3.32Å; E1065-R1069 WeakPolarHBondContact O-CB 3.47Å; E1065-R1069 PolarHBondContact O-N 2.89Å; E1065-R1069 IonicContact OE1-CZ 3.76Å; E1065-R1069 IonicContact OE1-NH1 3.11Å; E1065-R1069 PolarHBondContact OE1-NH1 3.47Å; E1065-R1069 IonicContact OE1-NH2 3.79Å; E1065-R1069 PolarHBondContact OE1-NH2 2.85Å
1066	F	83.1	Confident	84.6	Confident	133 Å²	133	123.1 Å²	123.1	58%	0.583	55%	0.552	S	S	*	*	H	α-helix	trans	-65.5	-44.7	178	-171.6	-94.5	0	0	0	112.5	K1062 R1064 R1069 Q1070	K1062-F1066 WeakPolarHBondContact O-CB 3.39Å; K1062-F1066 PolarHBondContact O-N 2.84Å; R1064-F1066 VanDerWaalsContact C-N 3.29Å; R1064-F1066 PolarHBondContact O-N 2.88Å; F1066-R1069 PolarHBondContact O-N 3.27Å; F1066-Q1070 HydrophobicContact CE1-CG 4.27Å; F1066-Q1070 PolarHBondContact O-N 2.89Å
1067	R	86.7	Confident	84.1	Confident	202 Å²	202	119.6 Å²	119.6	76%	0.762	54%	0.544	S	S	*	.	H	α-helix	trans	-64.3	-39.6	176.2	-180	177.6	-97.9	171.6	-7.5	111.8	T1063 R1064 Q1070 A1071	T1063-R1067 PolarHBondContact O-N 2.89Å; R1064-R1067 PolarHBondContact O-N 3.12Å; R1067-Q1070 PolarHBondContact O-N 3.29Å; R1067-A1071 PolarHBondContact O-N 2.8Å
1068	E	87.6	Confident	83.3	Confident	95 Å²	95	119.5 Å²	119.5	44%	0.444	54%	0.544	S	S	.	.	H	α-helix	trans	-72.4	-30.5	177.3	-158.6	-160	-151.5	0	0	112.4	R1064 E1065 A1071 R1072	R1064-E1068 WeakPolarHBondContact O-CB 3.46Å; R1064-E1068 PolarHBondContact O-N 3.06Å; E1065-E1068 PolarHBondContact O-N 3.22Å; E1068-A1071 PolarHBondContact O-N 2.96Å; E1068-R1072 VanDerWaalsContact CD-CZ 3.43Å; E1068-R1072 PolarHBondContact O-N 2.89Å; E1068-R1072 IonicContact OE1-CZ 3.83Å; E1068-R1072 IonicContact OE1-NH1 3.96Å; E1068-R1072 IonicContact OE1-NH2 2.94Å; E1068-R1072 PolarHBondContact OE1-NH2 2.97Å; E1068-R1072 IonicContact OE2-CZ 3.96Å; E1068-R1072 VanDerWaalsContact OE2-CZ 3.26Å; E1068-R1072 IonicContact OE2-NH1 2.61Å; E1068-R1072 PolarHBondContact OE2-NH1 3.13Å; E1068-R1072 IonicContact OE2-NH2 2.88Å; E1068-R1072 PolarHBondContact OE2-NH2 3.5Å
1069	R	85.5	Confident	82.2	Confident	136 Å²	136	118.1 Å²	118.1	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-70	-39.9	171.1	-172.7	176.2	-89.3	102.7	-5.3	111.4	E1065 F1066 A1071 R1072 E1073	E1065-R1069 VanDerWaalsContact O-CB 3.32Å; E1065-R1069 WeakPolarHBondContact O-CB 3.47Å; E1065-R1069 PolarHBondContact O-N 2.89Å; E1065-R1069 IonicContact OE1-CZ 3.76Å; E1065-R1069 IonicContact OE1-NH1 3.11Å; E1065-R1069 PolarHBondContact OE1-NH1 3.47Å; E1065-R1069 IonicContact OE1-NH2 3.79Å; E1065-R1069 PolarHBondContact OE1-NH2 2.85Å; F1066-R1069 PolarHBondContact O-N 3.27Å; R1069-A1071 VanDerWaalsContact C-N 3.28Å; R1069-A1071 PolarHBondContact O-N 2.89Å; R1069-R1072 PolarHBondContact O-N 3.01Å; R1069-E1073 VanDerWaalsContact O-CB 3.26Å; R1069-E1073 WeakPolarHBondContact O-CB 3.41Å; R1069-E1073 PolarHBondContact O-N 2.75Å
1070	Q	81.2	Confident	81.1	Confident	101 Å²	101	119.7 Å²	119.7	47%	0.472	55%	0.55	S	S	.	*	H	α-helix	trans	-62.8	-32.1	170.8	-88.2	-166.2	-20.3	0	0	113.3	F1066 R1067 R1074	F1066-Q1070 HydrophobicContact CE1-CG 4.27Å; F1066-Q1070 PolarHBondContact O-N 2.89Å; R1067-Q1070 PolarHBondContact O-N 3.29Å; Q1070-R1074 PolarHBondContact O-N 2.81Å; Q1070-R1074 VanDerWaalsContact O-N 3.16Å
1071	A	85.1	Confident	79.4	Confident	45 Å²	45	118.9 Å²	118.9	37%	0.372	55%	0.549	S	S	.	.	H	α-helix	trans	-64.9	-56.1	171.8	0	0	0	0	0	110.5	R1067 E1068 R1069 E1073 R1074 D1075	R1067-A1071 PolarHBondContact O-N 2.8Å; E1068-A1071 PolarHBondContact O-N 2.96Å; R1069-A1071 VanDerWaalsContact C-N 3.28Å; R1069-A1071 PolarHBondContact O-N 2.89Å; A1071-E1073 PolarHBondContact O-N 2.67Å; A1071-R1074 CarbonylContact O-C 3.5Å; A1071-R1074 WeakPolarHBondContact O-CA 3.45Å; A1071-R1074 VanDerWaalsContact O-CB 3.28Å; A1071-R1074 WeakPolarHBondContact O-CB 3.5Å; A1071-R1074 PolarHBondContact O-N 3.36Å; A1071-D1075 PolarHBondContact O-N 2.86Å
1072	R	83.3	Confident	77.5	Confident	121 Å²	121	122.3 Å²	122.3	46%	0.457	55%	0.554	S	S	.	*	H	α-helix	trans	-58.3	-33.1	177.4	-67.3	-173.1	-170.2	92.3	-1	113.9	E1068 R1069 R1074 D1075 Y1076	E1068-R1072 VanDerWaalsContact CD-CZ 3.43Å; E1068-R1072 PolarHBondContact O-N 2.89Å; E1068-R1072 IonicContact OE1-CZ 3.83Å; E1068-R1072 IonicContact OE1-NH1 3.96Å; E1068-R1072 IonicContact OE1-NH2 2.94Å; E1068-R1072 PolarHBondContact OE1-NH2 2.97Å; E1068-R1072 IonicContact OE2-CZ 3.96Å; E1068-R1072 VanDerWaalsContact OE2-CZ 3.26Å; E1068-R1072 IonicContact OE2-NH1 2.61Å; E1068-R1072 PolarHBondContact OE2-NH1 3.13Å; E1068-R1072 IonicContact OE2-NH2 2.88Å; E1068-R1072 PolarHBondContact OE2-NH2 3.5Å; R1069-R1072 PolarHBondContact O-N 3.01Å; R1072-R1074 VanDerWaalsContact C-N 3.34Å; R1072-D1075 WeakPolarHBondContact CA-OD2 3.14Å; R1072-D1075 PolarHBondContact O-N 3.49Å; R1072-Y1076 WeakPolarHBondContact O-CB 3.36Å; R1072-Y1076 WeakPolarHBondContact O-CD2 3.41Å; R1072-Y1076 PolarHBondContact O-N 2.95Å
1073	E	77.4	Confident	75.8	Confident	135 Å²	135	123 Å²	123	63%	0.631	56%	0.559	S	S	*	*	H	α-helix	trans	-70.5	-30.6	175.9	-171	167.7	-151.2	0	0	112	R1069 A1071 A1077	R1069-E1073 VanDerWaalsContact O-CB 3.26Å; R1069-E1073 WeakPolarHBondContact O-CB 3.41Å; R1069-E1073 PolarHBondContact O-N 2.75Å; A1071-E1073 PolarHBondContact O-N 2.67Å; E1073-A1077 PolarHBondContact O-N 2.86Å
1074	R	80	Confident	73.8	Confident	188 Å²	188	128.2 Å²	128.2	71%	0.709	57%	0.569	S	S	*	*	H	α-helix	trans	-69.7	-49	165.7	-104.9	-167.7	174.3	90	0.7	111.9	Q1070 A1071 R1072 Y1076 A1077 E1078	Q1070-R1074 PolarHBondContact O-N 2.81Å; Q1070-R1074 VanDerWaalsContact O-N 3.16Å; A1071-R1074 CarbonylContact O-C 3.5Å; A1071-R1074 WeakPolarHBondContact O-CA 3.45Å; A1071-R1074 VanDerWaalsContact O-CB 3.28Å; A1071-R1074 WeakPolarHBondContact O-CB 3.5Å; A1071-R1074 PolarHBondContact O-N 3.36Å; R1072-R1074 VanDerWaalsContact C-N 3.34Å; R1074-Y1076 PolarHBondContact O-N 2.95Å; R1074-A1077 WeakPolarHBondContact O-CB 3.49Å; R1074-A1077 PolarHBondContact O-N 2.85Å; R1074-E1078 PolarHBondContact O-N 3.23Å
1075	D	79.8	Confident	71.8	Confident	82 Å²	82	123.3 Å²	123.3	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-56.2	-41.8	-179.7	-51.9	-25	0	0	0	110.7	A1071 R1072 E1078 I1079	A1071-D1075 PolarHBondContact O-N 2.86Å; R1072-D1075 WeakPolarHBondContact CA-OD2 3.14Å; R1072-D1075 PolarHBondContact O-N 3.49Å; D1075-E1078 PolarHBondContact O-N 3.02Å; D1075-I1079 WeakPolarHBondContact O-CB 3.43Å; D1075-I1079 WeakPolarHBondContact O-CD1 3.42Å; D1075-I1079 WeakPolarHBondContact O-CG1 3.36Å; D1075-I1079 PolarHBondContact O-N 3.02Å
1076	Y	65.5	Low	69.7	Low	168 Å²	168	127.2 Å²	127.2	66%	0.659	58%	0.577	S	S	*	*	H	α-helix	trans	-67.1	-32.3	175.4	-101.6	-79.4	0	0	0	114.3	R1072 R1074 Q1080	R1072-Y1076 WeakPolarHBondContact O-CB 3.36Å; R1072-Y1076 WeakPolarHBondContact O-CD2 3.41Å; R1072-Y1076 PolarHBondContact O-N 2.95Å; R1074-Y1076 PolarHBondContact O-N 2.95Å; Y1076-Q1080 WeakPolarHBondContact O-CG 3.5Å; Y1076-Q1080 PolarHBondContact O-N 2.8Å
1077	A	72.9	Confident	67.4	Low	50 Å²	50	124.7 Å²	124.7	41%	0.413	59%	0.589	S	S	.	*	H	α-helix	trans	-71.6	-44.8	174.2	0	0	0	0	0	110.8	E1073 R1074 I1079 Q1080 D1081	E1073-A1077 PolarHBondContact O-N 2.86Å; R1074-A1077 WeakPolarHBondContact O-CB 3.49Å; R1074-A1077 PolarHBondContact O-N 2.85Å; A1077-I1079 VanDerWaalsContact C-N 3.34Å; A1077-I1079 PolarHBondContact O-N 3.41Å; A1077-Q1080 PolarHBondContact O-N 3.45Å; A1077-D1081 PolarHBondContact O-N 3.07Å
1078	E	72.3	Confident	64.8	Low	114 Å²	114	121.2 Å²	121.2	53%	0.533	59%	0.593	S	S	.	*	H	α-helix	trans	-60.1	-42	177.6	-171.7	165.5	177.4	0	0	111.6	R1074 D1075 Q1080 D1081 F1082	R1074-E1078 PolarHBondContact O-N 3.23Å; D1075-E1078 PolarHBondContact O-N 3.02Å; E1078-Q1080 VanDerWaalsContact C-N 3.31Å; E1078-Q1080 PolarHBondContact O-N 3.35Å; E1078-D1081 PolarHBondContact O-N 3.39Å; E1078-F1082 HydrophobicContact CG-CD2 4.07Å; E1078-F1082 HydrophobicContact CG-CE2 3.89Å; E1078-F1082 VanDerWaalsContact O-CD2 3.31Å; E1078-F1082 WeakPolarHBondContact O-CD2 3.18Å; E1078-F1082 PolarHBondContact O-N 2.91Å
1079	I	67.6	Low	62.4	Low	98 Å²	98	123.8 Å²	123.8	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-62.3	-33.8	173.7	-68.8	163.9	0	0	0	112.5	D1075 A1077 H1083	D1075-I1079 WeakPolarHBondContact O-CB 3.43Å; D1075-I1079 WeakPolarHBondContact O-CD1 3.42Å; D1075-I1079 WeakPolarHBondContact O-CG1 3.36Å; D1075-I1079 PolarHBondContact O-N 3.02Å; A1077-I1079 VanDerWaalsContact C-N 3.34Å; A1077-I1079 PolarHBondContact O-N 3.41Å; I1079-H1083 PolarHBondContact O-N 3.44Å
1080	Q	59.6	Low	60.1	Low	133 Å²	133	124.6 Å²	124.6	62%	0.621	63%	0.625	S	S	*	*	H	α-helix	trans	-72.3	-33.6	175.3	-75.3	-171.9	21	0	0	112.9	Y1076 A1077 E1078 H1083 R1084	Y1076-Q1080 WeakPolarHBondContact O-CG 3.5Å; Y1076-Q1080 PolarHBondContact O-N 2.8Å; A1077-Q1080 PolarHBondContact O-N 3.45Å; E1078-Q1080 VanDerWaalsContact C-N 3.31Å; E1078-Q1080 PolarHBondContact O-N 3.35Å; Q1080-H1083 PolarHBondContact O-N 2.69Å; Q1080-R1084 PolarHBondContact O-N 3.08Å
1081	D	53.4	Low	58	Low	102 Å²	102	127 Å²	127	55%	0.545	64%	0.636	S	S	.	*	H	α-helix	trans	-72.5	-38.5	175.7	-75.5	-30.7	0	0	0	111.8	A1077 E1078 H1083 R1084 T1085	A1077-D1081 PolarHBondContact O-N 3.07Å; E1078-D1081 PolarHBondContact O-N 3.39Å; D1081-H1083 VanDerWaalsContact C-N 3.27Å; D1081-H1083 PolarHBondContact O-N 2.82Å; D1081-R1084 WeakPolarHBondContact O-CB 3.11Å; D1081-R1084 PolarHBondContact O-N 2.86Å; D1081-T1085 PolarHBondContact O-OG1 3.12Å
1082	F	50	Low	55.9	Low	129 Å²	129	132.7 Å²	132.7	57%	0.566	66%	0.659	S	S	*	*	H	α-helix	trans	-56.2	-40	171.1	-90.4	-71.6	0	0	0	112.7	E1078 R1084 T1085	E1078-F1082 HydrophobicContact CG-CD2 4.07Å; E1078-F1082 HydrophobicContact CG-CE2 3.89Å; E1078-F1082 VanDerWaalsContact O-CD2 3.31Å; E1078-F1082 WeakPolarHBondContact O-CD2 3.18Å; E1078-F1082 PolarHBondContact O-N 2.91Å; F1082-R1084 PolarHBondContact O-N 2.88Å; F1082-T1085 PolarHBondContact O-N 2.82Å; F1082-T1085 PolarHBondContact O-OG1 2.85Å
1083	H	54.1	Low	53.8	Low	163 Å²	163	133.7 Å²	133.7	76%	0.755	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-7.7	177	-107.1	-65.9	0	0	0	114.7	I1079 Q1080 D1081	I1079-H1083 PolarHBondContact O-N 3.44Å; Q1080-H1083 PolarHBondContact O-N 2.69Å; D1081-H1083 VanDerWaalsContact C-N 3.27Å; D1081-H1083 PolarHBondContact O-N 2.82Å
1084	R	47.4	Very low	51.8	Low	206 Å²	206	138 Å²	138	78%	0.777	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-13.9	177.8	-168.4	177.3	-67.3	-88.3	-0.7	113.2	Q1080 D1081 F1082	Q1080-R1084 PolarHBondContact O-N 3.08Å; D1081-R1084 WeakPolarHBondContact O-CB 3.11Å; D1081-R1084 PolarHBondContact O-N 2.86Å; F1082-R1084 PolarHBondContact O-N 2.88Å
1085	T	48.6	Very low	49.8	Very low	97 Å²	97	132.9 Å²	132.9	60%	0.595	69%	0.691	S	S	*	*	S	Bend	trans	-106.6	-5.2	-169.7	38.8	0	0	0	0	116.5	D1081 F1082	D1081-T1085 PolarHBondContact O-OG1 3.12Å; F1082-T1085 PolarHBondContact O-N 2.82Å; F1082-T1085 PolarHBondContact O-OG1 2.85Å
1086	F	43.3	Very low	47.7	Very low	173 Å²	173	132.2 Å²	132.2	76%	0.759	70%	0.704	S	S	*	*			trans	-136.6	125.5	179.6	-67.9	-83.6	0	0	0	112.1
1087	G	34.3	Very low	46.4	Very low	81 Å²	81	133.4 Å²	133.4	84%	0.835	72%	0.718	S	S	*	*			trans	113.2	121.9	-175.4	0	0	0	0	0	112
1088	C	33.1	Very low	44.6	Very low	128 Å²	128	135.4 Å²	135.4	87%	0.865	73%	0.729	S	S	*	*			cis	-150.1	136.2	3.7	-161.4	0	0	0	0	110.3
1089	D	35.4	Very low	42.8	Very low	150 Å²	150	135.2 Å²	135.2	80%	0.802	74%	0.74	S	S	*	*			trans	-72.9	152.2	160.1	-59.7	-85.1	0	0	0	110.1
1090	D	37.1	Very low	41.4	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	75%	0.752	S	S	*	*				-167.9	163.5	115.4	-129.5	-33.3	0	0	0	113.7
1091	E	37.6	Very low	40.3	Very low	153 Å²	153	141.8 Å²	141.8	72%	0.715	76%	0.762	S	S	*	*			trans	18.9	117.8	167.9	-55	-161.1	99.6	0	0	121.1
1092	L	41.1	Very low	39.3	Very low	163 Å²	163	140.2 Å²	140.2	85%	0.853	77%	0.77	S	S	*	*				-170.6	158.8	89.5	-97.5	176.9	0	0	0	113.1
1093	L	38.7	Very low	38.4	Very low	143 Å²	143	140 Å²	140	75%	0.749	78%	0.783	S	S	*	*			trans	-93.6	162.2	-164.7	-90.2	62.8	0	0	0	115.6
1094	Y	36.4	Very low	37.5	Very low	224 Å²	224	140.2 Å²	140.2	88%	0.878	79%	0.789	S	S	*	*			trans	104.5	102.5	135.8	-128.6	-95.5	0	0	0	120.5
1095	G	38.1	Very low	36.9	Very low	81 Å²	81	134.1 Å²	134.1	84%	0.835	78%	0.782	S	S	*	*			trans	78.8	131.3	149.2	0	0	0	0	0	118.2
1096	G	36.4	Very low	36.4	Very low	69 Å²	69	136.6 Å²	136.6	71%	0.711	79%	0.791	S	S	*	*			cis	146	145.1	-10.9	0	0	0	0	0	113.5
1097	M	37.8	Very low	35.8	Very low	192 Å²	192	135.2 Å²	135.2	95%	0.946	79%	0.792	S	S	*	*			trans	69	153.6	160.1	-63.4	178	74.7	0	0	117.1
1098	S	34.5	Very low	35.9	Very low	93 Å²	93	135.8 Å²	135.8	65%	0.65	79%	0.789	S	S	*	*			cis	-173.8	131.1	-15.6	160.3	0	0	0	0	111.7
1099	S	34.8	Very low	35.9	Very low	110 Å²	110	141 Å²	141	77%	0.769	79%	0.79	S	S	*	*			trans	56.7	177.9	153.1	-131.4	0	0	0	0	117.2
1100	Y	36.9	Very low	35.9	Very low	191 Å²	191	138.4 Å²	138.4	75%	0.749	78%	0.781	S	S	*	*			cis	-147.9	146.3	4	53.6	-87.7	0	0	0	108.4
1101	E	36.4	Very low	35.9	Very low	177 Å²	177	140.1 Å²	140.1	83%	0.827	78%	0.784	S	S	*	*				62.7	135.8	95.7	-155.5	172.2	-142.3	0	0	114.5
1102	G	34.2	Very low	35.7	Very low	69 Å²	69	137.9 Å²	137.9	71%	0.711	79%	0.786	S	S	*	*			cis	-168.6	-174.1	1.7	0	0	0	0	0	111.3
1103	C	29.7	Very low	35.6	Very low	125 Å²	125	135.2 Å²	135.2	85%	0.845	78%	0.778	S	S	*	*			trans	-77.4	162.9	-175.8	-55	0	0	0	0	114.2
1104	L	36.1	Very low	35.3	Very low	168 Å²	168	138.8 Å²	138.8	88%	0.88	78%	0.781	S	S	*	*				179.9	129.4	116.2	-95.1	168.1	0	0	0	115.5
1105	A	35	Very low	35.2	Very low	77 Å²	77	135.6 Å²	135.6	64%	0.636	78%	0.775	S	S	*	*			trans	45.7	123.4	133.2	0	0	0	0	0	124.5
1106	L	37.1	Very low	35.1	Very low	149 Å²	149	135.2 Å²	135.2	78%	0.78	77%	0.771	S	S	*	*			trans	79.9	116.5	133.5	-65	168.9	0	0	0	122.9
1107	N	30.7	Very low	35.1	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	77%	0.771	S	S	*	*			trans	67.3	123	135.1	-69.7	-14.6	0	0	0	123.6
1108	A	36.6	Very low	35.1	Very low	93 Å²	93	137.8 Å²	137.8	77%	0.769	77%	0.766	S	S	*	*			trans	76.6	99.2	137.5	0	0	0	0	0	121.9
1109	R	32.5	Very low	35.1	Very low	238 Å²	238	139.6 Å²	139.6	90%	0.898	77%	0.766	S	S	*	*				66.5	150	123.1	-160.7	-177.4	179	179	1.7	118.9
1110	P	36.9	Very low	35	Very low	94 Å²	94	140.4 Å²	140.4	61%	0.61	76%	0.761	S	S	*	*			cis	-127.1	-161.6	-40.5	40.6	-23.9	0	0	0	112.6
1111	Q	36.3	Very low	35.1	Very low	189 Å²	189	136.7 Å²	136.7	88%	0.883	76%	0.758	S	S	*	*			trans	84.8	159.8	157.1	-76.9	172	-21.5	0	0	119
1112	S	34.2	Very low	35	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	75%	0.753	S	S	*	*			trans	-110.2	-167.2	-165.8	58.5	0	0	0	0	109.9
1113	P	37.8	Very low	35	Very low	106 Å²	106	141 Å²	141	69%	0.688	76%	0.757	S	S	*	*			cis	-145	162.3	6.2	43.7	-24.3	0	0	0	119.3
1114	R	33.8	Very low	35.2	Very low	219 Å²	219	138.7 Å²	138.7	83%	0.826	75%	0.747	S	S	*	*			trans	59.5	163.2	130.4	-158.9	176.2	-166.1	-127.6	14.4	122.3
1115	E	32.4	Very low	35.1	Very low	157 Å²	157	139.1 Å²	139.1	73%	0.734	74%	0.744	S	S	*	*			trans	88.7	150.9	156.8	-98.9	138.7	-115.3	0	0	121.6
1116	G	37.4	Very low	35	Very low	73 Å²	73	141.2 Å²	141.2	75%	0.753	75%	0.749	S	S	*	*			trans	83.2	89.2	-176.6	0	0	0	0	0	114.4
1117	H	35.6	Very low	34.8	Very low	155 Å²	155	143.6 Å²	143.6	72%	0.718	75%	0.753	S	S	*	*			cis	77.8	147.8	33	-141.1	-78.7	0	0	0	114.8
1118	L	39.1	Very low	35.1	Very low	160 Å²	160	146.1 Å²	146.1	84%	0.838	76%	0.757	S	S	*	*			trans	82.6	141.3	-174	-62.4	134.8	0	0	0	116.7
1119	M	33	Very low	35.2	Very low	131 Å²	131	147 Å²	147	65%	0.645	75%	0.754	S	S	*	*			cis	175.4	161.8	-48.2	-98.3	-71.8	-170.9	0	0	108.6
1120	D	33.2	Very low	35.1	Very low	126 Å²	126	146.9 Å²	146.9	67%	0.674	75%	0.754	S	S	*	*			trans	73.9	143.6	139.3	-93.2	-43.5	0	0	0	125.3
1121	T	39.9	Very low	34.6	Very low	113 Å²	113	147.8 Å²	147.8	69%	0.693	76%	0.763	S	S	*	*			trans	71.5	152.4	145.8	67.6	0	0	0	0	122.1
1122	L	34.2	Very low	34.6	Very low	138 Å²	138	144.1 Å²	144.1	72%	0.723	76%	0.758	S	S	*	*			cis	-164	157.5	-34.8	-97.2	-171.2	0	0	0	108.6
1123	Y	33.3	Very low	34.7	Very low	199 Å²	199	149.1 Å²	149.1	78%	0.78	77%	0.766	S	S	*	*			trans	58.3	103.5	144.5	-83.3	-134.1	0	0	0	122.5
1124	A	34.1	Very low	34.7	Very low	77 Å²	77	150.2 Å²	150.2	64%	0.636	77%	0.773	S	S	*	*				30	120.9	114.5	0	0	0	0	0	122.8
1125	Q	34.6	Very low	34.8	Very low	177 Å²	177	143.2 Å²	143.2	83%	0.827	77%	0.77	S	S	*	*				-176.1	128	129.9	-99.8	155.7	92.1	0	0	108.2
1126	V	31.3	Very low	34.8	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	78%	0.775	S	S	*	*			cis	68.8	85.5	49.1	-171.4	0	0	0	0	114.2
1127	K	34.5	Very low	34.9	Very low	199 Å²	199	145.6 Å²	145.6	87%	0.865	78%	0.78	S	S	*	*			trans	-176.3	141.9	133.1	-100.4	153.6	-171.5	170.9	0	114.3
1128	K	37.2	Very low	34.8	Very low	197 Å²	197	145.8 Å²	145.8	86%	0.857	79%	0.786	S	S	*	*			trans	-82.3	172.4	159	-60.4	175.5	179.4	175.7	0	107.9
1129	P	37.8	Very low	34.6	Very low	111 Å²	111	150.3 Å²	150.3	72%	0.721	79%	0.792	S	S	*	*			cis	-153.5	-167.7	23.1	45.9	-24.3	0	0	0	118.5
1130	R	30.1	Very low	35.2	Very low	237 Å²	237	148.7 Å²	148.7	89%	0.894	79%	0.793	S	S	*	*			trans	74.8	104.3	149.3	-81.3	177.7	174.8	165.2	-1.7	122
1131	S	26.5	Very low	36	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	80%	0.799	S	S	*	*				73.9	108.1	113.9	177.2	0	0	0	0	122.4
1132	S	36.1	Very low	36.4	Very low	113 Å²	113	146.9 Å²	146.9	79%	0.79	79%	0.788	S	S	*	*				-174.4	106.7	123.5	41	0	0	0	0	116.8
1133	K	36.5	Very low	37.6	Very low	211 Å²	211	143.3 Å²	143.3	92%	0.917	78%	0.775	S	S	*	*			trans	55.8	166.6	144.9	-79.9	-170.1	174.8	-174.9	0	121.1
1134	P	38.2	Very low	38.9	Very low	128 Å²	128	139.6 Å²	139.6	83%	0.831	77%	0.769	S	S	*	*			trans	-114.9	171.8	-144.9	43	-36.9	0	0	0	117.5
1135	G	35.4	Very low	41.1	Very low	73 Å²	73	141.7 Å²	141.7	75%	0.753	77%	0.765	S	S	*	*			trans	-170.6	146.3	163.6	0	0	0	0	0	111.6
1136	D	33	Very low	43.2	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	75%	0.745	S	S	*	*			trans	-91.1	151.6	-168.8	-67.2	-80	0	0	0	115.7
1137	S	38.5	Very low	45.1	Very low	123 Å²	123	138.8 Å²	138.8	86%	0.86	74%	0.739	S	S	*	*			trans	-172.2	85.1	144.3	-85.6	0	0	0	0	113.1
1138	N	34.6	Very low	47.1	Very low	158 Å²	158	133.9 Å²	133.9	85%	0.845	72%	0.721	S	S	*	*			trans	-95	108.4	163.6	-82.4	-46.7	0	0	0	109.8
1139	R	34.6	Very low	49.2	Very low	255 Å²	255	129.8 Å²	129.8	96%	0.962	71%	0.705	S	S	*	*			trans	-103.9	54.5	175.9	-153.6	-180	-165.2	-162.6	5.2	112.1
1140	S	45.8	Very low	51.2	Low	97 Å²	97	132 Å²	132	68%	0.678	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-61.7	155.7	172.1	48.1	0	0	0	0	111.9
1141	T	50.7	Low	53.8	Low	127 Å²	127	125.2 Å²	125.2	78%	0.779	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-49.4	138	173.1	47	0	0	0	0	111.3	S1143	T1141-S1143 PolarHBondContact O-N 3.46Å
1142	P	47	Very low	56.5	Low	74 Å²	74	128.3 Å²	128.3	48%	0.481	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-58.8	129.1	-172.8	24.4	-34.1	0	0	0	110.8	D1146	P1142-D1146 HydrophobicContact CB-CB 4.39Å
1143	S	60.6	Low	58.8	Low	63 Å²	63	128.8 Å²	128.8	44%	0.441	67%	0.665	S	S	.	*	P	Polyproline II helix	trans	-58.5	151.1	173.7	176.7	0	0	0	0	109.7	T1141 H1145 D1146 R1147	T1141-S1143 PolarHBondContact O-N 3.46Å; S1143-H1145 PolarHBondContact O-N 2.89Å; S1143-H1145 VanDerWaalsContact O-N 3.11Å; S1143-H1145 PolarHBondContact OG-N 3.43Å; S1143-D1146 WeakPolarHBondContact CB-OD2 3.41Å; S1143-D1146 PolarHBondContact N-OD2 3.21Å; S1143-D1146 VanDerWaalsContact N-OD2 3.14Å; S1143-D1146 PolarHBondContact O-N 3.4Å; S1143-R1147 PolarHBondContact O-N 2.83Å
1144	N	60.8	Low	60.9	Low	122 Å²	122	124.2 Å²	124.2	65%	0.652	65%	0.646	S	S	*	*	H	α-helix	trans	-53.8	-31.1	168.7	-93.7	-23.5	0	0	0	111	R1147 I1148	N1144-R1147 PolarHBondContact O-N 2.86Å; N1144-I1148 WeakPolarHBondContact O-CB 3.33Å; N1144-I1148 WeakPolarHBondContact O-CD1 3.4Å; N1144-I1148 WeakPolarHBondContact O-CG1 3.22Å; N1144-I1148 PolarHBondContact O-N 2.92Å
1145	H	79.7	Confident	62.8	Low	120 Å²	120	125 Å²	125	56%	0.556	64%	0.637	S	S	*	*	H	α-helix	trans	-65.7	-47.2	173.8	-160.8	80	0	0	0	112.6	S1143 R1147 I1148 Q1149	S1143-H1145 PolarHBondContact O-N 2.89Å; S1143-H1145 VanDerWaalsContact O-N 3.11Å; S1143-H1145 PolarHBondContact OG-N 3.43Å; H1145-R1147 VanDerWaalsContact C-N 3.27Å; H1145-R1147 PolarHBondContact O-N 2.91Å; H1145-I1148 PolarHBondContact O-N 2.64Å; H1145-Q1149 PolarHBondContact CD2-NE2 2.71Å; H1145-Q1149 PolarHBondContact NE2-NE2 3.22Å; H1145-Q1149 WeakPolarHBondContact O-CB 3.33Å; H1145-Q1149 WeakPolarHBondContact O-CG 3.41Å; H1145-Q1149 PolarHBondContact O-N 3.19Å
1146	D	78.7	Confident	64.8	Low	75 Å²	75	127.8 Å²	127.8	40%	0.401	63%	0.63	S	S	.	*	H	α-helix	trans	-63	-35.2	175.7	-60	-44.2	0	0	0	112.2	P1142 S1143 R1150	P1142-D1146 HydrophobicContact CB-CB 4.39Å; S1143-D1146 WeakPolarHBondContact CB-OD2 3.41Å; S1143-D1146 PolarHBondContact N-OD2 3.21Å; S1143-D1146 VanDerWaalsContact N-OD2 3.14Å; S1143-D1146 PolarHBondContact O-N 3.4Å; D1146-R1150 WeakPolarHBondContact O-CB 3.36Å; D1146-R1150 PolarHBondContact O-N 2.85Å
1147	R	71	Confident	66.7	Low	163 Å²	163	125.7 Å²	125.7	62%	0.615	62%	0.616	S	S	*	*	H	α-helix	trans	-70.5	-40.3	178.3	-159.6	176.8	-166.2	-179.2	4.4	111.2	S1143 N1144 H1145 L1151	S1143-R1147 PolarHBondContact O-N 2.83Å; N1144-R1147 PolarHBondContact O-N 2.86Å; H1145-R1147 VanDerWaalsContact C-N 3.27Å; H1145-R1147 PolarHBondContact O-N 2.91Å; R1147-L1151 HydrophobicContact CG-CD1 4.45Å; R1147-L1151 WeakPolarHBondContact O-CB 3.43Å; R1147-L1151 VanDerWaalsContact O-CG 3.3Å; R1147-L1151 WeakPolarHBondContact O-CG 3.49Å; R1147-L1151 PolarHBondContact O-N 3.08Å
1148	I	76.7	Confident	68.2	Low	96 Å²	96	122.1 Å²	122.1	49%	0.492	59%	0.593	S	S	.	*	H	α-helix	trans	-71.5	-36.6	174.6	-69.5	164.9	0	0	0	111.3	N1144 H1145 R1152	N1144-I1148 WeakPolarHBondContact O-CB 3.33Å; N1144-I1148 WeakPolarHBondContact O-CD1 3.4Å; N1144-I1148 WeakPolarHBondContact O-CG1 3.22Å; N1144-I1148 PolarHBondContact O-N 2.92Å; H1145-I1148 PolarHBondContact O-N 2.64Å; I1148-R1152 WeakPolarHBondContact O-CB 3.48Å; I1148-R1152 WeakPolarHBondContact O-CG 3.26Å; I1148-R1152 PolarHBondContact O-N 3.31Å
1149	Q	81.6	Confident	69.7	Low	110 Å²	110	120.8 Å²	120.8	51%	0.514	58%	0.58	S	S	.	*	H	α-helix	trans	-64.3	-47.3	172.5	-76.4	-162.1	20.7	0	0	111.3	H1145 R1152 Q1153	H1145-Q1149 PolarHBondContact CD2-NE2 2.71Å; H1145-Q1149 PolarHBondContact NE2-NE2 3.22Å; H1145-Q1149 WeakPolarHBondContact O-CB 3.33Å; H1145-Q1149 WeakPolarHBondContact O-CG 3.41Å; H1145-Q1149 PolarHBondContact O-N 3.19Å; Q1149-R1152 PolarHBondContact O-N 2.94Å; Q1149-Q1153 WeakPolarHBondContact O-CB 3.2Å; Q1149-Q1153 PolarHBondContact O-N 3.22Å
1150	R	80.1	Confident	70.9	Confident	157 Å²	157	115.4 Å²	115.4	59%	0.592	57%	0.566	S	S	*	*	H	α-helix	trans	-59.4	-47.6	173.7	-96.4	-177	-91.6	-169.6	-10.2	111.9	D1146 R1152 Q1153 E1154	D1146-R1150 WeakPolarHBondContact O-CB 3.36Å; D1146-R1150 PolarHBondContact O-N 2.85Å; R1150-R1152 VanDerWaalsContact C-N 3.3Å; R1150-R1152 PolarHBondContact O-N 2.94Å; R1150-Q1153 PolarHBondContact O-N 3.02Å; R1150-Q1153 VanDerWaalsContact O-N 3.09Å; R1150-E1154 WeakPolarHBondContact O-CB 3.28Å; R1150-E1154 PolarHBondContact O-N 3.38Å
1151	L	83.7	Confident	71.4	Confident	96 Å²	96	115.5 Å²	115.5	50%	0.503	56%	0.559	S	S	.	*	H	α-helix	trans	-60.7	-35.4	175.7	-77	165.7	0	0	0	112.8	R1147 F1155	R1147-L1151 HydrophobicContact CG-CD1 4.45Å; R1147-L1151 WeakPolarHBondContact O-CB 3.43Å; R1147-L1151 VanDerWaalsContact O-CG 3.3Å; R1147-L1151 WeakPolarHBondContact O-CG 3.49Å; R1147-L1151 PolarHBondContact O-N 3.08Å; L1151-F1155 WeakPolarHBondContact O-CB 3.34Å; L1151-F1155 PolarHBondContact O-N 3.05Å
1152	R	82.6	Confident	71.5	Confident	177 Å²	177	115.9 Å²	115.9	67%	0.668	55%	0.551	S	S	*	*	H	α-helix	trans	-67.3	-41	172.3	-82.9	-171.6	175.4	-140.8	0.9	112.4	I1148 Q1149 R1150 F1155 Q1156	I1148-R1152 WeakPolarHBondContact O-CB 3.48Å; I1148-R1152 WeakPolarHBondContact O-CG 3.26Å; I1148-R1152 PolarHBondContact O-N 3.31Å; Q1149-R1152 PolarHBondContact O-N 2.94Å; R1150-R1152 VanDerWaalsContact C-N 3.3Å; R1150-R1152 PolarHBondContact O-N 2.94Å; R1152-F1155 PolarHBondContact O-N 2.91Å; R1152-Q1156 WeakPolarHBondContact O-CB 3.34Å; R1152-Q1156 VanDerWaalsContact O-CG 3.28Å; R1152-Q1156 WeakPolarHBondContact O-CG 3.28Å; R1152-Q1156 PolarHBondContact O-N 2.82Å
1153	Q	84.1	Confident	71.8	Confident	123 Å²	123	117.8 Å²	117.8	58%	0.575	56%	0.558	S	S	*	*	H	α-helix	trans	-71.2	-39	-179.4	-162.7	168.4	39.6	0	0	111.2	Q1149 R1150 Q1156 Q1157	Q1149-Q1153 WeakPolarHBondContact O-CB 3.2Å; Q1149-Q1153 PolarHBondContact O-N 3.22Å; R1150-Q1153 PolarHBondContact O-N 3.02Å; R1150-Q1153 VanDerWaalsContact O-N 3.09Å; Q1153-Q1156 PolarHBondContact O-N 2.87Å; Q1153-Q1157 WeakPolarHBondContact O-CB 3.21Å; Q1153-Q1157 WeakPolarHBondContact O-CG 3.33Å; Q1153-Q1157 PolarHBondContact O-N 2.78Å
1154	E	82.1	Confident	71.5	Confident	115 Å²	115	118 Å²	118	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-65.6	-40.6	171.9	-174	172.8	-154.7	0	0	111.4	R1150 Q1156 Q1157 A1158	R1150-E1154 WeakPolarHBondContact O-CB 3.28Å; R1150-E1154 PolarHBondContact O-N 3.38Å; E1154-Q1156 VanDerWaalsContact C-N 3.31Å; E1154-Q1156 PolarHBondContact O-N 3.38Å; E1154-Q1157 PolarHBondContact O-N 2.94Å; E1154-A1158 WeakPolarHBondContact O-CB 3.27Å; E1154-A1158 PolarHBondContact O-N 2.93Å
1155	F	77.1	Confident	71	Confident	143 Å²	143	116.5 Å²	116.5	63%	0.627	55%	0.545	S	S	*	.	H	α-helix	trans	-72.1	-22.7	173.5	-154.3	-90	0	0	0	113.1	L1151 R1152 K1159	L1151-F1155 WeakPolarHBondContact O-CB 3.34Å; L1151-F1155 PolarHBondContact O-N 3.05Å; R1152-F1155 PolarHBondContact O-N 2.91Å; F1155-K1159 WeakPolarHBondContact O-CB 3.27Å; F1155-K1159 WeakPolarHBondContact O-CG 3.25Å; F1155-K1159 PolarHBondContact O-N 3.4Å
1156	Q	77.2	Confident	69.5	Low	132 Å²	132	116.3 Å²	116.3	62%	0.617	55%	0.548	S	S	*	.	H	α-helix	trans	-81.6	-36.3	171.5	-77.8	175.7	-13.2	0	0	112.1	R1152 Q1153 E1154 Q1160	R1152-Q1156 WeakPolarHBondContact O-CB 3.34Å; R1152-Q1156 VanDerWaalsContact O-CG 3.28Å; R1152-Q1156 WeakPolarHBondContact O-CG 3.28Å; R1152-Q1156 PolarHBondContact O-N 2.82Å; Q1153-Q1156 PolarHBondContact O-N 2.87Å; E1154-Q1156 VanDerWaalsContact C-N 3.31Å; E1154-Q1156 PolarHBondContact O-N 3.38Å; Q1156-Q1160 PolarHBondContact O-N 2.9Å; Q1156-Q1160 VanDerWaalsContact O-N 3.11Å
1157	Q	74	Confident	67.9	Low	114 Å²	114	122 Å²	122	53%	0.533	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-52.9	169.8	-77.7	178.2	-17.3	0	0	110.5	Q1153 E1154 K1159 Q1160 D1161	Q1153-Q1157 WeakPolarHBondContact O-CB 3.21Å; Q1153-Q1157 WeakPolarHBondContact O-CG 3.33Å; Q1153-Q1157 PolarHBondContact O-N 2.78Å; E1154-Q1157 PolarHBondContact O-N 2.94Å; Q1157-K1159 PolarHBondContact O-N 2.86Å; Q1157-K1159 VanDerWaalsContact O-N 3.14Å; Q1157-Q1160 CarbonylContact O-C 3.51Å; Q1157-Q1160 WeakPolarHBondContact O-CA 3.32Å; Q1157-Q1160 PolarHBondContact O-N 2.8Å; Q1157-D1161 PolarHBondContact O-N 3.41Å
1158	A	69.8	Low	66.8	Low	47 Å²	47	122.4 Å²	122.4	39%	0.388	57%	0.566	S	S	.	*	H	α-helix	trans	-54.2	-36.7	175.2	0	0	0	0	0	112.7	E1154 D1161 E1162	E1154-A1158 WeakPolarHBondContact O-CB 3.27Å; E1154-A1158 PolarHBondContact O-N 2.93Å; A1158-D1161 PolarHBondContact O-N 3.32Å; A1158-E1162 WeakPolarHBondContact O-CB 3.36Å; A1158-E1162 WeakPolarHBondContact O-CG 3.34Å; A1158-E1162 PolarHBondContact O-N 3.39Å
1159	K	66.1	Low	65.2	Low	131 Å²	131	127.4 Å²	127.4	57%	0.57	58%	0.578	S	S	*	*	H	α-helix	trans	-69.7	-31.7	172.2	-88.1	-159.3	166.4	-157.6	0	114.7	F1155 Q1157 D1163	F1155-K1159 WeakPolarHBondContact O-CB 3.27Å; F1155-K1159 WeakPolarHBondContact O-CG 3.25Å; F1155-K1159 PolarHBondContact O-N 3.4Å; Q1157-K1159 PolarHBondContact O-N 2.86Å; Q1157-K1159 VanDerWaalsContact O-N 3.14Å; K1159-D1163 WeakPolarHBondContact O-CB 3.46Å; K1159-D1163 PolarHBondContact O-N 2.9Å
1160	Q	59	Low	63.1	Low	142 Å²	142	127.1 Å²	127.1	66%	0.664	58%	0.584	S	S	*	*	H	α-helix	trans	-76.2	-34.9	171.4	-74.4	-168	-30.2	0	0	111.9	Q1156 Q1157 D1163 V1164	Q1156-Q1160 PolarHBondContact O-N 2.9Å; Q1156-Q1160 VanDerWaalsContact O-N 3.11Å; Q1157-Q1160 CarbonylContact O-C 3.51Å; Q1157-Q1160 WeakPolarHBondContact O-CA 3.32Å; Q1157-Q1160 PolarHBondContact O-N 2.8Å; Q1160-D1163 CarbonylContact O-C 3.47Å; Q1160-D1163 PolarHBondContact O-N 2.78Å; Q1160-V1164 WeakPolarHBondContact O-CB 3.43Å; Q1160-V1164 VanDerWaalsContact O-CG2 3.24Å; Q1160-V1164 WeakPolarHBondContact O-CG2 3.36Å; Q1160-V1164 PolarHBondContact O-N 2.78Å
1161	D	57.6	Low	60.8	Low	99 Å²	99	130 Å²	130	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-72.5	-37.3	178.7	-66.7	-36.7	0	0	0	111.3	Q1157 A1158 V1164 E1165	Q1157-D1161 PolarHBondContact O-N 3.41Å; A1158-D1161 PolarHBondContact O-N 3.32Å; D1161-V1164 CarbonylContact O-C 3.6Å; D1161-V1164 PolarHBondContact O-N 2.88Å; D1161-E1165 VanDerWaalsContact O-CB 3.27Å; D1161-E1165 WeakPolarHBondContact O-CB 3.28Å; D1161-E1165 PolarHBondContact O-N 3.23Å
1162	E	52.2	Low	58.3	Low	134 Å²	134	130.7 Å²	130.7	63%	0.626	61%	0.61	S	S	*	*	H	α-helix	trans	-61.9	-45.3	167.8	-75.6	-172.6	137.8	0	0	111.4	A1158 V1164 E1165 D1166	A1158-E1162 WeakPolarHBondContact O-CB 3.36Å; A1158-E1162 WeakPolarHBondContact O-CG 3.34Å; A1158-E1162 PolarHBondContact O-N 3.39Å; E1162-V1164 PolarHBondContact O-N 3.12Å; E1162-V1164 VanDerWaalsContact O-N 3.15Å; E1162-E1165 PolarHBondContact O-N 2.8Å; E1162-D1166 PolarHBondContact O-N 3.35Å
1163	D	52.6	Low	55.8	Low	115 Å²	115	130.7 Å²	130.7	62%	0.615	61%	0.614	S	S	*	*	H	α-helix	trans	-65.4	-13.2	175.3	-119.6	-27.2	0	0	0	113.8	K1159 Q1160 R1167	K1159-D1163 WeakPolarHBondContact O-CB 3.46Å; K1159-D1163 PolarHBondContact O-N 2.9Å; Q1160-D1163 CarbonylContact O-C 3.47Å; Q1160-D1163 PolarHBondContact O-N 2.78Å; D1163-R1167 VanDerWaalsContact O-CB 3.29Å; D1163-R1167 WeakPolarHBondContact O-CB 3.49Å
1164	V	54.9	Low	53.7	Low	66 Å²	66	130.6 Å²	130.6	40%	0.4	61%	0.614	S	S	.	*	H	α-helix	trans	-99.6	-36.5	174.6	166.4	0	0	0	0	111.6	Q1160 D1161 E1162 R1167 R1168	Q1160-V1164 WeakPolarHBondContact O-CB 3.43Å; Q1160-V1164 VanDerWaalsContact O-CG2 3.24Å; Q1160-V1164 WeakPolarHBondContact O-CG2 3.36Å; Q1160-V1164 PolarHBondContact O-N 2.78Å; D1161-V1164 CarbonylContact O-C 3.6Å; D1161-V1164 PolarHBondContact O-N 2.88Å; E1162-V1164 PolarHBondContact O-N 3.12Å; E1162-V1164 VanDerWaalsContact O-N 3.15Å; V1164-R1167 CarbonylContact O-C 3.56Å; V1164-R1167 WeakPolarHBondContact O-CB 3.43Å; V1164-R1168 VanDerWaalsContact O-CG 3.25Å; V1164-R1168 WeakPolarHBondContact O-CG 3.23Å; V1164-R1168 PolarHBondContact O-N 3.35Å; V1164-R1168 VanDerWaalsContact O-N 3.1Å
1165	E	49.5	Very low	51.3	Low	92 Å²	92	132.6 Å²	132.6	43%	0.43	62%	0.624	S	S	.	*	H	α-helix	trans	-88.6	-35.4	-172.6	-150	58.5	-123.7	0	0	112.9	D1161 E1162 R1167 R1168 R1169	D1161-E1165 VanDerWaalsContact O-CB 3.27Å; D1161-E1165 WeakPolarHBondContact O-CB 3.28Å; D1161-E1165 PolarHBondContact O-N 3.23Å; E1162-E1165 PolarHBondContact O-N 2.8Å; E1165-R1167 PolarHBondContact O-N 3.19Å; E1165-R1168 CarbonylContact O-C 3.57Å; E1165-R1168 WeakPolarHBondContact O-CA 3.28Å; E1165-R1168 WeakPolarHBondContact O-CB 3.34Å; E1165-R1168 PolarHBondContact O-N 3.47Å; E1165-R1168 WeakPolarHBondContact OE1-CB 3.3Å; E1165-R1168 WeakPolarHBondContact OE1-CD 3.49Å; E1165-R1168 WeakPolarHBondContact OE2-CD 3.24Å; E1165-R1169 WeakPolarHBondContact O-CG 3.47Å; E1165-R1169 PolarHBondContact O-N 3.17Å
1166	D	49.2	Very low	49.2	Very low	115 Å²	115	129.6 Å²	129.6	62%	0.615	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-30.3	165.5	-90.9	-16.1	0	0	0	111.2	E1162 R1168 R1169 T1170	E1162-D1166 PolarHBondContact O-N 3.35Å; D1166-R1168 VanDerWaalsContact C-N 3.26Å; D1166-R1168 PolarHBondContact O-N 2.94Å; D1166-R1169 PolarHBondContact O-N 2.7Å; D1166-T1170 PolarHBondContact O-OG1 3.25Å
1167	R	44.4	Very low	47.2	Very low	195 Å²	195	134.1 Å²	134.1	74%	0.736	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-10	173.4	-157.1	173.4	-166.1	151.4	3.5	113.7	D1163 V1164 E1165	D1163-R1167 VanDerWaalsContact O-CB 3.29Å; D1163-R1167 WeakPolarHBondContact O-CB 3.49Å; V1164-R1167 CarbonylContact O-C 3.56Å; V1164-R1167 WeakPolarHBondContact O-CB 3.43Å; E1165-R1167 PolarHBondContact O-N 3.19Å
1168	R	48.1	Very low	45.2	Very low	172 Å²	172	133.6 Å²	133.6	65%	0.649	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-28.2	170.6	-77.4	167.3	174	-77.4	-0.8	112.9	V1164 E1165 D1166 T1170	V1164-R1168 VanDerWaalsContact O-CG 3.25Å; V1164-R1168 WeakPolarHBondContact O-CG 3.23Å; V1164-R1168 PolarHBondContact O-N 3.35Å; V1164-R1168 VanDerWaalsContact O-N 3.1Å; E1165-R1168 CarbonylContact O-C 3.57Å; E1165-R1168 WeakPolarHBondContact O-CA 3.28Å; E1165-R1168 WeakPolarHBondContact O-CB 3.34Å; E1165-R1168 PolarHBondContact O-N 3.47Å; E1165-R1168 WeakPolarHBondContact OE1-CB 3.3Å; E1165-R1168 WeakPolarHBondContact OE1-CD 3.49Å; E1165-R1168 WeakPolarHBondContact OE2-CD 3.24Å; D1166-R1168 VanDerWaalsContact C-N 3.26Å; D1166-R1168 PolarHBondContact O-N 2.94Å; R1168-T1170 VanDerWaalsContact C-N 3.29Å; R1168-T1170 PolarHBondContact O-N 3.21Å
1169	R	43	Very low	43.4	Very low	200 Å²	200	136.6 Å²	136.6	76%	0.755	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-1.5	-179.2	-73.5	178.4	-178.2	-102.7	-1.3	115.3	E1165 D1166	E1165-R1169 WeakPolarHBondContact O-CG 3.47Å; E1165-R1169 PolarHBondContact O-N 3.17Å; D1166-R1169 PolarHBondContact O-N 2.7Å
1170	T	38.2	Very low	41.9	Very low	104 Å²	104	135.3 Å²	135.3	64%	0.638	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	34	-172.7	42.4	0	0	0	0	115	D1166 R1168	D1166-T1170 PolarHBondContact O-OG1 3.25Å; R1168-T1170 VanDerWaalsContact C-N 3.29Å; R1168-T1170 PolarHBondContact O-N 3.21Å
1171	Y	30.5	Very low	40.7	Very low	219 Å²	219	140.3 Å²	140.3	86%	0.859	68%	0.679	S	S	*	*			trans	-145.2	100.5	174.4	-99.7	-83.9	0	0	0	114.6
1172	S	31.6	Very low	39.9	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	69%	0.691	S	S	*	*			trans	-177.7	143.6	144.1	-168.2	0	0	0	0	111.1
1173	F	30.4	Very low	39	Very low	176 Å²	176	139.3 Å²	139.3	77%	0.772	70%	0.697	S	S	*	*			trans	60.1	119.4	169.3	-118.4	-106.9	0	0	0	117
1174	E	39.4	Very low	38.1	Very low	122 Å²	122	138 Å²	138	57%	0.57	70%	0.697	S	S	*	*			cis	-155.5	150.6	-1	-128.7	-161.6	147.8	0	0	112.2
1175	Q	32.2	Very low	37.3	Very low	157 Å²	157	143.9 Å²	143.9	73%	0.734	72%	0.72	S	S	*	*			trans	47.4	138.7	156.3	-58.3	-172	35.5	0	0	122
1176	S	33.2	Very low	36.6	Very low	79 Å²	79	144.8 Å²	144.8	55%	0.552	74%	0.737	S	S	*	*			cis	-171.3	162.7	-12.4	51.3	0	0	0	0	112.6
1177	W	34.4	Very low	35.9	Very low	228 Å²	228	142.4 Å²	142.4	86%	0.864	74%	0.74	S	S	*	*			trans	63.8	102.4	168	-48.7	104	0	0	0	118.1
1178	S	33.2	Very low	35.5	Very low	103 Å²	103	143.4 Å²	143.4	72%	0.72	74%	0.743	S	S	*	*				83.3	138.7	71	77.1	0	0	0	0	114.7
1179	S	31.7	Very low	34.8	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	74%	0.743	S	S	*	*			cis	-161	-179.4	6.3	-154.7	0	0	0	0	113.7
1180	S	34.9	Very low	34.3	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	74%	0.741	S	S	*	*			trans	51.5	104.6	162.1	54.8	0	0	0	0	119.1
1181	R	34.3	Very low	34.1	Very low	247 Å²	247	138.4 Å²	138.4	93%	0.932	75%	0.749	S	S	*	*				74.4	149.5	62	-85.1	-153.5	163.7	-166.1	-2.4	116.3
1182	P	40.2	Very low	34.4	Very low	119 Å²	119	133 Å²	133	77%	0.773	74%	0.742	S	S	*	*			trans	-132.6	-133	-136.1	44.4	-25	0	0	0	113
1183	A	32.8	Very low	34.7	Very low	92 Å²	92	133.4 Å²	133.4	76%	0.76	74%	0.74	S	S	*	*			trans	91.6	146.6	179.6	0	0	0	0	0	114.3
1184	S	34.6	Very low	35	Very low	89 Å²	89	132.6 Å²	132.6	62%	0.622	74%	0.739	S	S	*	*			cis	-174.9	164.9	-14.8	49.1	0	0	0	0	110.7
1185	Q	37.8	Very low	34.8	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	75%	0.746	S	S	*	*			trans	67.5	161.6	156.7	-74.6	171	15.2	0	0	116.4
1186	S	33.7	Very low	34.9	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	75%	0.749	S	S	*	*			cis	-162.4	140.6	-21.4	173	0	0	0	0	110.4
1187	G	35.2	Very low	34.9	Very low	66 Å²	66	135 Å²	135	68%	0.68	76%	0.757	S	S	*	*			trans	65.7	-178.5	160.7	0	0	0	0	0	117.2
1188	R	35.5	Very low	34.7	Very low	215 Å²	215	132.8 Å²	132.8	81%	0.811	76%	0.756	S	S	*	*			cis	-168.2	144.3	-31	-127.1	-179.2	-173.9	-127.2	13.6	107.5
1189	H	34	Very low	34.6	Very low	139 Å²	139	139.3 Å²	139.3	64%	0.644	77%	0.765	S	S	*	*			trans	67.3	105.9	159	-60.8	-53.6	0	0	0	121.7
1190	S	31.8	Very low	34.8	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	76%	0.763	S	S	*	*				84.6	121.1	106.4	-59.8	0	0	0	0	123
1191	V	34.2	Very low	34.6	Very low	132 Å²	132	148.1 Å²	148.1	80%	0.8	77%	0.772	S	S	*	*				94.5	146.2	126.9	166	0	0	0	0	120.4
1192	S	37.2	Very low	34.5	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	76%	0.761	S	S	*	*			trans	79.1	93.4	171.3	-65	0	0	0	0	120.3
1193	V	37.4	Very low	34.3	Very low	119 Å²	119	146.1 Å²	146.1	72%	0.721	76%	0.763	S	S	*	*				21.6	126.5	105.9	-166.5	0	0	0	0	115.5
1194	E	37.9	Very low	34.2	Very low	160 Å²	160	149.7 Å²	149.7	75%	0.748	76%	0.764	S	S	*	*				177.6	138	88.5	-168.4	74.9	-108	0	0	111.8
1195	V	34.9	Very low	34	Very low	118 Å²	118	154.6 Å²	154.6	72%	0.715	77%	0.769	S	S	*	*			trans	58.5	166.7	152.1	165	0	0	0	0	121.9
1196	Q	33.8	Very low	33.7	Very low	172 Å²	172	152.7 Å²	152.7	80%	0.804	76%	0.76	S	S	*	*			trans	74.4	93.3	168.9	-106.2	164.1	-8.1	0	0	117.1
1197	V	32.6	Very low	33.7	Very low	118 Å²	118	152.8 Å²	152.8	72%	0.715	76%	0.761	S	S	*	*				72.4	103.8	71.3	176.9	0	0	0	0	113.6
1198	Q	30.1	Very low	33.9	Very low	182 Å²	182	157.9 Å²	157.9	85%	0.85	77%	0.765	S	S	*	*			trans	64.9	87.2	141.4	-170.7	-174.6	-0.8	0	0	119.4
1199	R	32.6	Very low	33.9	Very low	239 Å²	239	153.7 Å²	153.7	90%	0.902	75%	0.754	S	S	*	*			trans	-172.8	78.2	140.7	-158.8	173.8	-156.9	-113.9	5.1	117.2
1200	Q	35.3	Very low	34	Very low	155 Å²	155	155.1 Å²	155.1	72%	0.724	76%	0.761	S	S	*	*			trans	172.8	135.7	147.9	-101.4	163.9	-35.2	0	0	107.7
1201	R	30.5	Very low	34.3	Very low	244 Å²	244	153.5 Å²	153.5	92%	0.921	75%	0.754	S	S	*	*			cis	46.4	119.6	-3.1	-77	-165.7	-178.3	-110.1	2.8	118
1202	Q	32.5	Very low	34.5	Very low	151 Å²	151	154.3 Å²	154.3	71%	0.706	75%	0.749	S	S	*	*			trans	89.3	63.1	163.6	-155.2	164.2	4.6	0	0	117
1203	E	35.9	Very low	34.6	Very low	173 Å²	173	157.4 Å²	157.4	81%	0.808	74%	0.744	S	S	*	*			trans	-134.2	43.8	148	-67.3	-169.6	158.3	0	0	108.9	R1205	E1203-R1205 VanDerWaalsContact C-N 3.28Å
1204	E	31.3	Very low	34.7	Very low	167 Å²	167	157.1 Å²	157.1	78%	0.78	74%	0.735	S	S	*	*				-35.7	88	94	-64	-177.1	133.1	0	0	115.7
1205	R	30.8	Very low	34.7	Very low	192 Å²	192	158.5 Å²	158.5	73%	0.725	74%	0.735	S	S	*	*				-176	126.6	129.1	-105.3	-175.2	144.4	142.7	2.8	116.6	E1203	E1203-R1205 VanDerWaalsContact C-N 3.28Å
1206	E	30	Very low	34.8	Very low	148 Å²	148	157.6 Å²	157.6	69%	0.692	73%	0.734	S	S	*	*			trans	48.8	79.5	131.6	-63.6	162.5	-161.5	0	0	120.2
1207	S	33.5	Very low	35.1	Very low	114 Å²	114	154.6 Å²	154.6	80%	0.797	73%	0.732	S	S	*	*			trans	178.3	147.3	142.9	39.7	0	0	0	0	111.1
1208	F	39.3	Very low	35.5	Very low	173 Å²	173	156.6 Å²	156.6	76%	0.759	74%	0.738	S	S	*	*			cis	-147.8	135.1	-10.1	-154.6	-111.8	0	0	0	108.9
1209	Q	36.6	Very low	36.1	Very low	126 Å²	126	153.2 Å²	153.2	59%	0.589	73%	0.732	S	S	*	*			trans	20.4	135.2	143	-52.4	-166	66.2	0	0	118.7
1210	Q	35	Very low	36.4	Very low	169 Å²	169	152.4 Å²	152.4	79%	0.79	73%	0.729	S	S	*	*			cis	-172.4	170.4	30.1	-118	164.6	36.1	0	0	107.3
1211	A	38.1	Very low	36.5	Very low	67 Å²	67	153.3 Å²	153.3	55%	0.554	73%	0.733	S	S	*	*			cis	-161.1	149.3	9	0	0	0	0	0	112.2
1212	Q	38.5	Very low	36.6	Very low	149 Å²	149	146.2 Å²	146.2	70%	0.696	72%	0.721	S	S	*	*			trans	71.4	139.2	143.3	-62.8	-174.5	34.6	0	0	119.1
1213	R	40.5	Very low	36.7	Very low	169 Å²	169	150.2 Å²	150.2	64%	0.638	73%	0.729	S	S	*	*			cis	-160.8	118.4	4	-116.7	-179.7	-156	-80.2	-6.7	115.1
1214	Q	38.9	Very low	36.8	Very low	113 Å²	113	151.8 Å²	151.8	53%	0.528	73%	0.734	S	S	.	*			trans	62.6	160.6	139.4	-11.8	-168.3	-119.9	0	0	120.5
1215	Y	38.1	Very low	36.9	Very low	189 Å²	189	151.2 Å²	151.2	74%	0.741	74%	0.736	S	S	*	*			cis	-138.3	132.6	-0.9	-90.7	-74	0	0	0	109.4
1216	S	37.3	Very low	37.2	Very low	100 Å²	100	146.5 Å²	146.5	70%	0.699	74%	0.738	S	S	*	*				58.2	113.8	97.4	-159.6	0	0	0	0	116.1
1217	S	39.6	Very low	37.4	Very low	108 Å²	108	144.3 Å²	144.3	76%	0.755	74%	0.739	S	S	*	*				166.9	171.1	77.8	45.7	0	0	0	0	109.7
1218	L	40.5	Very low	37.7	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	74%	0.737	S	S	*	*			cis	-161.2	154.6	-19.6	-104.7	170.1	0	0	0	109.2
1219	P	44.1	Very low	37.5	Very low	111 Å²	111	143.2 Å²	143.2	72%	0.721	74%	0.739	S	S	*	*			trans	-123	174.2	-169.8	43.1	-33.3	0	0	0	117.7
1220	R	38.9	Very low	37.6	Very low	222 Å²	222	142 Å²	142	84%	0.838	74%	0.744	S	S	*	*			trans	-167.3	137.2	159.9	-96	142.9	-169.2	-85.3	2	109.5
1221	Q	35.7	Very low	37.7	Very low	174 Å²	174	141.4 Å²	141.4	81%	0.813	74%	0.742	S	S	*	*				65.2	139	69.9	-71.2	-168.5	-1.7	0	0	115.2
1222	S	33.2	Very low	37.7	Very low	95 Å²	95	144.4 Å²	144.4	66%	0.664	75%	0.748	S	S	*	*			cis	-175.4	158.7	-5.1	55.6	0	0	0	0	114.3
1223	R	33.9	Very low	37.5	Very low	235 Å²	235	141.5 Å²	141.5	89%	0.887	75%	0.745	S	S	*	*			trans	54	127.4	151.9	-76.3	-174.8	171.8	-171.1	-1.9	122.4
1224	K	39.4	Very low	37.4	Very low	206 Å²	206	144.1 Å²	144.1	90%	0.896	76%	0.755	S	S	*	*			trans	159.6	167.6	135.8	-89.5	159.9	-177.3	-179.8	0	110
1225	N	32.9	Very low	37.3	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	76%	0.757	S	S	*	*				-171.5	154.1	-58.9	-130.9	26.8	0	0	0	108.3
1226	A	36.7	Very low	37.1	Very low	93 Å²	93	142.2 Å²	142.2	77%	0.769	75%	0.752	S	S	*	*			trans	68.2	154.5	165.1	0	0	0	0	0	118.5
1227	S	35.2	Very low	36.9	Very low	101 Å²	101	142 Å²	142	71%	0.706	74%	0.744	S	S	*	*			cis	-173.6	158.7	-22.1	51.4	0	0	0	0	113
1228	S	38.5	Very low	36.6	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	75%	0.745	S	S	*	*			trans	71	160.2	155.8	76.4	0	0	0	0	119.5
1229	I	36.7	Very low	36.4	Very low	154 Å²	154	143.3 Å²	143.3	79%	0.79	74%	0.742	S	S	*	*			cis	-170.6	179.9	-35.9	-164.8	155.5	0	0	0	108.7
1230	S	38.7	Very low	36.3	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	75%	0.75	S	S	*	*			trans	74.3	145.8	165.5	69.9	0	0	0	0	118.6
1231	Q	35.3	Very low	36.2	Very low	158 Å²	158	136.9 Å²	136.9	74%	0.738	74%	0.742	S	S	*	*			cis	-161.8	171.5	-32.8	-144.2	179.4	-87.5	0	0	110
1232	D	39	Very low	36.1	Very low	129 Å²	129	138.6 Å²	138.6	69%	0.69	75%	0.75	S	S	*	*			trans	65	132.7	161.5	-52.3	-36.9	0	0	0	118.8
1233	S	35	Very low	36.3	Very low	89 Å²	89	137.7 Å²	137.7	62%	0.622	76%	0.755	S	S	*	*			cis	133.7	174.6	-7.4	-169.3	0	0	0	0	109.8
1234	W	37.3	Very low	36.3	Very low	224 Å²	224	135.3 Å²	135.3	85%	0.848	75%	0.752	S	S	*	*			trans	77.3	122.8	-166.2	-47.6	112	0	0	0	115.5
1235	E	36.8	Very low	36.1	Very low	122 Å²	122	132.9 Å²	132.9	57%	0.57	74%	0.744	S	S	*	*			cis	166.4	137.2	-34.3	-100.4	-145.5	109.2	0	0	105.7
1236	Q	33.8	Very low	36.2	Very low	139 Å²	139	130 Å²	130	65%	0.65	74%	0.735	S	S	*	*			trans	66.6	147	148.7	-64.4	-172.5	38	0	0	118.9
1237	N	34.9	Very low	36.2	Very low	97 Å²	97	130.2 Å²	130.2	52%	0.519	74%	0.737	S	S	.	*			cis	-159.7	158.8	1.3	-115.1	-14.6	0	0	0	115.5
1238	Y	32.6	Very low	36.3	Very low	199 Å²	199	134.5 Å²	134.5	78%	0.78	74%	0.743	S	S	*	*			trans	47.2	106.4	153.3	-59.3	-55.6	0	0	0	125.3
1239	A	35.8	Very low	36.4	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	75%	0.745	S	S	*	*				59.9	158	101.6	0	0	0	0	0	124.2
1240	P	41.3	Very low	36.3	Very low	134 Å²	134	137 Å²	137	87%	0.87	74%	0.744	S	S	*	*			trans	-125.6	175.7	-165.3	43.8	-29.1	0	0	0	118
1241	G	37.2	Very low	36.7	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	74%	0.739	S	S	*	*			trans	178.8	127.9	165.6	0	0	0	0	0	110.6
1242	E	34.1	Very low	36.8	Very low	210 Å²	210	140.1 Å²	140.1	98%	0.981	75%	0.745	S	S	*	*				63.2	136.5	83.1	-68.3	-154.2	133.9	0	0	116.2
1243	G	37.2	Very low	36.4	Very low	76 Å²	76	144.6 Å²	144.6	78%	0.784	75%	0.754	S	S	*	*			trans	156.6	25.7	171.1	0	0	0	0	0	125.1
1244	F	34.3	Very low	36.2	Very low	185 Å²	185	145 Å²	145	81%	0.811	76%	0.757	S	S	*	*			trans	43.5	125	147.5	-96.4	-114.1	0	0	0	125.6
1245	Q	34	Very low	36.1	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	75%	0.754	S	S	*	*			trans	78.3	119.6	133.1	-88.2	-156.8	77.5	0	0	126.8
1246	S	35.9	Very low	35.9	Very low	93 Å²	93	144.4 Å²	144.4	65%	0.65	77%	0.768	S	S	*	*				93.4	105.3	118.4	-67.3	0	0	0	0	125.3
1247	A	36.7	Very low	35.6	Very low	99 Å²	99	146.5 Å²	146.5	82%	0.818	78%	0.778	S	S	*	*				99.3	123.4	116.6	0	0	0	0	0	123.7
1248	K	36.9	Very low	35.3	Very low	191 Å²	191	145 Å²	145	83%	0.83	79%	0.786	S	S	*	*				117.7	153.1	126.8	-151.9	176.9	178.6	-167	0	119.4
1249	E	42.1	Very low	35.3	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.813	79%	0.79	S	S	*	*			trans	88.6	163.8	168.5	-137.4	82.4	-125.8	0	0	117.7
1250	N	33.3	Very low	35.1	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	79%	0.793	S	S	*	*			trans	-146	-162.5	-144.5	-160.6	20	0	0	0	113
1251	P	48.2	Very low	34.3	Very low	91 Å²	91	148.9 Å²	148.9	59%	0.591	79%	0.792	S	S	*	*				-104.3	166	-106.8	36.3	-22.1	0	0	0	116.4
1252	R	36.4	Very low	33.8	Very low	233 Å²	233	149.2 Å²	149.2	88%	0.879	80%	0.795	S	S	*	*				177	150.7	126.2	-97.1	158.3	-170	-172.9	4.9	114
1253	Y	30.7	Very low	33.6	Very low	222 Å²	222	149.7 Å²	149.7	87%	0.871	79%	0.79	S	S	*	*			trans	50.6	105.5	157	-89.5	-95.7	0	0	0	120.1
1254	S	30.9	Very low	33.2	Very low	98 Å²	98	153.6 Å²	153.6	69%	0.685	79%	0.792	S	S	*	*				158.6	149.1	93.1	-163.9	0	0	0	0	112.2
1255	S	36.3	Very low	32.9	Very low	113 Å²	113	148.7 Å²	148.7	79%	0.79	79%	0.793	S	S	*	*			trans	62.8	134.6	179.3	65.9	0	0	0	0	117.6
1256	Y	31.2	Very low	32.6	Very low	220 Å²	220	143.8 Å²	143.8	86%	0.863	78%	0.784	S	S	*	*			trans	-131.9	152.5	-173.2	-83.8	-108.1	0	0	0	107.9
1257	Q	28.5	Very low	32.6	Very low	184 Å²	184	147 Å²	147	86%	0.86	79%	0.789	S	S	*	*			cis	-150.2	141.1	-1.2	-165.7	175.9	13.7	0	0	109
1258	G	27.7	Very low	32.4	Very low	66 Å²	66	146.2 Å²	146.2	68%	0.68	79%	0.791	S	S	*	*			trans	-172.4	138.3	173.5	0	0	0	0	0	114.1
1259	S	32.9	Very low	32.8	Very low	125 Å²	125	144.3 Å²	144.3	87%	0.874	78%	0.783	S	S	*	*			trans	63.9	166.6	-176.3	-55.7	0	0	0	0	114.4
1260	R	31.3	Very low	33	Very low	224 Å²	224	141.5 Å²	141.5	85%	0.845	77%	0.773	S	S	*	*			cis	-154.7	163.2	10.2	-152.1	177.1	-169	-163.3	4.5	112.4
1261	N	25.2	Very low	33.9	Very low	161 Å²	161	138 Å²	138	86%	0.861	76%	0.764	S	S	*	*			trans	113.8	115.3	172.5	-67.2	-4.2	0	0	0	109.5
1262	G	26.6	Very low	34.9	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	77%	0.767	S	S	*	*			cis	143.3	146.9	24	0	0	0	0	0	104.8
1263	Y	29.4	Very low	36.5	Very low	221 Å²	221	133.7 Å²	133.7	87%	0.867	74%	0.743	S	S	*	*			cis	-139.8	167.4	21.9	-110.7	-113.9	0	0	0	112
1264	L	28.1	Very low	38.4	Very low	157 Å²	157	129.2 Å²	129.2	82%	0.822	73%	0.731	S	S	*	*			trans	-2.4	133.3	160.6	-55.4	173.9	0	0	0	120.6
1265	G	28	Very low	40.6	Very low	82 Å²	82	129.9 Å²	129.9	85%	0.845	73%	0.727	S	S	*	*			trans	85.6	143.5	157.3	0	0	0	0	0	115.3
1266	G	27.6	Very low	42.5	Very low	52 Å²	52	129 Å²	129	54%	0.536	71%	0.71	S	S	.	*			cis	174.8	164.1	-3.9	0	0	0	0	0	110.6
1267	H	37.4	Very low	44.7	Very low	161 Å²	161	122.5 Å²	122.5	75%	0.745	69%	0.693	S	S	*	*			trans	52.4	78.1	166	-10.8	-79.9	0	0	0	115	F1269	H1267-F1269 HydrophobicContact CB-CD2 3.75Å; H1267-F1269 HydrophobicContact CB-CE2 3.5Å; H1267-F1269 VanDerWaalsContact CB-CE2 3.5Å; H1267-F1269 HydrophobicContact CB-CZ 4.36Å; H1267-F1269 WeakPolarHBondContact O-CD2 3.25Å; H1267-F1269 PolarHBondContact O-N 3.42Å
1268	G	31.1	Very low	47.1	Very low	83 Å²	83	120.2 Å²	120.2	86%	0.856	68%	0.683	S	S	*	*			trans	-66	81.3	162.3	0	0	0	0	0	110.7	N1270	G1268-N1270 PolarHBondContact O-N 3.22Å; G1268-N1270 VanDerWaalsContact O-N 3.08Å
1269	F	46.3	Very low	49.5	Very low	151 Å²	151	120 Å²	120	66%	0.662	66%	0.664	S	S	*	*			trans	-62.9	112.3	179.1	-86.6	-82.5	0	0	0	110	H1267 A1271 M1274	H1267-F1269 HydrophobicContact CB-CD2 3.75Å; H1267-F1269 HydrophobicContact CB-CE2 3.5Å; H1267-F1269 VanDerWaalsContact CB-CE2 3.5Å; H1267-F1269 HydrophobicContact CB-CZ 4.36Å; H1267-F1269 WeakPolarHBondContact O-CD2 3.25Å; H1267-F1269 PolarHBondContact O-N 3.42Å; F1269-A1271 PolarHBondContact O-N 3Å; F1269-M1274 HydrophobicContact CB-CG 4.47Å
1270	N	45.5	Very low	51.9	Low	114 Å²	114	119.1 Å²	119.1	61%	0.61	65%	0.649	S	S	*	*			trans	-54.2	126	177.1	-128.6	-69.2	0	0	0	109.3	G1268 R1272 V1273 M1274	G1268-N1270 PolarHBondContact O-N 3.22Å; G1268-N1270 VanDerWaalsContact O-N 3.08Å; N1270-R1272 PolarHBondContact O-N 3.3Å; N1270-V1273 HydrophobicContact CB-CB 4.33Å; N1270-V1273 HydrophobicContact CB-CG2 3.91Å; N1270-V1273 WeakPolarHBondContact O-CA 3.49Å; N1270-V1273 WeakPolarHBondContact O-CB 3.42Å; N1270-V1273 PolarHBondContact O-N 3Å; N1270-M1274 PolarHBondContact O-N 2.91Å; N1270-M1274 VanDerWaalsContact O-N 3.17Å
1271	A	52.8	Low	54.4	Low	70 Å²	70	114.1 Å²	114.1	58%	0.579	64%	0.639	S	S	*	*	H	α-helix	trans	-57.2	-29.3	-178.2	0	0	0	0	0	112.2	F1269 M1274 L1275	F1269-A1271 PolarHBondContact O-N 3Å; A1271-M1274 PolarHBondContact O-N 3.33Å; A1271-L1275 PolarHBondContact O-N 2.94Å
1272	R	68.1	Low	57.2	Low	171 Å²	171	112.6 Å²	112.6	65%	0.645	62%	0.621	S	S	*	*	H	α-helix	trans	-56.6	-50.5	168.7	-180	176.2	-73.2	-150.4	-2.2	112.4	N1270 M1274 L1275 E1276	N1270-R1272 PolarHBondContact O-N 3.3Å; R1272-M1274 VanDerWaalsContact C-N 3.33Å; R1272-M1274 PolarHBondContact O-N 3.29Å; R1272-L1275 PolarHBondContact O-N 2.97Å; R1272-E1276 WeakPolarHBondContact O-CB 3.49Å; R1272-E1276 PolarHBondContact O-N 3.35Å
1273	V	70.3	Confident	59.7	Low	62 Å²	62	114.2 Å²	114.2	38%	0.376	61%	0.609	S	S	.	*	H	α-helix	trans	-66.1	-35.4	-178.7	177.5	0	0	0	0	111.4	N1270 T1277	N1270-V1273 HydrophobicContact CB-CB 4.33Å; N1270-V1273 HydrophobicContact CB-CG2 3.91Å; N1270-V1273 WeakPolarHBondContact O-CA 3.49Å; N1270-V1273 WeakPolarHBondContact O-CB 3.42Å; N1270-V1273 PolarHBondContact O-N 3Å; V1273-T1277 VanDerWaalsContact O-CB 3.28Å; V1273-T1277 WeakPolarHBondContact O-CB 3.44Å; V1273-T1277 PolarHBondContact O-N 3.3Å; V1273-T1277 PolarHBondContact O-OG1 2.82Å
1274	M	71.3	Confident	62	Low	127 Å²	127	109 Å²	109	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-63.8	-47.8	172.4	-92	-85.5	-75.2	0	0	112.3	F1269 N1270 A1271 R1272 T1277 Q1278	F1269-M1274 HydrophobicContact CB-CG 4.47Å; N1270-M1274 PolarHBondContact O-N 2.91Å; N1270-M1274 VanDerWaalsContact O-N 3.17Å; A1271-M1274 PolarHBondContact O-N 3.33Å; R1272-M1274 VanDerWaalsContact C-N 3.33Å; R1272-M1274 PolarHBondContact O-N 3.29Å; M1274-T1277 PolarHBondContact O-N 2.78Å; M1274-Q1278 WeakPolarHBondContact O-CB 3.33Å; M1274-Q1278 PolarHBondContact O-N 3.31Å
1275	L	76.4	Confident	64.4	Low	112 Å²	112	107.8 Å²	107.8	59%	0.586	58%	0.583	S	S	*	*	H	α-helix	trans	-64.8	-39.3	176.4	-80.2	161.4	0	0	0	112.4	A1271 R1272 Q1278 E1279	A1271-L1275 PolarHBondContact O-N 2.94Å; R1272-L1275 PolarHBondContact O-N 2.97Å; L1275-Q1278 PolarHBondContact O-N 2.7Å; L1275-E1279 PolarHBondContact O-N 2.84Å
1276	E	76.8	Confident	66.9	Low	94 Å²	94	109 Å²	109	44%	0.439	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-44.2	177.1	-173.5	159.9	-135.2	0	0	111.4	R1272 Q1278 E1279 L1280	R1272-E1276 WeakPolarHBondContact O-CB 3.49Å; R1272-E1276 PolarHBondContact O-N 3.35Å; E1276-Q1278 VanDerWaalsContact C-N 3.32Å; E1276-Q1278 PolarHBondContact O-N 3.01Å; E1276-E1279 PolarHBondContact O-N 2.77Å; E1276-L1280 HydrophobicContact CG-CD1 4.38Å; E1276-L1280 VanDerWaalsContact O-CB 3.3Å; E1276-L1280 WeakPolarHBondContact O-CB 3.23Å; E1276-L1280 VanDerWaalsContact O-CG 3.24Å; E1276-L1280 WeakPolarHBondContact O-CG 3.23Å; E1276-L1280 PolarHBondContact O-N 3.28Å
1277	T	77.7	Confident	69.1	Low	84 Å²	84	113.2 Å²	113.2	52%	0.515	56%	0.562	S	S	.	*	H	α-helix	trans	-62.5	-38.9	172.6	-55.5	0	0	0	0	111.7	V1273 M1274 L1281	V1273-T1277 VanDerWaalsContact O-CB 3.28Å; V1273-T1277 WeakPolarHBondContact O-CB 3.44Å; V1273-T1277 PolarHBondContact O-N 3.3Å; V1273-T1277 PolarHBondContact O-OG1 2.82Å; M1274-T1277 PolarHBondContact O-N 2.78Å; T1277-L1281 WeakPolarHBondContact O-CB 3.31Å; T1277-L1281 PolarHBondContact O-N 2.83Å
1278	Q	78.4	Confident	70.9	Confident	137 Å²	137	112.9 Å²	112.9	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-68.3	-42.7	178	-177.9	170	79	0	0	112.4	M1274 L1275 E1276 L1281 R1282	M1274-Q1278 WeakPolarHBondContact O-CB 3.33Å; M1274-Q1278 PolarHBondContact O-N 3.31Å; L1275-Q1278 PolarHBondContact O-N 2.7Å; E1276-Q1278 VanDerWaalsContact C-N 3.32Å; E1276-Q1278 PolarHBondContact O-N 3.01Å; Q1278-L1281 PolarHBondContact O-N 3.37Å; Q1278-R1282 WeakPolarHBondContact O-CB 3.45Å; Q1278-R1282 PolarHBondContact O-N 2.97Å
1279	E	77.7	Confident	72.7	Confident	62 Å²	62	113.7 Å²	113.7	29%	0.29	54%	0.54	S	S	.	.	H	α-helix	trans	-71.7	-35.3	175.5	-175.9	58.6	-157.8	0	0	111.9	L1275 E1276 R1282 Q1283 R1286	L1275-E1279 PolarHBondContact O-N 2.84Å; E1276-E1279 PolarHBondContact O-N 2.77Å; E1279-R1282 CarbonylContact O-C 3.35Å; E1279-R1282 PolarHBondContact O-N 2.94Å; E1279-R1282 IonicContact OE1-CZ 3.87Å; E1279-R1282 IonicContact OE1-NE 2.89Å; E1279-R1282 IonicContact OE1-NH2 3.85Å; E1279-R1282 PolarHBondContact OE1-NH2 3.29Å; E1279-R1282 IonicContact OE2-CZ 2.75Å; E1279-R1282 IonicContact OE2-NE 3.7Å; E1279-R1282 PolarHBondContact OE2-NE 3.16Å; E1279-R1282 IonicContact OE2-NH2 3.26Å; E1279-R1282 PolarHBondContact OE2-NH2 3.29Å; E1279-Q1283 WeakPolarHBondContact O-CG 3.35Å; E1279-Q1283 PolarHBondContact O-N 2.87Å; E1279-R1286 IonicContact OE1-NH2 2.94Å; E1279-R1286 PolarHBondContact OE1-NH2 3.39Å
1280	L	83.1	Confident	73.4	Confident	105 Å²	105	112.7 Å²	112.7	55%	0.55	54%	0.537	S	S	.	.	H	α-helix	trans	-59.5	-46.8	171.2	-78.4	170.1	0	0	0	111.3	E1276 R1282 Q1283 E1284	E1276-L1280 HydrophobicContact CG-CD1 4.38Å; E1276-L1280 VanDerWaalsContact O-CB 3.3Å; E1276-L1280 WeakPolarHBondContact O-CB 3.23Å; E1276-L1280 VanDerWaalsContact O-CG 3.24Å; E1276-L1280 WeakPolarHBondContact O-CG 3.23Å; E1276-L1280 PolarHBondContact O-N 3.28Å; L1280-R1282 VanDerWaalsContact C-N 3.28Å; L1280-R1282 PolarHBondContact O-N 3.22Å; L1280-Q1283 PolarHBondContact O-N 2.92Å; L1280-Q1283 VanDerWaalsContact O-N 3.14Å; L1280-E1284 WeakPolarHBondContact O-CB 3.14Å; L1280-E1284 PolarHBondContact O-N 3.2Å
1281	L	85.2	Confident	73.9	Confident	120 Å²	120	112.4 Å²	112.4	63%	0.628	53%	0.532	S	S	*	.	H	α-helix	trans	-61.6	-37.1	175.2	-174.4	61.9	0	0	0	111.8	T1277 Q1278 E1284 Q1285	T1277-L1281 WeakPolarHBondContact O-CB 3.31Å; T1277-L1281 PolarHBondContact O-N 2.83Å; Q1278-L1281 PolarHBondContact O-N 3.37Å; L1281-E1284 PolarHBondContact O-N 3.23Å; L1281-Q1285 WeakPolarHBondContact O-CB 3.35Å; L1281-Q1285 PolarHBondContact O-N 2.93Å
1282	R	83.2	Confident	74.2	Confident	128 Å²	128	115.8 Å²	115.8	48%	0.483	54%	0.54	S	S	.	.	H	α-helix	trans	-72	-27	175.6	-160.5	178.7	71	118.4	-0.1	113.3	Q1278 E1279 L1280 R1286	Q1278-R1282 WeakPolarHBondContact O-CB 3.45Å; Q1278-R1282 PolarHBondContact O-N 2.97Å; E1279-R1282 CarbonylContact O-C 3.35Å; E1279-R1282 PolarHBondContact O-N 2.94Å; E1279-R1282 IonicContact OE1-CZ 3.87Å; E1279-R1282 IonicContact OE1-NE 2.89Å; E1279-R1282 IonicContact OE1-NH2 3.85Å; E1279-R1282 PolarHBondContact OE1-NH2 3.29Å; E1279-R1282 IonicContact OE2-CZ 2.75Å; E1279-R1282 IonicContact OE2-NE 3.7Å; E1279-R1282 PolarHBondContact OE2-NE 3.16Å; E1279-R1282 IonicContact OE2-NH2 3.26Å; E1279-R1282 PolarHBondContact OE2-NH2 3.29Å; L1280-R1282 VanDerWaalsContact C-N 3.28Å; L1280-R1282 PolarHBondContact O-N 3.22Å; R1282-R1286 WeakPolarHBondContact O-CG 3.35Å; R1282-R1286 PolarHBondContact O-N 3.42Å; R1282-R1286 PolarHBondContact O-NE 3.02Å
1283	Q	79.3	Confident	73.4	Confident	106 Å²	106	115.3 Å²	115.3	50%	0.495	54%	0.542	S	S	.	.	H	α-helix	trans	-75.8	-43.5	170.3	-73.6	-175.4	21.8	0	0	111.2	E1279 L1280 Q1285 R1286 R1287	E1279-Q1283 WeakPolarHBondContact O-CG 3.35Å; E1279-Q1283 PolarHBondContact O-N 2.87Å; L1280-Q1283 PolarHBondContact O-N 2.92Å; L1280-Q1283 VanDerWaalsContact O-N 3.14Å; Q1283-Q1285 VanDerWaalsContact C-N 3.32Å; Q1283-Q1285 PolarHBondContact O-N 3.21Å; Q1283-R1286 PolarHBondContact O-N 2.88Å; Q1283-R1287 WeakPolarHBondContact O-CB 3.45Å; Q1283-R1287 PolarHBondContact O-N 2.95Å
1284	E	77.4	Confident	72.1	Confident	111 Å²	111	120.7 Å²	120.7	52%	0.519	56%	0.56	S	S	.	*	H	α-helix	trans	-59.4	-43.5	175.1	-164.8	63.9	-118.2	0	0	111	L1280 L1281 R1286 R1287 K1288	L1280-E1284 WeakPolarHBondContact O-CB 3.14Å; L1280-E1284 PolarHBondContact O-N 3.2Å; L1281-E1284 PolarHBondContact O-N 3.23Å; E1284-R1286 PolarHBondContact O-N 3.15Å; E1284-R1287 PolarHBondContact O-N 3Å; E1284-K1288 WeakPolarHBondContact O-CB 3.33Å; E1284-K1288 PolarHBondContact O-N 3.46Å
1285	Q	79.1	Confident	70.4	Confident	131 Å²	131	122.6 Å²	122.6	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-64.4	-40.6	176.6	-162.3	170.2	17.3	0	0	112.2	L1281 Q1283 K1288 E1289	L1281-Q1285 WeakPolarHBondContact O-CB 3.35Å; L1281-Q1285 PolarHBondContact O-N 2.93Å; Q1283-Q1285 VanDerWaalsContact C-N 3.32Å; Q1283-Q1285 PolarHBondContact O-N 3.21Å; Q1285-K1288 PolarHBondContact O-N 2.77Å; Q1285-E1289 PolarHBondContact O-N 3.24Å
1286	R	79.4	Confident	68.8	Low	109 Å²	109	122.3 Å²	122.3	41%	0.411	57%	0.573	S	S	.	*	H	α-helix	trans	-67.7	-38.3	172.9	-77.9	-172	-74.3	169.8	-2.8	112.8	E1279 R1282 Q1283 E1284 K1288 E1289 Q1290	E1279-R1286 IonicContact OE1-NH2 2.94Å; E1279-R1286 PolarHBondContact OE1-NH2 3.39Å; R1282-R1286 WeakPolarHBondContact O-CG 3.35Å; R1282-R1286 PolarHBondContact O-N 3.42Å; R1282-R1286 PolarHBondContact O-NE 3.02Å; Q1283-R1286 PolarHBondContact O-N 2.88Å; E1284-R1286 PolarHBondContact O-N 3.15Å; R1286-K1288 VanDerWaalsContact C-N 3.29Å; R1286-K1288 PolarHBondContact O-N 3.42Å; R1286-E1289 PolarHBondContact O-N 3.44Å; R1286-Q1290 WeakPolarHBondContact O-CB 3.22Å; R1286-Q1290 WeakPolarHBondContact O-CG 3.33Å; R1286-Q1290 PolarHBondContact O-N 3.28Å
1287	R	75.2	Confident	66.7	Low	140 Å²	140	124.3 Å²	124.3	53%	0.528	59%	0.594	S	S	.	*	H	α-helix	trans	-64.1	-33.6	172.5	174.4	177	163.7	85.7	6.3	111.5	Q1283 E1284 Q1291	Q1283-R1287 WeakPolarHBondContact O-CB 3.45Å; Q1283-R1287 PolarHBondContact O-N 2.95Å; E1284-R1287 PolarHBondContact O-N 3Å; R1287-Q1291 WeakPolarHBondContact O-CG 3.15Å; R1287-Q1291 PolarHBondContact O-N 3.29Å; R1287-Q1291 VanDerWaalsContact O-N 3.15Å; R1287-Q1291 PolarHBondContact O-NE2 2.84Å
1288	K	74.4	Confident	64.8	Low	154 Å²	154	124.9 Å²	124.9	67%	0.67	61%	0.607	S	S	*	*	H	α-helix	trans	-74	-43.5	175.8	-158.8	168.7	-172.9	174.4	0	112	E1284 Q1285 R1286 Q1291 L1292	E1284-K1288 WeakPolarHBondContact O-CB 3.33Å; E1284-K1288 PolarHBondContact O-N 3.46Å; Q1285-K1288 PolarHBondContact O-N 2.77Å; R1286-K1288 VanDerWaalsContact C-N 3.29Å; R1286-K1288 PolarHBondContact O-N 3.42Å; K1288-Q1291 PolarHBondContact O-N 2.67Å; K1288-L1292 WeakPolarHBondContact O-CB 3.28Å; K1288-L1292 PolarHBondContact O-N 3.18Å
1289	E	69.2	Low	62.7	Low	100 Å²	100	126.1 Å²	126.1	47%	0.467	62%	0.618	S	S	.	*	H	α-helix	trans	-61.9	-43	171.4	-94.2	-155.9	91.7	0	0	112.9	Q1285 R1286 Q1291 L1292 K1293	Q1285-E1289 PolarHBondContact O-N 3.24Å; R1286-E1289 PolarHBondContact O-N 3.44Å; E1289-Q1291 VanDerWaalsContact C-N 3.34Å; E1289-Q1291 PolarHBondContact O-N 3.38Å; E1289-L1292 CarbonylContact O-C 3.58Å; E1289-L1292 PolarHBondContact O-N 2.76Å; E1289-L1292 VanDerWaalsContact O-N 3.17Å; E1289-K1293 WeakPolarHBondContact O-CB 3.4Å; E1289-K1293 PolarHBondContact O-N 3.42Å; E1289-K1293 IonicContact OE1-NZ 2.72Å; E1289-K1293 PolarHBondContact OE1-NZ 3.36Å
1290	Q	61.8	Low	60.6	Low	129 Å²	129	126.7 Å²	126.7	60%	0.603	64%	0.64	S	S	*	*	H	α-helix	trans	-67.9	-32.6	179.6	-74.9	-176.8	15.3	0	0	112.5	R1286 K1294	R1286-Q1290 WeakPolarHBondContact O-CB 3.22Å; R1286-Q1290 WeakPolarHBondContact O-CG 3.33Å; R1286-Q1290 PolarHBondContact O-N 3.28Å; Q1290-K1294 WeakPolarHBondContact O-CB 3.35Å; Q1290-K1294 WeakPolarHBondContact O-CG 3.36Å; Q1290-K1294 PolarHBondContact O-N 2.82Å
1291	Q	56.3	Low	58.4	Low	108 Å²	108	127.5 Å²	127.5	51%	0.505	65%	0.649	S	S	.	*	H	α-helix	trans	-70	-37.5	169.4	-76.1	171.1	106.4	0	0	111.8	R1287 K1288 E1289 K1293 K1294	R1287-Q1291 WeakPolarHBondContact O-CG 3.15Å; R1287-Q1291 PolarHBondContact O-N 3.29Å; R1287-Q1291 VanDerWaalsContact O-N 3.15Å; R1287-Q1291 PolarHBondContact O-NE2 2.84Å; K1288-Q1291 PolarHBondContact O-N 2.67Å; E1289-Q1291 VanDerWaalsContact C-N 3.34Å; E1289-Q1291 PolarHBondContact O-N 3.38Å; Q1291-K1293 VanDerWaalsContact C-N 3.27Å; Q1291-K1293 PolarHBondContact O-N 2.83Å; Q1291-K1294 PolarHBondContact O-N 2.58Å
1292	L	57.7	Low	56	Low	142 Å²	142	133.1 Å²	133.1	74%	0.743	66%	0.662	S	S	*	*	H	α-helix	trans	-68.7	-24.4	175.7	-146.6	75.2	0	0	0	113.2	K1288 E1289	K1288-L1292 WeakPolarHBondContact O-CB 3.28Å; K1288-L1292 PolarHBondContact O-N 3.18Å; E1289-L1292 CarbonylContact O-C 3.58Å; E1289-L1292 PolarHBondContact O-N 2.76Å; E1289-L1292 VanDerWaalsContact O-N 3.17Å
1293	K	51.1	Low	53.9	Low	161 Å²	161	130.3 Å²	130.3	70%	0.7	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	7.3	174.4	-77.4	171.1	175.2	151.9	0	114.2	E1289 Q1291	E1289-K1293 WeakPolarHBondContact O-CB 3.4Å; E1289-K1293 PolarHBondContact O-N 3.42Å; E1289-K1293 IonicContact OE1-NZ 2.72Å; E1289-K1293 PolarHBondContact OE1-NZ 3.36Å; Q1291-K1293 VanDerWaalsContact C-N 3.27Å; Q1291-K1293 PolarHBondContact O-N 2.83Å
1294	K	43.7	Very low	52.5	Low	174 Å²	174	130.5 Å²	130.5	76%	0.757	68%	0.683	S	S	*	*			trans	-112.7	15.5	178.2	-87	-165.9	171.3	-163.4	0	114.9	Q1290 Q1291 P1296	Q1290-K1294 WeakPolarHBondContact O-CB 3.35Å; Q1290-K1294 WeakPolarHBondContact O-CG 3.36Å; Q1290-K1294 PolarHBondContact O-N 2.82Å; Q1291-K1294 PolarHBondContact O-N 2.58Å; K1294-P1296 WeakPolarHBondContact O-CD 3.5Å
1295	Q	36.1	Very low	50.8	Low	168 Å²	168	133.8 Å²	133.8	79%	0.785	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-87.1	118.6	164.7	-76	-167.9	-54.5	0	0	110.6
1296	P	41.5	Very low	49	Very low	106 Å²	106	136.9 Å²	136.9	69%	0.688	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-79.6	154.3	175.8	33.4	-35	0	0	0	111.7	K1294 A1298	K1294-P1296 WeakPolarHBondContact O-CD 3.5Å; P1296-A1298 PolarHBondContact O-N 3.33Å
1297	P	33.9	Very low	47.4	Very low	135 Å²	135	137.9 Å²	137.9	88%	0.877	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-74.1	119.8	169.2	30.7	-31.8	0	0	0	109.9
1298	A	36.3	Very low	45.9	Very low	96 Å²	96	137.5 Å²	137.5	79%	0.793	72%	0.72	S	S	*	*			trans	-110.9	139	-178.8	0	0	0	0	0	112.4	P1296	P1296-A1298 PolarHBondContact O-N 3.33Å
1299	D	35.7	Very low	44.4	Very low	164 Å²	164	136.1 Å²	136.1	88%	0.877	73%	0.725	S	S	*	*			trans	-58.5	148.7	-163.3	-64.3	-79.8	0	0	0	120.3
1300	G	34	Very low	43.8	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	74%	0.738	S	S	*	*			trans	87	173.5	138.1	0	0	0	0	0	118.6
1301	V	37.1	Very low	43.5	Very low	122 Å²	122	136.6 Å²	136.6	74%	0.739	75%	0.747	S	S	*	*			cis	-153.4	144.2	7	171.8	0	0	0	0	111.4
1302	R	34.2	Very low	42.6	Very low	238 Å²	238	136.7 Å²	136.7	90%	0.898	76%	0.76	S	S	*	*			trans	74.6	136.8	161.4	-78.2	159	-160.9	-104.6	-0.7	122.2
1303	G	38.5	Very low	42	Very low	69 Å²	69	135.1 Å²	135.1	71%	0.711	76%	0.758	S	S	*	*			trans	-98.1	-137.4	156.1	0	0	0	0	0	111.6
1304	P	50.6	Low	41.4	Very low	110 Å²	110	132.3 Å²	132.3	71%	0.714	76%	0.759	S	S	*	*			cis	-141.3	-144	15.2	44.9	-24	0	0	0	114.4
1305	F	40.2	Very low	41.2	Very low	181 Å²	181	132 Å²	132	79%	0.794	76%	0.76	S	S	*	*			trans	79.3	134.4	-177.4	-61.5	-75.2	0	0	0	114.9
1306	R	42.5	Very low	41.4	Very low	195 Å²	195	130 Å²	130	74%	0.736	76%	0.759	S	S	*	*			cis	-139.5	146.2	2.3	-107.3	176.1	-174.2	-97.3	12.8	108.7
1307	Q	44.7	Very low	41.4	Very low	131 Å²	131	128.7 Å²	128.7	61%	0.612	76%	0.757	S	S	*	*				47.8	125.8	97.6	-71.4	-179	-46.5	0	0	114.5
1308	D	45.1	Very low	41.8	Very low	132 Å²	132	132.8 Å²	132.8	71%	0.706	76%	0.755	S	S	*	*			cis	-153.9	158.7	17.2	-93.7	-39.6	0	0	0	115.8
1309	V	42	Very low	42	Very low	125 Å²	125	135.3 Å²	135.3	76%	0.758	76%	0.755	S	S	*	*			trans	47.7	117.5	150.2	-178.4	0	0	0	0	121.7
1310	P	57.5	Low	42.1	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	75%	0.747	S	S	*	*			trans	-102.1	171.2	157.5	39.9	-33	0	0	0	112.9
1311	P	54.3	Low	42.3	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	75%	0.749	S	S	*	*			trans	-134	144.9	149.5	36.9	-24.3	0	0	0	115.1
1312	S	38.6	Very low	42.5	Very low	111 Å²	111	142 Å²	142	78%	0.776	75%	0.752	S	S	*	*			trans	-99.4	-142.4	161.5	-46.6	0	0	0	0	109.1
1313	P	43.9	Very low	42.7	Very low	109 Å²	109	139.4 Å²	139.4	71%	0.708	75%	0.75	S	S	*	*				-118.1	-179.2	-78.8	35	-21.2	0	0	0	113.5
1314	S	38	Very low	42.7	Very low	102 Å²	102	142 Å²	142	71%	0.713	75%	0.752	S	S	*	*			trans	70	165.8	160.9	73.4	0	0	0	0	116.1
1315	Q	39.5	Very low	42.5	Very low	166 Å²	166	141.8 Å²	141.8	78%	0.776	75%	0.751	S	S	*	*			cis	-146.8	-174	21.3	-59.1	177.6	5.9	0	0	112.5
1316	V	40.3	Very low	42.4	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	74%	0.744	S	S	*	*			trans	59.7	148.5	163.6	-85.6	0	0	0	0	119.3
1317	A	41.9	Very low	42.5	Very low	78 Å²	78	138.5 Å²	138.5	65%	0.645	74%	0.744	S	S	*	*			cis	-143.5	150.5	-2.4	0	0	0	0	0	110.1
1318	R	42.8	Very low	42.2	Very low	221 Å²	221	135.6 Å²	135.6	83%	0.834	75%	0.749	S	S	*	*				46.9	131	94	-59.4	-179.8	170.7	153.1	-3.8	114.1
1319	L	40.4	Very low	42.4	Very low	150 Å²	150	140 Å²	140	79%	0.785	76%	0.756	S	S	*	*			cis	-135.6	178.4	7.1	-69.8	95.8	0	0	0	109.1
1320	N	38.6	Very low	42.7	Very low	133 Å²	133	138 Å²	138	71%	0.711	75%	0.746	S	S	*	*			cis	-159.5	154.9	22.9	-147.7	-16.5	0	0	0	114.2
1321	R	36.4	Very low	41.8	Very low	212 Å²	212	140 Å²	140	80%	0.8	74%	0.743	S	S	*	*			trans	34	111.9	166.1	-85	175.2	165.1	177.9	-4.5	119.5
1322	L	42.7	Very low	41.3	Very low	153 Å²	153	143.4 Å²	143.4	80%	0.801	74%	0.741	S	S	*	*				63.3	131	72.8	-64.8	162.8	0	0	0	112.7
1323	Q	37.6	Very low	41.1	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	72%	0.716	S	S	*	*			cis	-137.3	157.9	30.1	-114.9	160.4	3.7	0	0	114.6
1324	T	38.9	Very low	40.9	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	72%	0.716	S	S	*	*			trans	-133.5	-173.1	171.7	54.7	0	0	0	0	108.3
1325	P	45.7	Very low	41.1	Very low	106 Å²	106	143.4 Å²	143.4	69%	0.688	72%	0.717	S	S	*	*			cis	-110.2	-114.5	-30.1	16.7	7.1	0	0	0	109.8
1326	E	39.9	Very low	41.2	Very low	136 Å²	136	142.2 Å²	142.2	64%	0.636	71%	0.713	S	S	*	*			cis	-165.6	-167.3	-11.6	-143.5	-170.2	131	0	0	110.4
1327	K	42.6	Very low	41.2	Very low	172 Å²	172	143.1 Å²	143.1	75%	0.748	71%	0.71	S	S	*	*			trans	40.2	105.2	153.7	-64.9	168.4	-153.5	174	0	118.5
1328	G	40	Very low	41.2	Very low	70 Å²	70	147.1 Å²	147.1	72%	0.722	71%	0.714	S	S	*	*			cis	108.6	117	-4.7	0	0	0	0	0	115.2
1329	R	49.1	Very low	41.1	Very low	224 Å²	224	142.2 Å²	142.2	85%	0.845	71%	0.706	S	S	*	*			trans	69.7	162.9	166.7	-68.1	-172.7	179.8	-127.7	-0.5	115.4
1330	P	46.8	Very low	41.1	Very low	83 Å²	83	141.6 Å²	141.6	54%	0.539	70%	0.7	S	S	.	*			cis	-127.2	-164	11.3	46.2	-31.2	0	0	0	115.1	R1036	R1036-P1330 VanDerWaalsContact CD-O 3.28Å; R1036-P1330 WeakPolarHBondContact CD-O 3.37Å; R1036-P1330 PolarHBondContact NE-O 3.26Å
1331	F	40.3	Very low	41.3	Very low	158 Å²	158	142.3 Å²	142.3	69%	0.693	70%	0.7	S	S	*	*			trans	17.7	156.4	157.2	-60.4	-58.8	0	0	0	123.3
1332	Y	42.7	Very low	41.7	Very low	193 Å²	193	136.5 Å²	136.5	76%	0.757	69%	0.691	S	S	*	*			cis	-88.3	-47.4	-4.9	-143.5	-98.1	0	0	0	112.2	K1038	K1038-Y1332 PolarHBondContact NZ-O 3.33Å
1333	S	34.5	Very low	41.6	Very low	36 Å²	36	135 Å²	135	25%	0.252	68%	0.681	S	S	.	*			trans	-63.2	0	179	-77.3	0	0	0	0	114.2	R1036 K1038	R1036-S1333 WeakPolarHBondContact CD-OXT 3.27Å; R1036-S1333 PolarHBondContact NH1-OXT 2.96Å; K1038-S1333 WeakPolarHBondContact CA-O 3.45Å; K1038-S1333 VanDerWaalsContact CB-C 3.44Å; K1038-S1333 VanDerWaalsContact CB-O 3.3Å; K1038-S1333 WeakPolarHBondContact CB-O 3.22Å; K1038-S1333 WeakPolarHBondContact CE-OXT 3.49Å; K1038-S1333 VanDerWaalsContact CG-O 3.31Å; K1038-S1333 WeakPolarHBondContact CG-O 3.35Å; K1038-S1333 VanDerWaalsContact N-C 3.32Å; K1038-S1333 VanDerWaalsContact N-CA 3.29Å; K1038-S1333 PolarHBondContact N-O 2.99Å; K1038-S1333 PolarHBondContact NZ-OG 2.78Å; K1038-S1333 PolarHBondContact NZ-OXT 2.86Å

Retrieved 1,333 of 1,333 residues in 1417.7 ms (Link to these results)

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