RAB14_HUMAN Loading...

Ras-related protein Rab-14

The small GTPases Rab are key regulators of intracellular membrane trafficking, from the formation of transport vesicles to their fusion with membranes. Rabs cycle between an inactive GDP-bound form and an active GTP-bound form that is able to recruit to membranes different set of downstream effectors directly responsible for vesicle formation, movement, tethering and fusion¹. RAB14 is involved in membrane trafficking between the Golgi complex and endosomes during early embryonic development (By similarity). Regulates the Golgi to endosome transport of FGFR-containing vesicles during early development, a key process for developing basement membrane and epiblast and primitive endoderm lineages during early postimplantation development. May act by modulating the kinesin KIF16B-cargo association to endosomes (By similarity). Regulates, together with its guanine nucleotide exchange factor DENND6A, the specific endocytic transport of ADAM10, N-cadherin/CDH2 shedding and cell-cell adhesion². Mediates endosomal tethering and fusion through the interaction with RUFY1 and RAB4B³. Interaction with RAB11FIP1 may function in the process of neurite formation⁴.

AlphaFold DB , UniProt , Accession P61106, Species HUMAN (Homo sapiens, Human), Gene RAB14, Length 215 aa.

Structure Viewer

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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	35.9	Very low	68.3	Low	226 Å²	226	88.5 Å²	88.5	100%	1.113	50%	0.504	S	S	*	.				0	120.7	0	-74.5	177.7	-176.6	0	0	107.5	T3	M1-T3 PolarHBondContact O-N 3.23Å; M1-T3 VanDerWaalsContact O-N 3.09Å
2	A	40.7	Very low	70.6	Confident	103 Å²	103	81.2 Å²	81.2	85%	0.851	46%	0.462	S	S	*	.			trans	-69.8	104.3	172	0	0	0	0	0	107.5	A4	A2-A4 PolarHBondContact O-N 3.35Å
3	T	45.7	Very low	72.5	Confident	127 Å²	127	77.8 Å²	77.8	78%	0.779	44%	0.439	S	S	*	.			trans	-57	109	161.9	35.1	0	0	0	0	105.8	M1 P5	M1-T3 PolarHBondContact O-N 3.23Å; M1-T3 VanDerWaalsContact O-N 3.09Å; T3-P5 VanDerWaalsContact O-CD 3.27Å; T3-P5 WeakPolarHBondContact O-CD 3.47Å
4	A	52.2	Low	74.3	Confident	62 Å²	62	72.3 Å²	72.3	51%	0.512	41%	0.408	S	S	.	.			trans	-53.6	118.9	176.6	0	0	0	0	0	107	A2 Y6 N7	A2-A4 PolarHBondContact O-N 3.35Å; A4-Y6 PolarHBondContact O-N 2.93Å; A4-N7 PolarHBondContact O-N 3.36Å; A4-N7 VanDerWaalsContact O-N 3.09Å
5	P	56.2	Low	75.7	Confident	107 Å²	107	67.5 Å²	67.5	70%	0.695	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.2	-172.6	17.4	-28.3	0	0	0	112.7	T3	T3-P5 VanDerWaalsContact O-CD 3.27Å; T3-P5 WeakPolarHBondContact O-CD 3.47Å
6	Y	68.4	Low	76.9	Confident	177 Å²	177	63.3 Å²	63.3	69%	0.694	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	18.7	-178.1	-66.7	-79.4	0	0	0	115.3	A4 Y8 I52	A4-Y6 PolarHBondContact O-N 2.93Å; Y6-Y8 WeakPolarHBondContact O-CD1 3.43Å; Y6-Y8 WeakPolarHBondContact O-CE1 3.4Å; Y6-Y8 PolarHBondContact O-N 3.08Å; Y6-I52 HydrophobicContact CD1-CD1 3.98Å
7	N	85.9	Confident	78	Confident	90 Å²	90	59.6 Å²	59.6	48%	0.481	34%	0.336	S	S	.	.			trans	-76.2	126.4	174.8	-156.8	19.6	0	0	0	110.9	A4 K59	A4-N7 PolarHBondContact O-N 3.36Å; A4-N7 VanDerWaalsContact O-N 3.09Å; N7-K59 WeakPolarHBondContact O-CD 3.33Å
8	Y	89.6	Confident	78.9	Confident	26 Å²	26	56.3 Å²	56.3	10%	0.102	32%	0.318	C	S	.	.			trans	-146.7	146.2	177.5	57	-95.6	0	0	0	110.2	Y6 Y10 I11 I52 K59 K61 K193	Y6-Y8 WeakPolarHBondContact O-CD1 3.43Å; Y6-Y8 WeakPolarHBondContact O-CE1 3.4Å; Y6-Y8 PolarHBondContact O-N 3.08Å; Y8-Y10 WeakPolarHBondContact CD2-O 3.31Å; Y8-I11 HydrophobicContact CD2-CG1 4.03Å; Y8-I11 HydrophobicContact CE2-CD1 3.71Å; Y8-I11 HydrophobicContact CE2-CG1 3.34Å; Y8-I52 HydrophobicContact CD1-CD1 3.77Å; Y8-I52 HydrophobicContact CD1-CG1 4.26Å; Y8-I52 HydrophobicContact CE1-CD1 4.43Å; Y8-K59 WeakPolarHBondContact CA-O 3.43Å; Y8-K59 WeakPolarHBondContact CB-O 3.28Å; Y8-K61 HydrophobicContact CD1-CB 4.04Å; Y8-K61 HydrophobicContact CD1-CD 4.24Å; Y8-K61 HydrophobicContact CD2-CB 3.79Å; Y8-K61 HydrophobicContact CE1-CB 4.2Å; Y8-K61 HydrophobicContact CE1-CD 3.6Å; Y8-K61 HydrophobicContact CE1-CG 4.48Å; Y8-K61 HydrophobicContact CE2-CB 3.94Å; Y8-K61 HydrophobicContact CE2-CD 4.09Å; Y8-K61 HydrophobicContact CG-CB 3.84Å; Y8-K61 VanDerWaalsContact CZ-CD 3.48Å; Y8-K193 HydrophobicContact CD2-CD 4.27Å; Y8-K193 HydrophobicContact CE2-CD 3.6Å; Y8-K193 HydrophobicContact CE2-CG 4.4Å; Y8-K193 PolarHBondContact OH-NZ 3.48Å
9	S	89.7	Confident	79.6	Confident	29 Å²	29	54.2 Å²	54.2	20%	0.203	31%	0.306	C	S	.	.	S	Bend	trans	-89.4	-30.2	-176.6	-48	0	0	0	0	111.9	Q58 K59 H192 K193	S9-Q58 PolarHBondContact OG-OE1 3.02Å; S9-K59 PolarHBondContact N-O 3.22Å; S9-H192 PolarHBondContact O-CD2 3.15Å; S9-K193 PolarHBondContact O-N 3.41Å
10	Y	93.2	Very high	80.3	Confident	19 Å²	19	54.9 Å²	54.9	8%	0.075	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.3	-175.5	-62.3	-84	0	0	0	112.6	Y8 F12 Q58 K59 I60 K61 Y173 I176 V190 Q191 H192	Y8-Y10 WeakPolarHBondContact CD2-O 3.31Å; Y10-F12 HydrophobicContact CD1-CE1 4.33Å; Y10-F12 HydrophobicContact CG-CE1 4.19Å; Y10-Q58 HydrophobicContact CE2-CG 4.36Å; Y10-K59 PolarHBondContact N-O 2.99Å; Y10-I60 HydrophobicContact CD2-CG1 4.47Å; Y10-I60 WeakPolarHBondContact O-CA 3.3Å; Y10-K61 PolarHBondContact O-N 3.09Å; Y10-Y173 HydrophobicContact CD2-CE2 4.38Å; Y10-Y173 HydrophobicContact CE2-CD2 4.31Å; Y10-Y173 AromaticContact CE2-CE2 3.77Å; Y10-Y173 HydrophobicContact CE2-CE2 3.77Å; Y10-I176 HydrophobicContact CD1-CD1 4.25Å; Y10-I176 HydrophobicContact CE1-CD1 4.22Å; Y10-I176 HydrophobicContact CE1-CG2 4.47Å; Y10-V190 HydrophobicContact CD1-CG1 4.02Å; Y10-Q191 CarbonylContact C-O 3.58Å; Y10-Q191 VanDerWaalsContact CA-O 3.28Å; Y10-Q191 WeakPolarHBondContact CA-O 3.37Å; Y10-H192 HydrophobicContact CD1-CB 4.16Å; Y10-H192 AromaticContact CD1-CD2 3.94Å; Y10-H192 HydrophobicContact CE1-CB 3.97Å; Y10-H192 AromaticContact CE1-CD2 3.4Å; Y10-H192 WeakPolarHBondContact CE1-CD2 3.2Å; Y10-H192 AromaticContact CE1-CG 3.95Å; Y10-H192 AromaticContact CZ-CD2 3.59Å
11	I	94.3	Very high	80.8	Confident	8 Å²	8	53.6 Å²	53.6	4%	0.041	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.9	163.7	-54.3	177.6	0	0	0	107.9	Y8 K61 Q63 V190 Q191	Y8-I11 HydrophobicContact CD2-CG1 4.03Å; Y8-I11 HydrophobicContact CE2-CD1 3.71Å; Y8-I11 HydrophobicContact CE2-CG1 3.34Å; I11-K61 CarbonylContact C-O 3.6Å; I11-K61 VanDerWaalsContact CA-O 3.27Å; I11-K61 WeakPolarHBondContact CA-O 3.5Å; I11-K61 HydrophobicContact CG1-CB 4.32Å; I11-Q63 HydrophobicContact CG2-CB 4.44Å; I11-Q63 HydrophobicContact CG2-CG 3.74Å; I11-V190 WeakPolarHBondContact O-CA 3.2Å; I11-Q191 HydrophobicContact CB-CB 4.11Å; I11-Q191 HydrophobicContact CD1-CB 4.49Å; I11-Q191 HydrophobicContact CG1-CB 4.47Å; I11-Q191 PolarHBondContact N-O 2.74Å; I11-Q191 PolarHBondContact O-N 3.18Å
12	F	95.8	Very high	83.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.1	170.9	-62.1	-11.6	0	0	0	109.8	Y10 Y14 I60 K61 L62 Q63 A85 A169 I172 I176 V190	Y10-F12 HydrophobicContact CD1-CE1 4.33Å; Y10-F12 HydrophobicContact CG-CE1 4.19Å; F12-Y14 HydrophobicContact CB-CD1 4.34Å; F12-Y14 HydrophobicContact CB-CE1 3.95Å; F12-Y14 HydrophobicContact CD2-CE1 4.48Å; F12-I60 HydrophobicContact CB-CG2 4.37Å; F12-I60 HydrophobicContact CD1-CG2 4.06Å; F12-I60 HydrophobicContact CD2-CD1 4.46Å; F12-I60 HydrophobicContact CD2-CG2 3.59Å; F12-I60 HydrophobicContact CE1-CG2 4.21Å; F12-I60 HydrophobicContact CE2-CD1 3.65Å; F12-I60 HydrophobicContact CE2-CG2 3.79Å; F12-I60 HydrophobicContact CG-CG2 3.73Å; F12-I60 HydrophobicContact CZ-CD1 3.77Å; F12-I60 HydrophobicContact CZ-CG2 4.09Å; F12-K61 PolarHBondContact N-O 3.49Å; F12-L62 HydrophobicContact CB-CD2 3.85Å; F12-L62 HydrophobicContact CD2-CD2 4.15Å; F12-L62 HydrophobicContact CG-CD2 4.41Å; F12-Q63 PolarHBondContact O-N 2.81Å; F12-A85 HydrophobicContact CB-CB 4.47Å; F12-A169 HydrophobicContact CD2-CB 4.37Å; F12-A169 HydrophobicContact CE2-CB 4.39Å; F12-I172 HydrophobicContact CD1-CG2 4.16Å; F12-I172 HydrophobicContact CD2-CB 4.1Å; F12-I172 HydrophobicContact CD2-CD1 4.12Å; F12-I172 HydrophobicContact CD2-CG2 3.85Å; F12-I172 HydrophobicContact CE1-CG2 3.91Å; F12-I172 HydrophobicContact CE2-CB 3.75Å; F12-I172 HydrophobicContact CE2-CG2 3.54Å; F12-I172 HydrophobicContact CG-CG2 4.17Å; F12-I172 HydrophobicContact CZ-CB 4.23Å; F12-I172 HydrophobicContact CZ-CG2 3.59Å; F12-I176 HydrophobicContact CE1-CD1 3.67Å; F12-I176 HydrophobicContact CZ-CD1 3.73Å; F12-V190 HydrophobicContact CD1-CB 4.27Å; F12-V190 HydrophobicContact CD1-CG1 3.94Å; F12-V190 HydrophobicContact CD1-CG2 3.78Å; F12-V190 HydrophobicContact CE1-CB 4.35Å; F12-V190 HydrophobicContact CE1-CG1 3.67Å; F12-V190 HydrophobicContact CE1-CG2 3.88Å
13	K	95.2	Very high	86.2	Confident	38 Å²	38	38.5 Å²	38.5	17%	0.165	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.6	173.1	177.8	174.9	164.6	-167.3	0	110.4	Q63 Y80 R82 G83 A85 G86 G189	K13-Q63 CarbonylContact C-O 3.56Å; K13-Q63 WeakPolarHBondContact CA-O 3.24Å; K13-Y80 WeakPolarHBondContact CE-O 2.87Å; K13-Y80 PolarHBondContact NZ-O 2.81Å; K13-R82 PolarHBondContact NZ-O 2.9Å; K13-G83 WeakPolarHBondContact CD-O 3.41Å; K13-A85 PolarHBondContact O-N 2.98Å; K13-G86 PolarHBondContact O-N 3.16Å; K13-G189 PolarHBondContact N-O 2.61Å
14	Y	96.9	Very high	88.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146	175.2	-77.7	14.7	0	0	0	111.1	F12 L62 Q63 I64 W65 G86 L88 F165 A168 A169 I172	F12-Y14 HydrophobicContact CB-CD1 4.34Å; F12-Y14 HydrophobicContact CB-CE1 3.95Å; F12-Y14 HydrophobicContact CD2-CE1 4.48Å; Y14-L62 HydrophobicContact CD2-CD1 4.34Å; Y14-L62 HydrophobicContact CE1-CD2 4.1Å; Y14-L62 HydrophobicContact CE2-CD1 3.92Å; Y14-L62 HydrophobicContact CE2-CD2 4.22Å; Y14-Q63 PolarHBondContact N-O 3.48Å; Y14-I64 HydrophobicContact CD2-CG1 4.48Å; Y14-W65 PolarHBondContact O-N 2.92Å; Y14-G86 VanDerWaalsContact CA-O 3.29Å; Y14-G86 WeakPolarHBondContact CA-O 3.37Å; Y14-L88 HydrophobicContact CD2-CD1 3.38Å; Y14-L88 HydrophobicContact CE2-CD1 3.9Å; Y14-L88 HydrophobicContact CG-CD1 3.99Å; Y14-F165 AromaticContact CD2-CD1 3.93Å; Y14-F165 HydrophobicContact CD2-CD1 3.93Å; Y14-F165 HydrophobicContact CD2-CE1 4.47Å; Y14-F165 HydrophobicContact CE2-CD1 4.14Å; Y14-F165 PolarHBondContact OH-O 3.29Å; Y14-A168 HydrophobicContact CE2-CB 4.11Å; Y14-A168 WeakPolarHBondContact OH-CB 3.38Å; Y14-A169 WeakPolarHBondContact OH-CA 3.47Å; Y14-A169 VanDerWaalsContact OH-CB 3.29Å; Y14-A169 WeakPolarHBondContact OH-CB 3.29Å; Y14-A169 PolarHBondContact OH-N 2.73Å; Y14-I172 HydrophobicContact CD1-CD1 4.45Å; Y14-I172 HydrophobicContact CE1-CD1 3.44Å; Y14-I172 VanDerWaalsContact CE1-CD1 3.44Å
15	I	95.3	Very high	90.5	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142	166.4	62.4	178.7	0	0	0	109	I17 W65 Y80 Y81 A84 G86 A87 L88 T113	I15-I17 HydrophobicContact CB-CG2 4.49Å; I15-I17 HydrophobicContact CD1-CG2 4.04Å; I15-I17 HydrophobicContact CG1-CG2 4.19Å; I15-W65 WeakPolarHBondContact CA-O 3.46Å; I15-W65 HydrophobicContact CG2-CB 4.4Å; I15-Y80 WeakPolarHBondContact CG2-O 3.43Å; I15-Y81 HydrophobicContact CD1-CD1 3.25Å; I15-Y81 HydrophobicContact CD1-CE1 3.63Å; I15-Y81 HydrophobicContact CD1-CG 3.86Å; I15-A84 HydrophobicContact CD1-CB 4.07Å; I15-A84 HydrophobicContact CG1-CB 4.11Å; I15-A84 HydrophobicContact CG2-CB 3.94Å; I15-G86 PolarHBondContact N-O 3.05Å; I15-A87 HydrophobicContact CD1-CB 4.05Å; I15-A87 HydrophobicContact CG1-CB 3.76Å; I15-A87 WeakPolarHBondContact O-CA 3.41Å; I15-L88 PolarHBondContact O-N 2.99Å; I15-T113 HydrophobicContact CD1-CG2 4.15Å
16	I	95.8	Very high	92.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.5	169.1	-43.2	-178.4	0	0	0	108.1	K24 L28 I64 W65 D66 T67 L88 V90 F165	I16-K24 HydrophobicContact CB-CB 4.38Å; I16-K24 HydrophobicContact CG2-CB 3.66Å; I16-K24 HydrophobicContact CG2-CD 3.93Å; I16-K24 HydrophobicContact CG2-CG 3.73Å; I16-L28 HydrophobicContact CD1-CB 4.05Å; I16-I64 HydrophobicContact CD1-CG2 3.68Å; I16-I64 HydrophobicContact CG1-CG2 3.71Å; I16-W65 PolarHBondContact N-O 2.91Å; I16-D66 HydrophobicContact CD1-CB 4.44Å; I16-T67 PolarHBondContact O-N 2.85Å; I16-T67 PolarHBondContact O-OG1 2.76Å; I16-L88 WeakPolarHBondContact CA-O 3.24Å; I16-L88 HydrophobicContact CB-CB 4.46Å; I16-L88 HydrophobicContact CG1-CB 4.32Å; I16-L88 HydrophobicContact CG2-CB 4.1Å; I16-V90 HydrophobicContact CG2-CG2 3.66Å; I16-F165 HydrophobicContact CD1-CE1 4.49Å; I16-F165 HydrophobicContact CD1-CZ 4.21Å
17	I	94.4	Very high	93.6	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	161.6	-176	65.9	175	0	0	0	110.6	I15 K24 Y81 L88 M89 V90 W105 A109	I15-I17 HydrophobicContact CB-CG2 4.49Å; I15-I17 HydrophobicContact CD1-CG2 4.04Å; I15-I17 HydrophobicContact CG1-CG2 4.19Å; I17-K24 VanDerWaalsContact C-CD 3.5Å; I17-Y81 HydrophobicContact CD1-CE1 4.02Å; I17-Y81 HydrophobicContact CG2-CE1 4.03Å; I17-L88 PolarHBondContact N-O 2.91Å; I17-M89 HydrophobicContact CD1-CB 4.32Å; I17-M89 HydrophobicContact CD1-CG 4.35Å; I17-M89 HydrophobicContact CG1-CB 4.05Å; I17-M89 HydrophobicContact CG1-CG 4.2Å; I17-V90 PolarHBondContact O-N 3.04Å; I17-W105 HydrophobicContact CB-CE3 4.03Å; I17-W105 HydrophobicContact CB-CZ3 4.32Å; I17-W105 HydrophobicContact CD1-CB 4.37Å; I17-A109 HydrophobicContact CD1-CB 3.97Å
18	G	94.6	Very high	94.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.082	C	C	.	.			trans	132.2	170.7	-175.7	0	0	0	0	0	112.2	K24 G69 W105	G18-K24 PolarHBondContact O-NZ 2.92Å; G18-G69 WeakPolarHBondContact O-CA 3.2Å; G18-W105 VanDerWaalsContact C-CZ2 3.44Å; G18-W105 WeakPolarHBondContact O-CZ2 3.36Å
19	D	93.5	Very high	94.3	Very high	17 Å²	17	14.3 Å²	14.3	9%	0.091	8%	0.084	C	C	.	.			trans	-59.4	162.1	-173.9	-85.2	17.5	0	0	0	113.9	V22 K24 T98 H101 W105	D19-V22 HydrophobicContact CB-CG1 3.77Å; D19-V22 VanDerWaalsContact O-CG2 3.25Å; D19-V22 WeakPolarHBondContact O-CG2 3.36Å; D19-K24 PolarHBondContact O-NZ 3.35Å; D19-T98 HydrophobicContact CB-CG2 3.9Å; D19-H101 IonicContact OD1-CG 3.18Å; D19-H101 IonicContact OD1-ND1 2.7Å; D19-H101 IonicContact OD2-CE1 3.35Å; D19-H101 IonicContact OD2-CG 2.64Å; D19-H101 IonicContact OD2-ND1 3.39Å; D19-H101 PolarHBondContact OD2-ND1 2.89Å; D19-W105 PolarHBondContact OD1-NE1 3.5Å
20	M	91.9	Very high	94.6	Very high	67 Å²	67	13.8 Å²	13.8	33%	0.33	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	138.1	170.8	-172.2	177.8	73.4	0	0	111.2	V22 H42 G69 Q70 R95	M20-V22 VanDerWaalsContact C-N 3.29Å; M20-V22 PolarHBondContact O-N 2.98Å; M20-H42 HydrophobicContact CG-CB 4.35Å; M20-H42 HydrophobicContact SD-CB 4.02Å; M20-H42 PolarHBondContact SD-CD2 3.18Å; M20-H42 VanDerWaalsContact SD-CG 3.51Å; M20-G69 PolarHBondContact N-O 2.97Å; M20-Q70 HydrophobicContact CB-CG 4.42Å; M20-Q70 HydrophobicContact CG-CG 4.33Å; M20-Q70 HydrophobicContact SD-CG 3.36Å; M20-Q70 WeakPolarHBondContact SD-CG 3.33Å; M20-Q70 PolarHBondContact SD-NE2 2.97Å; M20-Q70 VanDerWaalsContact SD-NE2 3.45Å; M20-R95 PolarHBondContact O-NH1 2.99Å; M20-R95 VanDerWaalsContact O-NH1 3.09Å; M20-R95 PolarHBondContact O-NH2 3.3Å; M20-R95 VanDerWaalsContact O-NH2 3.1Å
21	G	92.1	Very high	94.8	Very high	29 Å²	29	12.9 Å²	12.9	30%	0.299	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	9.4	174.3	0	0	0	0	0	115.6	G23 K125	G21-G23 VanDerWaalsContact C-N 3.27Å; G21-K125 PolarHBondContact O-NZ 3.28Å
22	V	95.1	Very high	94.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	-75.2	-16.8	172.7	-56.9	0	0	0	0	112.9	D19 M20 K24 V90 D92 T98 N124	D19-V22 HydrophobicContact CB-CG1 3.77Å; D19-V22 VanDerWaalsContact O-CG2 3.25Å; D19-V22 WeakPolarHBondContact O-CG2 3.36Å; M20-V22 VanDerWaalsContact C-N 3.29Å; M20-V22 PolarHBondContact O-N 2.98Å; V22-K24 HydrophobicContact CG2-CD 4.39Å; V22-K24 HydrophobicContact CG2-CG 3.63Å; V22-V90 HydrophobicContact CB-CG1 4.23Å; V22-V90 HydrophobicContact CG2-CB 3.89Å; V22-V90 HydrophobicContact CG2-CG1 3.78Å; V22-D92 HydrophobicContact CB-CB 4.25Å; V22-D92 HydrophobicContact CG1-CB 4.1Å; V22-T98 HydrophobicContact CG1-CG2 3.71Å; V22-N124 PolarHBondContact O-ND2 3.13Å
23	G	94.7	Very high	94.6	Very high	11 Å²	11	18.7 Å²	18.7	11%	0.113	11%	0.105	C	C	.	.	S	Bend	trans	101.8	25.8	177	0	0	0	0	0	115.7	G21 C26 L27	G21-G23 VanDerWaalsContact C-N 3.27Å; G23-C26 WeakPolarHBondContact O-CB 3.32Å; G23-C26 PolarHBondContact O-N 3.11Å; G23-L27 WeakPolarHBondContact O-CG 3.47Å; G23-L27 PolarHBondContact O-N 3.37Å
24	K	94.5	Very high	94.3	Very high	9 Å²	9	22.7 Å²	22.7	4%	0.039	12%	0.123	C	C	.	.	H	α-helix	trans	-54	-52.7	176.5	-58.9	-171.6	-62.2	-72.9	0	113.2	I16 I17 G18 D19 V22 C26 L27 L28 D66 T67 V90	I16-K24 HydrophobicContact CB-CB 4.38Å; I16-K24 HydrophobicContact CG2-CB 3.66Å; I16-K24 HydrophobicContact CG2-CD 3.93Å; I16-K24 HydrophobicContact CG2-CG 3.73Å; I17-K24 VanDerWaalsContact C-CD 3.5Å; G18-K24 PolarHBondContact O-NZ 2.92Å; D19-K24 PolarHBondContact O-NZ 3.35Å; V22-K24 HydrophobicContact CG2-CD 4.39Å; V22-K24 HydrophobicContact CG2-CG 3.63Å; K24-C26 VanDerWaalsContact C-N 3.31Å; K24-C26 PolarHBondContact O-N 2.83Å; K24-L27 WeakPolarHBondContact O-CB 3.25Å; K24-L27 PolarHBondContact O-N 2.85Å; K24-L28 PolarHBondContact O-N 2.72Å; K24-D66 WeakPolarHBondContact CB-OD1 3.36Å; K24-T67 WeakPolarHBondContact CE-O 3.37Å; K24-V90 HydrophobicContact CG-CB 4.22Å; K24-V90 HydrophobicContact CG-CG2 4.27Å
25	S	93.2	Very high	93.8	Very high	10 Å²	10	28.3 Å²	28.3	7%	0.07	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-37.5	177	-37	0	0	0	0	111.6	L27 L28 H29 T43 D66	S25-L27 PolarHBondContact O-N 3.24Å; S25-L28 WeakPolarHBondContact O-CB 3.48Å; S25-L28 PolarHBondContact O-N 3.48Å; S25-H29 PolarHBondContact O-CD2 3.22Å; S25-H29 PolarHBondContact O-N 2.88Å; S25-T43 PolarHBondContact OG-OG1 3.39Å; S25-D66 WeakPolarHBondContact CA-OD2 3.43Å; S25-D66 WeakPolarHBondContact CB-OD2 3.45Å; S25-D66 PolarHBondContact OG-OD2 2.85Å
26	C	94.5	Very high	93.2	Very high	24 Å²	24	32.1 Å²	32.1	16%	0.162	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-40.8	176	-53.9	0	0	0	0	111.8	G23 K24 Q30 F36 A155	G23-C26 WeakPolarHBondContact O-CB 3.32Å; G23-C26 PolarHBondContact O-N 3.11Å; K24-C26 VanDerWaalsContact C-N 3.31Å; K24-C26 PolarHBondContact O-N 2.83Å; C26-Q30 WeakPolarHBondContact O-CB 3.18Å; C26-Q30 PolarHBondContact O-N 3.32Å; C26-F36 HydrophobicContact CB-CD2 4.2Å; C26-F36 HydrophobicContact CB-CE2 4.09Å; C26-A155 HydrophobicContact CB-CB 3.6Å
27	L	96.4	Very high	92.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-42.7	173	-72.7	169.1	0	0	0	111.1	G23 K24 S25 F31 V90 I122 N124 A153 A155 V161	G23-L27 WeakPolarHBondContact O-CG 3.47Å; G23-L27 PolarHBondContact O-N 3.37Å; K24-L27 WeakPolarHBondContact O-CB 3.25Å; K24-L27 PolarHBondContact O-N 2.85Å; S25-L27 PolarHBondContact O-N 3.24Å; L27-F31 VanDerWaalsContact O-CB 3.24Å; L27-F31 WeakPolarHBondContact O-CB 3.39Å; L27-F31 PolarHBondContact O-N 2.93Å; L27-V90 HydrophobicContact CD1-CG1 3.8Å; L27-V90 HydrophobicContact CD1-CG2 3.87Å; L27-I122 HydrophobicContact CD1-CG2 4.21Å; L27-N124 HydrophobicContact CD1-CB 4.37Å; L27-A153 HydrophobicContact CD2-CB 4.33Å; L27-A155 HydrophobicContact CD2-CB 3.95Å; L27-A155 HydrophobicContact CG-CB 4.14Å; L27-V161 HydrophobicContact CD2-CG1 4.24Å; L27-V161 HydrophobicContact CD2-CG2 3.79Å
28	L	95.5	Very high	91.4	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-57.7	-57.2	175.8	178.2	61.8	0	0	0	111.2	I16 K24 S25 Q30 F31 T32 E47 I64 D66	I16-L28 HydrophobicContact CD1-CB 4.05Å; K24-L28 PolarHBondContact O-N 2.72Å; S25-L28 WeakPolarHBondContact O-CB 3.48Å; S25-L28 PolarHBondContact O-N 3.48Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.03Å; L28-F31 PolarHBondContact O-N 2.84Å; L28-F31 VanDerWaalsContact O-N 3.15Å; L28-T32 HydrophobicContact CD1-CG2 3.93Å; L28-T32 PolarHBondContact O-N 3.11Å; L28-T32 PolarHBondContact O-OG1 3.2Å; L28-E47 HydrophobicContact CD2-CB 4.42Å; L28-I64 HydrophobicContact CD1-CB 3.81Å; L28-I64 HydrophobicContact CD1-CD1 4.01Å; L28-I64 HydrophobicContact CD1-CG2 3.66Å; L28-D66 HydrophobicContact CD2-CB 3.65Å
29	H	94.2	Very high	90.3	Very high	34 Å²	34	48.4 Å²	48.4	16%	0.157	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-37.5	-178.8	-69.7	-67.1	0	0	0	112.6	S25 F31 T32 E33 K34 K35 E47	S25-H29 PolarHBondContact O-CD2 3.22Å; S25-H29 PolarHBondContact O-N 2.88Å; H29-F31 VanDerWaalsContact C-N 3.28Å; H29-F31 PolarHBondContact O-N 3.04Å; H29-T32 PolarHBondContact O-N 3.29Å; H29-E33 IonicContact CE1-OE1 3.62Å; H29-E33 IonicContact ND1-OE1 3.89Å; H29-E33 PolarHBondContact ND1-OE1 3.24Å; H29-E33 VanDerWaalsContact ND1-OE1 3.13Å; H29-E33 WeakPolarHBondContact O-CA 3.21Å; H29-E33 WeakPolarHBondContact O-CB 3.38Å; H29-E33 PolarHBondContact O-N 3.28Å; H29-K34 PolarHBondContact O-N 3.31Å; H29-K35 CarbonylContact C-O 3.39Å; H29-E47 IonicContact CE1-OE2 2.84Å; H29-E47 IonicContact NE2-OE2 2.72Å; H29-E47 PolarHBondContact NE2-OE2 3.01Å
30	Q	95.9	Very high	89	Confident	18 Å²	18	49.3 Å²	49.3	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-36.8	176.4	-176.4	65.9	-54	0	0	111	C26 L28 K34 K35 A155 V161	C26-Q30 WeakPolarHBondContact O-CB 3.18Å; C26-Q30 PolarHBondContact O-N 3.32Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.03Å; Q30-K34 WeakPolarHBondContact O-CA 3.29Å; Q30-K34 PolarHBondContact O-N 2.89Å; Q30-K34 VanDerWaalsContact OE1-CA 3.23Å; Q30-K34 PolarHBondContact OE1-O 3.4Å; Q30-K35 WeakPolarHBondContact CA-O 3.27Å; Q30-K35 PolarHBondContact N-O 3.34Å; Q30-K35 VanDerWaalsContact OE1-N 3.09Å; Q30-A155 WeakPolarHBondContact CG-O 3.47Å; Q30-A155 PolarHBondContact NE2-O 3.04Å; Q30-V161 HydrophobicContact CB-CG1 4.18Å; Q30-V161 HydrophobicContact CG-CB 4.26Å; Q30-V161 HydrophobicContact CG-CG1 4.03Å; Q30-V161 HydrophobicContact CG-CG2 4.01Å
31	F	96.6	Very high	88.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.7	-43.9	175.1	-179.6	-109.2	0	0	0	112.8	L27 L28 H29 R51 I53 L62 I64 V161 F165 L166	L27-F31 VanDerWaalsContact O-CB 3.24Å; L27-F31 WeakPolarHBondContact O-CB 3.39Å; L27-F31 PolarHBondContact O-N 2.93Å; L28-F31 PolarHBondContact O-N 2.84Å; L28-F31 VanDerWaalsContact O-N 3.15Å; H29-F31 VanDerWaalsContact C-N 3.28Å; H29-F31 PolarHBondContact O-N 3.04Å; F31-R51 HydrophobicContact CD1-CB 4.45Å; F31-R51 VanDerWaalsContact CD2-NH1 3.32Å; F31-R51 HydrophobicContact CE1-CB 3.78Å; F31-R51 HydrophobicContact CE1-CG 4.22Å; F31-R51 HydrophobicContact CZ-CB 4.38Å; F31-R51 HydrophobicContact CZ-CG 4.39Å; F31-R51 WeakPolarHBondContact O-CD 3.24Å; F31-R51 PolarHBondContact O-NH1 3.33Å; F31-I53 HydrophobicContact CE2-CG2 4.48Å; F31-I53 HydrophobicContact CZ-CG2 3.78Å; F31-L62 HydrophobicContact CE1-CD1 3.99Å; F31-L62 HydrophobicContact CZ-CD1 3.91Å; F31-I64 HydrophobicContact CD1-CD1 3.64Å; F31-I64 HydrophobicContact CE1-CD1 3.67Å; F31-V161 HydrophobicContact CB-CG1 3.99Å; F31-F165 HydrophobicContact CB-CD2 4.02Å; F31-F165 HydrophobicContact CB-CE2 3.69Å; F31-F165 HydrophobicContact CB-CZ 4.04Å; F31-F165 AromaticContact CD1-CD1 3.88Å; F31-F165 HydrophobicContact CD1-CD1 3.88Å; F31-F165 HydrophobicContact CD1-CD2 4.2Å; F31-F165 HydrophobicContact CD1-CE1 4.04Å; F31-F165 HydrophobicContact CD1-CE2 4.34Å; F31-F165 AromaticContact CD1-CG 3.96Å; F31-F165 HydrophobicContact CD1-CG 3.96Å; F31-F165 HydrophobicContact CD1-CZ 4.26Å; F31-F165 HydrophobicContact CD2-CB 4Å; F31-F165 AromaticContact CD2-CD2 3.62Å; F31-F165 HydrophobicContact CD2-CD2 3.62Å; F31-F165 HydrophobicContact CD2-CE2 4.2Å; F31-F165 AromaticContact CD2-CG 3.81Å; F31-F165 HydrophobicContact CD2-CG 3.81Å; F31-F165 HydrophobicContact CE1-CB 4.18Å; F31-F165 AromaticContact CE1-CD1 3.91Å; F31-F165 HydrophobicContact CE1-CD1 3.91Å; F31-F165 HydrophobicContact CE1-CE1 4.48Å; F31-F165 AromaticContact CE1-CG 3.99Å; F31-F165 HydrophobicContact CE1-CG 3.99Å; F31-F165 HydrophobicContact CE2-CB 3.56Å; F31-F165 HydrophobicContact CE2-CD2 4.11Å; F31-F165 AromaticContact CE2-CG 3.86Å; F31-F165 HydrophobicContact CE2-CG 3.86Å; F31-F165 HydrophobicContact CG-CB 4.48Å; F31-F165 HydrophobicContact CG-CD1 4.2Å; F31-F165 AromaticContact CG-CD2 3.67Å; F31-F165 HydrophobicContact CG-CD2 3.67Å; F31-F165 HydrophobicContact CG-CE1 4.35Å; F31-F165 AromaticContact CG-CE2 3.83Å; F31-F165 HydrophobicContact CG-CE2 3.83Å; F31-F165 AromaticContact CG-CG 3.86Å; F31-F165 HydrophobicContact CG-CG 3.86Å; F31-F165 HydrophobicContact CG-CZ 4.16Å; F31-F165 HydrophobicContact CZ-CB 3.66Å; F31-F165 HydrophobicContact CZ-CD1 4.27Å; F31-F165 AromaticContact CZ-CG 3.94Å; F31-F165 HydrophobicContact CZ-CG 3.94Å; F31-L166 HydrophobicContact CE2-CD1 4.05Å; F31-L166 HydrophobicContact CZ-CD1 4.45Å
32	T	94.2	Very high	87.7	Confident	41 Å²	41	54.6 Å²	54.6	25%	0.252	29%	0.292	S	S	.	.	H	α-helix	trans	-85.1	-35.4	-173.9	54.3	0	0	0	0	113.7	L28 H29	L28-T32 HydrophobicContact CD1-CG2 3.93Å; L28-T32 PolarHBondContact O-N 3.11Å; L28-T32 PolarHBondContact O-OG1 3.2Å; H29-T32 PolarHBondContact O-N 3.29Å
33	E	91.5	Very high	86.7	Confident	90 Å²	90	55.4 Å²	55.4	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-120.4	-6.9	-170.1	-63.2	178.5	-129.8	0	0	114.1	H29 K35	H29-E33 IonicContact CE1-OE1 3.62Å; H29-E33 IonicContact ND1-OE1 3.89Å; H29-E33 PolarHBondContact ND1-OE1 3.24Å; H29-E33 VanDerWaalsContact ND1-OE1 3.13Å; H29-E33 WeakPolarHBondContact O-CA 3.21Å; H29-E33 WeakPolarHBondContact O-CB 3.38Å; H29-E33 PolarHBondContact O-N 3.28Å; E33-K35 HydrophobicContact CB-CB 4.31Å; E33-K35 HydrophobicContact CB-CD 4.17Å; E33-K35 HydrophobicContact CB-CG 4.13Å; E33-K35 PolarHBondContact O-N 2.74Å; E33-K35 IonicContact OE2-NZ 3.44Å; E33-K35 PolarHBondContact OE2-NZ 2.95Å
34	K	90.6	Very high	85.4	Confident	122 Å²	122	61.9 Å²	61.9	53%	0.53	33%	0.327	S	S	.	.	S	Bend	trans	56.1	36.6	-172.7	-54.8	-67.5	171.7	-173.3	0	112.3	H29 Q30 E162	H29-K34 PolarHBondContact O-N 3.31Å; Q30-K34 WeakPolarHBondContact O-CA 3.29Å; Q30-K34 PolarHBondContact O-N 2.89Å; Q30-K34 VanDerWaalsContact OE1-CA 3.23Å; Q30-K34 PolarHBondContact OE1-O 3.4Å; K34-E162 IonicContact NZ-OE2 3.12Å; K34-E162 PolarHBondContact NZ-OE2 3.46Å
35	K	85.6	Confident	84.3	Confident	117 Å²	117	62.6 Å²	62.6	51%	0.509	34%	0.336	S	S	.	.			trans	-123.1	144.7	179	-66	178.8	-162.7	154.5	0	111.2	H29 Q30 E33	H29-K35 CarbonylContact C-O 3.39Å; Q30-K35 WeakPolarHBondContact CA-O 3.27Å; Q30-K35 PolarHBondContact N-O 3.34Å; Q30-K35 VanDerWaalsContact OE1-N 3.09Å; E33-K35 HydrophobicContact CB-CB 4.31Å; E33-K35 HydrophobicContact CB-CD 4.17Å; E33-K35 HydrophobicContact CB-CG 4.13Å; E33-K35 PolarHBondContact O-N 2.74Å; E33-K35 IonicContact OE2-NZ 3.44Å; E33-K35 PolarHBondContact OE2-NZ 2.95Å
36	F	82.6	Confident	83.8	Confident	82 Å²	82	64 Å²	64	36%	0.36	35%	0.345	S	S	.	.			trans	-116.6	127.9	168.1	177.5	-104.1	0	0	0	109.9	C26 A38 A155 K156	C26-F36 HydrophobicContact CB-CD2 4.2Å; C26-F36 HydrophobicContact CB-CE2 4.09Å; F36-A38 HydrophobicContact CD1-CB 4.49Å; F36-A38 HydrophobicContact CE1-CB 3.76Å; F36-A38 HydrophobicContact CZ-CB 4.43Å; F36-A155 HydrophobicContact CD2-CB 4.36Å; F36-A155 WeakPolarHBondContact CD2-O 3.47Å; F36-A155 HydrophobicContact CE2-CB 4.47Å; F36-K156 HydrophobicContact CD1-CB 4.33Å; F36-K156 HydrophobicContact CD1-CG 3.96Å; F36-K156 HydrophobicContact CD2-CB 4.17Å; F36-K156 HydrophobicContact CE1-CB 4.19Å; F36-K156 HydrophobicContact CE1-CG 3.85Å; F36-K156 HydrophobicContact CE2-CB 4.03Å; F36-K156 HydrophobicContact CG-CB 4.31Å; F36-K156 HydrophobicContact CG-CG 4.38Å; F36-K156 HydrophobicContact CZ-CB 4.04Å; F36-K156 HydrophobicContact CZ-CG 4.18Å
37	M	79.5	Confident	83.4	Confident	105 Å²	105	66.3 Å²	66.3	52%	0.517	35%	0.353	S	S	.	.			trans	-111.5	106.5	174.2	-64.6	-177.8	71.9	0	0	108.6	C40	M37-C40 HydrophobicContact CB-CB 4.19Å
38	A	72.2	Confident	83.1	Confident	76 Å²	76	71 Å²	71	63%	0.628	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-42.2	-178.8	0	0	0	0	0	112	F36 C40	F36-A38 HydrophobicContact CD1-CB 4.49Å; F36-A38 HydrophobicContact CE1-CB 3.76Å; F36-A38 HydrophobicContact CZ-CB 4.43Å; A38-C40 VanDerWaalsContact C-N 3.31Å; A38-C40 PolarHBondContact O-N 3.12Å
39	D	72	Confident	83	Confident	160 Å²	160	71.3 Å²	71.3	86%	0.856	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	39.9	-177.4	-57.9	-41	0	0	0	112.1	P41	D39-P41 WeakPolarHBondContact O-CD 3.1Å
40	C	66.3	Low	83	Confident	36 Å²	36	72.6 Å²	72.6	24%	0.243	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-72.3	123.3	177.1	-165.6	0	0	0	0	109.8	M37 A38	M37-C40 HydrophobicContact CB-CB 4.19Å; A38-C40 VanDerWaalsContact C-N 3.31Å; A38-C40 PolarHBondContact O-N 3.12Å
41	P	75.9	Confident	82.9	Confident	106 Å²	106	74.8 Å²	74.8	69%	0.688	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-60.2	155	174.7	26.4	-33.8	0	0	0	110.5	D39 T43	D39-P41 WeakPolarHBondContact O-CD 3.1Å; P41-T43 PolarHBondContact O-N 3.46Å
42	H	80.6	Confident	82.8	Confident	102 Å²	102	77.2 Å²	77.2	47%	0.472	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-59.3	133	172.6	-64.2	-41.6	0	0	0	110.5	M20 I44	M20-H42 HydrophobicContact CG-CB 4.35Å; M20-H42 HydrophobicContact SD-CB 4.02Å; M20-H42 PolarHBondContact SD-CD2 3.18Å; M20-H42 VanDerWaalsContact SD-CG 3.51Å; H42-I44 PolarHBondContact O-N 3.02Å; H42-I44 VanDerWaalsContact O-N 3.16Å
43	T	74.2	Confident	82.9	Confident	17 Å²	17	75.8 Å²	75.8	10%	0.104	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-57.1	119.2	177.3	-35.1	0	0	0	0	110.4	S25 P41 E47 A68	S25-T43 PolarHBondContact OG-OG1 3.39Å; P41-T43 PolarHBondContact O-N 3.46Å; T43-E47 HydrophobicContact CG2-CG 4.06Å; T43-A68 VanDerWaalsContact O-CB 3.3Å; T43-A68 WeakPolarHBondContact O-CB 3.49Å
44	I	67.4	Low	83.1	Confident	147 Å²	147	77.4 Å²	77.4	75%	0.754	41%	0.406	S	S	*	.	S	Bend	trans	-101.7	88	171.8	-55.8	176.7	0	0	0	106.3	H42 F73	H42-I44 PolarHBondContact O-N 3.02Å; H42-I44 VanDerWaalsContact O-N 3.16Å; I44-F73 HydrophobicContact CG2-CZ 4.21Å
45	G	71.6	Confident	83.2	Confident	23 Å²	23	71.9 Å²	71.9	24%	0.237	38%	0.382	C	S	.	.	S	Bend	trans	115.1	-138.3	-177.7	0	0	0	0	0	113.6	A68	G45-A68 VanDerWaalsContact O-CB 3.28Å; G45-A68 WeakPolarHBondContact O-CB 3.1Å; G45-A68 PolarHBondContact O-N 2.87Å
46	V	81.7	Confident	83.4	Confident	40 Å²	40	71 Å²	71	24%	0.242	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.7	-177.7	179.6	0	0	0	0	110	W65 D66 T67 V76 Y80	V46-W65 HydrophobicContact CG1-CB 4.2Å; V46-W65 HydrophobicContact CG1-CE3 3.73Å; V46-D66 CarbonylContact C-O 3.49Å; V46-D66 VanDerWaalsContact CA-O 3.24Å; V46-D66 WeakPolarHBondContact CA-O 3.29Å; V46-D66 VanDerWaalsContact CG1-O 3.25Å; V46-D66 WeakPolarHBondContact CG1-O 3.39Å; V46-T67 HydrophobicContact CG2-CG2 4.44Å; V46-V76 HydrophobicContact CG2-CG1 4.4Å; V46-Y80 HydrophobicContact CB-CE1 4.29Å; V46-Y80 HydrophobicContact CB-CE2 4.06Å; V46-Y80 HydrophobicContact CG1-CD1 4.09Å; V46-Y80 HydrophobicContact CG1-CE1 3.78Å; V46-Y80 HydrophobicContact CG1-CE2 4.26Å; V46-Y80 HydrophobicContact CG1-CG 4.44Å; V46-Y80 HydrophobicContact CG2-CD2 3.76Å; V46-Y80 HydrophobicContact CG2-CE1 4.36Å; V46-Y80 HydrophobicContact CG2-CE2 3.33Å; V46-Y80 HydrophobicContact CG2-CG 4.43Å
47	E	87.6	Confident	83.8	Confident	72 Å²	72	69.8 Å²	69.8	34%	0.336	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.7	172.8	-70.7	-174.9	-167.9	0	0	110.4	L28 H29 T43 W65 D66	L28-E47 HydrophobicContact CD2-CB 4.42Å; H29-E47 IonicContact CE1-OE2 2.84Å; H29-E47 IonicContact NE2-OE2 2.72Å; H29-E47 PolarHBondContact NE2-OE2 3.01Å; T43-E47 HydrophobicContact CG2-CG 4.06Å; E47-W65 WeakPolarHBondContact O-CA 3.48Å; E47-D66 HydrophobicContact CB-CB 4.25Å; E47-D66 PolarHBondContact N-O 2.71Å; E47-D66 PolarHBondContact O-N 2.88Å
48	F	89.9	Confident	84.4	Confident	100 Å²	100	67.6 Å²	67.6	44%	0.439	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.3	-177.4	176.5	-100.1	0	0	0	110.3	Q63 I64 W65	F48-Q63 HydrophobicContact CE2-CB 3.84Å; F48-Q63 HydrophobicContact CE2-CG 4.05Å; F48-Q63 HydrophobicContact CZ-CB 4.19Å; F48-Q63 HydrophobicContact CZ-CG 3.91Å; F48-I64 WeakPolarHBondContact CA-O 3.28Å; F48-W65 HydrophobicContact CB-CE3 4.29Å; F48-W65 HydrophobicContact CB-CZ3 4.25Å; F48-W65 AromaticContact CD2-CD2 3.83Å; F48-W65 HydrophobicContact CD2-CD2 3.83Å; F48-W65 AromaticContact CD2-CE2 3.75Å; F48-W65 AromaticContact CD2-CE3 3.9Å; F48-W65 HydrophobicContact CD2-CE3 3.9Å; F48-W65 HydrophobicContact CD2-CG 4.49Å; F48-W65 AromaticContact CD2-CH2 3.97Å; F48-W65 HydrophobicContact CD2-CH2 3.97Å; F48-W65 AromaticContact CD2-CZ2 3.85Å; F48-W65 HydrophobicContact CD2-CZ2 3.85Å; F48-W65 AromaticContact CD2-CZ3 3.98Å; F48-W65 HydrophobicContact CD2-CZ3 3.98Å; F48-W65 HydrophobicContact CE2-CD2 4.46Å; F48-W65 AromaticContact CE2-CE2 3.96Å; F48-W65 HydrophobicContact CE2-CH2 4.44Å; F48-W65 AromaticContact CE2-CZ2 3.97Å; F48-W65 HydrophobicContact CE2-CZ2 3.97Å; F48-W65 HydrophobicContact CG-CZ3 4.43Å
49	G	92.1	Very high	85.4	Confident	9 Å²	9	68 Å²	68	9%	0.093	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	155.3	170.8	0	0	0	0	0	111.7	I64	G49-I64 PolarHBondContact N-O 2.93Å; G49-I64 PolarHBondContact O-N 2.88Å
50	T	94.2	Very high	86.6	Confident	62 Å²	62	60.4 Å²	60.4	38%	0.38	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.5	172.7	-168.9	0	0	0	0	111.2	K61 L62	T50-K61 WeakPolarHBondContact OG1-CE 3.48Å; T50-L62 VanDerWaalsContact CA-O 3.24Å; T50-L62 WeakPolarHBondContact CA-O 3.27Å; T50-L62 WeakPolarHBondContact CB-O 3.25Å; T50-L62 PolarHBondContact OG1-O 3.22Å
51	R	95.1	Very high	88	Confident	64 Å²	64	61.1 Å²	61.1	24%	0.242	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	138.6	174.9	-173.3	166.5	172.5	-147.5	-15.3	109.5	F31 I53 L62 E162	F31-R51 HydrophobicContact CD1-CB 4.45Å; F31-R51 VanDerWaalsContact CD2-NH1 3.32Å; F31-R51 HydrophobicContact CE1-CB 3.78Å; F31-R51 HydrophobicContact CE1-CG 4.22Å; F31-R51 HydrophobicContact CZ-CB 4.38Å; F31-R51 HydrophobicContact CZ-CG 4.39Å; F31-R51 WeakPolarHBondContact O-CD 3.24Å; F31-R51 PolarHBondContact O-NH1 3.33Å; R51-I53 HydrophobicContact CG-CG2 4.36Å; R51-L62 PolarHBondContact N-O 2.81Å; R51-L62 PolarHBondContact O-N 2.82Å; R51-E162 IonicContact CZ-OE1 3.99Å; R51-E162 VanDerWaalsContact CZ-OE1 3.23Å; R51-E162 IonicContact CZ-OE2 3.87Å; R51-E162 VanDerWaalsContact NH1-CD 3.32Å; R51-E162 IonicContact NH1-OE1 3.13Å; R51-E162 PolarHBondContact NH1-OE1 3.45Å; R51-E162 VanDerWaalsContact NH1-OE1 3.12Å; R51-E162 IonicContact NH1-OE2 3.91Å; R51-E162 PolarHBondContact NH1-OE2 3.12Å; R51-E162 IonicContact NH2-OE1 3.45Å; R51-E162 PolarHBondContact NH2-OE1 3.02Å; R51-E162 IonicContact NH2-OE2 2.71Å; R51-E162 PolarHBondContact NH2-OE2 3.28Å
52	I	95	Very high	89	Confident	50 Å²	50	56 Å²	56	26%	0.256	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.2	170.4	-62.8	166.7	0	0	0	107.5	Y6 Y8 K59 I60 K61	Y6-I52 HydrophobicContact CD1-CD1 3.98Å; Y8-I52 HydrophobicContact CD1-CD1 3.77Å; Y8-I52 HydrophobicContact CD1-CG1 4.26Å; Y8-I52 HydrophobicContact CE1-CD1 4.43Å; I52-K59 HydrophobicContact CG2-CB 4.18Å; I52-I60 CarbonylContact C-O 3.58Å; I52-I60 WeakPolarHBondContact CA-O 3.44Å; I52-K61 HydrophobicContact CG1-CB 4.06Å; I52-K61 HydrophobicContact CG1-CG 4.18Å
53	I	95.8	Very high	89.7	Confident	11 Å²	11	53.3 Å²	53.3	6%	0.056	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	167.9	174.5	62	168.6	0	0	0	109.9	F31 R51 V55 K59 I60 L62 L166 A169	F31-I53 HydrophobicContact CE2-CG2 4.48Å; F31-I53 HydrophobicContact CZ-CG2 3.78Å; R51-I53 HydrophobicContact CG-CG2 4.36Å; I53-V55 HydrophobicContact CD1-CG2 3.94Å; I53-V55 HydrophobicContact CG1-CG2 4.42Å; I53-K59 CarbonylContact O-C 3.57Å; I53-K59 WeakPolarHBondContact O-CA 3.36Å; I53-I60 HydrophobicContact CG1-CB 4.2Å; I53-I60 PolarHBondContact N-O 2.88Å; I53-I60 PolarHBondContact O-N 3.09Å; I53-L62 HydrophobicContact CD1-CD1 3.74Å; I53-L62 HydrophobicContact CD1-CD2 4.16Å; I53-L62 HydrophobicContact CD1-CG 3.94Å; I53-L62 HydrophobicContact CG1-CD1 4.31Å; I53-L62 HydrophobicContact CG1-CG 4.11Å; I53-L62 HydrophobicContact CG2-CD1 4.49Å; I53-L166 HydrophobicContact CB-CD1 4.46Å; I53-L166 HydrophobicContact CD1-CD1 4.1Å; I53-L166 HydrophobicContact CD1-CG 4.36Å; I53-L166 HydrophobicContact CG2-CD1 4.07Å; I53-A169 HydrophobicContact CD1-CB 3.55Å
54	E	94.6	Very high	90.7	Very high	125 Å²	125	52.5 Å²	52.5	58%	0.584	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.3	175.5	-169.5	171	162.5	0	0	110.2	Q58	E54-Q58 WeakPolarHBondContact CA-O 2.99Å
55	V	94.1	Very high	91.9	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119	179.8	173.4	0	0	0	0	107.6	I53 G57 Q58 I60 A169 K170 Y173	I53-V55 HydrophobicContact CD1-CG2 3.94Å; I53-V55 HydrophobicContact CG1-CG2 4.42Å; V55-G57 PolarHBondContact O-N 3.03Å; V55-Q58 PolarHBondContact N-O 3.25Å; V55-Q58 WeakPolarHBondContact O-CB 3.49Å; V55-Q58 PolarHBondContact O-N 2.99Å; V55-I60 HydrophobicContact CB-CD1 3.78Å; V55-I60 HydrophobicContact CG1-CD1 4.45Å; V55-I60 HydrophobicContact CG2-CD1 4.04Å; V55-A169 HydrophobicContact CG2-CB 3.95Å; V55-K170 HydrophobicContact CG1-CB 4.34Å; V55-K170 HydrophobicContact CG1-CG 3.79Å; V55-K170 HydrophobicContact CG2-CG 4.49Å; V55-Y173 HydrophobicContact CG1-CD1 4.24Å; V55-Y173 HydrophobicContact CG1-CG 4.38Å
56	S	90.1	Very high	92.8	Very high	100 Å²	100	47.5 Å²	47.5	70%	0.699	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	41.3	179.8	-55.6	0	0	0	0	113.5	Q58	S56-Q58 PolarHBondContact O-N 2.92Å
57	G	90.4	Very high	92.9	Very high	55 Å²	55	45.6 Å²	45.6	57%	0.567	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	-2.2	-177.4	0	0	0	0	0	115.1	V55	V55-G57 PolarHBondContact O-N 3.03Å
58	Q	91.7	Very high	92.5	Very high	60 Å²	60	42.3 Å²	42.3	28%	0.28	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.8	175.6	-64.3	-63	-13	0	0	111.1	S9 Y10 E54 V55 S56 I60 Y173	S9-Q58 PolarHBondContact OG-OE1 3.02Å; Y10-Q58 HydrophobicContact CE2-CG 4.36Å; E54-Q58 WeakPolarHBondContact CA-O 2.99Å; V55-Q58 PolarHBondContact N-O 3.25Å; V55-Q58 WeakPolarHBondContact O-CB 3.49Å; V55-Q58 PolarHBondContact O-N 2.99Å; S56-Q58 PolarHBondContact O-N 2.92Å; Q58-I60 HydrophobicContact CB-CG1 4.46Å; Q58-Y173 HydrophobicContact CB-CE2 4.27Å; Q58-Y173 HydrophobicContact CG-CE2 3.78Å; Q58-Y173 VanDerWaalsContact CG-OH 3.3Å; Q58-Y173 WeakPolarHBondContact CG-OH 3.42Å
59	K	94.2	Very high	91.7	Very high	85 Å²	85	38 Å²	38	37%	0.37	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123	170.5	-71.7	-175.8	178.7	-173.1	0	109.9	N7 Y8 S9 Y10 I52 I53	N7-K59 WeakPolarHBondContact O-CD 3.33Å; Y8-K59 WeakPolarHBondContact CA-O 3.43Å; Y8-K59 WeakPolarHBondContact CB-O 3.28Å; S9-K59 PolarHBondContact N-O 3.22Å; Y10-K59 PolarHBondContact N-O 2.99Å; I52-K59 HydrophobicContact CG2-CB 4.18Å; I53-K59 CarbonylContact O-C 3.57Å; I53-K59 WeakPolarHBondContact O-CA 3.36Å
60	I	95.3	Very high	90.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.3	-176.1	-54.3	-178.5	0	0	0	108.4	Y10 F12 I52 I53 V55 Q58 L62 Y173	Y10-I60 HydrophobicContact CD2-CG1 4.47Å; Y10-I60 WeakPolarHBondContact O-CA 3.3Å; F12-I60 HydrophobicContact CB-CG2 4.37Å; F12-I60 HydrophobicContact CD1-CG2 4.06Å; F12-I60 HydrophobicContact CD2-CD1 4.46Å; F12-I60 HydrophobicContact CD2-CG2 3.59Å; F12-I60 HydrophobicContact CE1-CG2 4.21Å; F12-I60 HydrophobicContact CE2-CD1 3.65Å; F12-I60 HydrophobicContact CE2-CG2 3.79Å; F12-I60 HydrophobicContact CG-CG2 3.73Å; F12-I60 HydrophobicContact CZ-CD1 3.77Å; F12-I60 HydrophobicContact CZ-CG2 4.09Å; I52-I60 CarbonylContact C-O 3.58Å; I52-I60 WeakPolarHBondContact CA-O 3.44Å; I53-I60 HydrophobicContact CG1-CB 4.2Å; I53-I60 PolarHBondContact N-O 2.88Å; I53-I60 PolarHBondContact O-N 3.09Å; V55-I60 HydrophobicContact CB-CD1 3.78Å; V55-I60 HydrophobicContact CG1-CD1 4.45Å; V55-I60 HydrophobicContact CG2-CD1 4.04Å; Q58-I60 HydrophobicContact CB-CG1 4.46Å; I60-L62 HydrophobicContact CG2-CD2 4.11Å; I60-Y173 HydrophobicContact CD1-CD2 4.41Å
61	K	95.7	Very high	89	Confident	50 Å²	50	43 Å²	43	22%	0.217	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.6	171.7	-176.4	174.9	-178.3	175.6	0	109.5	Y8 Y10 I11 F12 T50 I52	Y8-K61 HydrophobicContact CD1-CB 4.04Å; Y8-K61 HydrophobicContact CD1-CD 4.24Å; Y8-K61 HydrophobicContact CD2-CB 3.79Å; Y8-K61 HydrophobicContact CE1-CB 4.2Å; Y8-K61 HydrophobicContact CE1-CD 3.6Å; Y8-K61 HydrophobicContact CE1-CG 4.48Å; Y8-K61 HydrophobicContact CE2-CB 3.94Å; Y8-K61 HydrophobicContact CE2-CD 4.09Å; Y8-K61 HydrophobicContact CG-CB 3.84Å; Y8-K61 VanDerWaalsContact CZ-CD 3.48Å; Y10-K61 PolarHBondContact O-N 3.09Å; I11-K61 CarbonylContact C-O 3.6Å; I11-K61 VanDerWaalsContact CA-O 3.27Å; I11-K61 WeakPolarHBondContact CA-O 3.5Å; I11-K61 HydrophobicContact CG1-CB 4.32Å; F12-K61 PolarHBondContact N-O 3.49Å; T50-K61 WeakPolarHBondContact OG1-CE 3.48Å; I52-K61 HydrophobicContact CG1-CB 4.06Å; I52-K61 HydrophobicContact CG1-CG 4.18Å
62	L	96.9	Very high	87.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132	168.4	-58.8	-171.4	0	0	0	109.7	F12 Y14 F31 T50 R51 I53 I60 I64 F165	F12-L62 HydrophobicContact CB-CD2 3.85Å; F12-L62 HydrophobicContact CD2-CD2 4.15Å; F12-L62 HydrophobicContact CG-CD2 4.41Å; Y14-L62 HydrophobicContact CD2-CD1 4.34Å; Y14-L62 HydrophobicContact CE1-CD2 4.1Å; Y14-L62 HydrophobicContact CE2-CD1 3.92Å; Y14-L62 HydrophobicContact CE2-CD2 4.22Å; F31-L62 HydrophobicContact CE1-CD1 3.99Å; F31-L62 HydrophobicContact CZ-CD1 3.91Å; T50-L62 VanDerWaalsContact CA-O 3.24Å; T50-L62 WeakPolarHBondContact CA-O 3.27Å; T50-L62 WeakPolarHBondContact CB-O 3.25Å; T50-L62 PolarHBondContact OG1-O 3.22Å; R51-L62 PolarHBondContact N-O 2.81Å; R51-L62 PolarHBondContact O-N 2.82Å; I53-L62 HydrophobicContact CD1-CD1 3.74Å; I53-L62 HydrophobicContact CD1-CD2 4.16Å; I53-L62 HydrophobicContact CD1-CG 3.94Å; I53-L62 HydrophobicContact CG1-CD1 4.31Å; I53-L62 HydrophobicContact CG1-CG 4.11Å; I53-L62 HydrophobicContact CG2-CD1 4.49Å; I60-L62 HydrophobicContact CG2-CD2 4.11Å; L62-I64 HydrophobicContact CB-CD1 4.2Å; L62-I64 HydrophobicContact CB-CG1 4.08Å; L62-F165 HydrophobicContact CD1-CB 4.17Å; L62-F165 HydrophobicContact CD1-CD1 4.33Å
63	Q	95.4	Very high	86.1	Confident	44 Å²	44	49.3 Å²	49.3	21%	0.206	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	106.8	169.1	-77.6	-170.3	-25.8	0	0	107.8	I11 F12 K13 Y14 F48	I11-Q63 HydrophobicContact CG2-CB 4.44Å; I11-Q63 HydrophobicContact CG2-CG 3.74Å; F12-Q63 PolarHBondContact O-N 2.81Å; K13-Q63 CarbonylContact C-O 3.56Å; K13-Q63 WeakPolarHBondContact CA-O 3.24Å; Y14-Q63 PolarHBondContact N-O 3.48Å; F48-Q63 HydrophobicContact CE2-CB 3.84Å; F48-Q63 HydrophobicContact CE2-CG 4.05Å; F48-Q63 HydrophobicContact CZ-CB 4.19Å; F48-Q63 HydrophobicContact CZ-CG 3.91Å
64	I	95.7	Very high	84.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.2	-168.4	-53.6	156.9	0	0	0	108.4	Y14 I16 L28 F31 F48 G49 L62 F165	Y14-I64 HydrophobicContact CD2-CG1 4.48Å; I16-I64 HydrophobicContact CD1-CG2 3.68Å; I16-I64 HydrophobicContact CG1-CG2 3.71Å; L28-I64 HydrophobicContact CD1-CB 3.81Å; L28-I64 HydrophobicContact CD1-CD1 4.01Å; L28-I64 HydrophobicContact CD1-CG2 3.66Å; F31-I64 HydrophobicContact CD1-CD1 3.64Å; F31-I64 HydrophobicContact CE1-CD1 3.67Å; F48-I64 WeakPolarHBondContact CA-O 3.28Å; G49-I64 PolarHBondContact N-O 2.93Å; G49-I64 PolarHBondContact O-N 2.88Å; L62-I64 HydrophobicContact CB-CD1 4.2Å; L62-I64 HydrophobicContact CB-CG1 4.08Å; I64-F165 HydrophobicContact CD1-CD1 3.82Å; I64-F165 HydrophobicContact CD1-CE1 3.57Å; I64-F165 HydrophobicContact CG1-CD1 4.4Å; I64-F165 HydrophobicContact CG1-CE1 4.12Å; I64-F165 HydrophobicContact CG2-CE1 4.07Å
65	W	93.6	Very high	83.2	Confident	65 Å²	65	49.2 Å²	49.2	25%	0.246	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	104.3	176.4	-59.3	89	0	0	0	108.6	Y14 I15 I16 V46 E47 F48 Y80	Y14-W65 PolarHBondContact O-N 2.92Å; I15-W65 WeakPolarHBondContact CA-O 3.46Å; I15-W65 HydrophobicContact CG2-CB 4.4Å; I16-W65 PolarHBondContact N-O 2.91Å; V46-W65 HydrophobicContact CG1-CB 4.2Å; V46-W65 HydrophobicContact CG1-CE3 3.73Å; E47-W65 WeakPolarHBondContact O-CA 3.48Å; F48-W65 HydrophobicContact CB-CE3 4.29Å; F48-W65 HydrophobicContact CB-CZ3 4.25Å; F48-W65 AromaticContact CD2-CD2 3.83Å; F48-W65 HydrophobicContact CD2-CD2 3.83Å; F48-W65 AromaticContact CD2-CE2 3.75Å; F48-W65 AromaticContact CD2-CE3 3.9Å; F48-W65 HydrophobicContact CD2-CE3 3.9Å; F48-W65 HydrophobicContact CD2-CG 4.49Å; F48-W65 AromaticContact CD2-CH2 3.97Å; F48-W65 HydrophobicContact CD2-CH2 3.97Å; F48-W65 AromaticContact CD2-CZ2 3.85Å; F48-W65 HydrophobicContact CD2-CZ2 3.85Å; F48-W65 AromaticContact CD2-CZ3 3.98Å; F48-W65 HydrophobicContact CD2-CZ3 3.98Å; F48-W65 HydrophobicContact CE2-CD2 4.46Å; F48-W65 AromaticContact CE2-CE2 3.96Å; F48-W65 HydrophobicContact CE2-CH2 4.44Å; F48-W65 AromaticContact CE2-CZ2 3.97Å; F48-W65 HydrophobicContact CE2-CZ2 3.97Å; F48-W65 HydrophobicContact CG-CZ3 4.43Å; W65-Y80 HydrophobicContact CB-CD1 4.26Å; W65-Y80 AromaticContact CD2-CD1 3.75Å; W65-Y80 HydrophobicContact CD2-CD1 3.75Å; W65-Y80 AromaticContact CD2-CE1 3.98Å; W65-Y80 HydrophobicContact CD2-CE1 3.98Å; W65-Y80 AromaticContact CE3-CD1 3.61Å; W65-Y80 HydrophobicContact CE3-CD1 3.61Å; W65-Y80 AromaticContact CE3-CE1 3.35Å; W65-Y80 HydrophobicContact CE3-CE1 3.35Å; W65-Y80 HydrophobicContact CG-CD1 4.07Å; W65-Y80 HydrophobicContact CH2-CE1 4.3Å; W65-Y80 HydrophobicContact CZ3-CD1 4.19Å; W65-Y80 AromaticContact CZ3-CE1 3.55Å; W65-Y80 HydrophobicContact CZ3-CE1 3.55Å
66	D	90.1	Very high	81.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.4	170.5	175.2	41.5	0	0	0	109.4	I16 K24 S25 L28 V46 E47	I16-D66 HydrophobicContact CD1-CB 4.44Å; K24-D66 WeakPolarHBondContact CB-OD1 3.36Å; S25-D66 WeakPolarHBondContact CA-OD2 3.43Å; S25-D66 WeakPolarHBondContact CB-OD2 3.45Å; S25-D66 PolarHBondContact OG-OD2 2.85Å; L28-D66 HydrophobicContact CD2-CB 3.65Å; V46-D66 CarbonylContact C-O 3.49Å; V46-D66 VanDerWaalsContact CA-O 3.24Å; V46-D66 WeakPolarHBondContact CA-O 3.29Å; V46-D66 VanDerWaalsContact CG1-O 3.25Å; V46-D66 WeakPolarHBondContact CG1-O 3.39Å; E47-D66 HydrophobicContact CB-CB 4.25Å; E47-D66 PolarHBondContact N-O 2.71Å; E47-D66 PolarHBondContact O-N 2.88Å
67	T	82.9	Confident	80.8	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.7	-171.6	67.8	0	0	0	0	111.7	I16 K24 V46 G69 T77	I16-T67 PolarHBondContact O-N 2.85Å; I16-T67 PolarHBondContact O-OG1 2.76Å; K24-T67 WeakPolarHBondContact CE-O 3.37Å; V46-T67 HydrophobicContact CG2-CG2 4.44Å; T67-G69 PolarHBondContact O-N 2.88Å; T67-T77 HydrophobicContact CG2-CG2 3.94Å
68	A	79.6	Confident	80.1	Confident	2 Å²	2	51.1 Å²	51.1	2%	0.017	24%	0.238	C	C	.	.			trans	-59.8	129.8	171.8	0	0	0	0	0	111.1	T43 G45 F73	T43-A68 VanDerWaalsContact O-CB 3.3Å; T43-A68 WeakPolarHBondContact O-CB 3.49Å; G45-A68 VanDerWaalsContact O-CB 3.28Å; G45-A68 WeakPolarHBondContact O-CB 3.1Å; G45-A68 PolarHBondContact O-N 2.87Å; A68-F73 HydrophobicContact CB-CB 3.91Å; A68-F73 HydrophobicContact CB-CD2 3.72Å; A68-F73 HydrophobicContact CB-CG 4.14Å
69	G	72.2	Confident	79.6	Confident	11 Å²	11	52 Å²	52	11%	0.113	25%	0.251	C	S	.	.			trans	-87.6	3.4	-179.4	0	0	0	0	0	115.2	G18 M20 T67	G18-G69 WeakPolarHBondContact O-CA 3.2Å; M20-G69 PolarHBondContact N-O 2.97Å; T67-G69 PolarHBondContact O-N 2.88Å
70	Q	72.5	Confident	79.2	Confident	43 Å²	43	50.8 Å²	50.8	20%	0.201	24%	0.244	C	C	.	.	S	Bend	trans	-79.8	140.8	176.8	-69.5	-168.6	38.6	0	0	111	M20 R72 F73 R74	M20-Q70 HydrophobicContact CB-CG 4.42Å; M20-Q70 HydrophobicContact CG-CG 4.33Å; M20-Q70 HydrophobicContact SD-CG 3.36Å; M20-Q70 WeakPolarHBondContact SD-CG 3.33Å; M20-Q70 PolarHBondContact SD-NE2 2.97Å; M20-Q70 VanDerWaalsContact SD-NE2 3.45Å; Q70-R72 VanDerWaalsContact C-N 3.27Å; Q70-R72 PolarHBondContact O-N 2.87Å; Q70-R72 VanDerWaalsContact OE1-NH2 3.13Å; Q70-F73 HydrophobicContact CB-CD2 3.82Å; Q70-F73 HydrophobicContact CB-CE2 4.33Å; Q70-F73 HydrophobicContact CG-CD2 4.48Å; Q70-F73 PolarHBondContact O-N 3.06Å; Q70-R74 PolarHBondContact O-N 3.36Å
71	E	59.1	Low	78.9	Confident	131 Å²	131	51 Å²	51	61%	0.612	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-52.4	-44.9	177.2	-174.3	-78.3	162.1	0	0	112.1	F73 R74	E71-F73 PolarHBondContact O-N 3.21Å; E71-R74 VanDerWaalsContact O-CB 3.28Å; E71-R74 WeakPolarHBondContact O-CB 3.3Å; E71-R74 WeakPolarHBondContact O-CG 3.23Å; E71-R74 PolarHBondContact O-N 2.92Å
72	R	63.7	Low	78.6	Confident	190 Å²	190	56.6 Å²	56.6	72%	0.717	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-60.3	-17.4	179.9	-65.6	-176.3	-67	-177.6	-1.6	114	Q70	Q70-R72 VanDerWaalsContact C-N 3.27Å; Q70-R72 PolarHBondContact O-N 2.87Å; Q70-R72 VanDerWaalsContact OE1-NH2 3.13Å
73	F	65.3	Low	78.1	Confident	58 Å²	58	57.1 Å²	57.1	25%	0.254	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-103.8	-0.2	177	-59.3	-49.6	0	0	0	113.7	I44 A68 Q70 E71 A75 V76 T77	I44-F73 HydrophobicContact CG2-CZ 4.21Å; A68-F73 HydrophobicContact CB-CB 3.91Å; A68-F73 HydrophobicContact CB-CD2 3.72Å; A68-F73 HydrophobicContact CB-CG 4.14Å; Q70-F73 HydrophobicContact CB-CD2 3.82Å; Q70-F73 HydrophobicContact CB-CE2 4.33Å; Q70-F73 HydrophobicContact CG-CD2 4.48Å; Q70-F73 PolarHBondContact O-N 3.06Å; E71-F73 PolarHBondContact O-N 3.21Å; F73-A75 PolarHBondContact O-N 2.81Å; F73-A75 VanDerWaalsContact O-N 3.12Å; F73-V76 WeakPolarHBondContact O-CA 3.25Å; F73-V76 WeakPolarHBondContact O-CB 3.42Å; F73-V76 PolarHBondContact O-N 3.06Å; F73-T77 PolarHBondContact O-N 3.01Å; F73-T77 VanDerWaalsContact O-N 3.11Å; F73-T77 PolarHBondContact O-OG1 3.42Å
74	R	64.3	Low	78.1	Confident	62 Å²	62	55 Å²	55	23%	0.234	26%	0.26	C	S	.	.	H	α-helix	trans	-53.7	-36.4	179.4	-79.7	-179.9	175.4	-178.4	-4.4	112.8	Q70 E71 V76 T77 R78	Q70-R74 PolarHBondContact O-N 3.36Å; E71-R74 VanDerWaalsContact O-CB 3.28Å; E71-R74 WeakPolarHBondContact O-CB 3.3Å; E71-R74 WeakPolarHBondContact O-CG 3.23Å; E71-R74 PolarHBondContact O-N 2.92Å; R74-V76 VanDerWaalsContact C-N 3.3Å; R74-V76 PolarHBondContact O-N 3.2Å; R74-T77 WeakPolarHBondContact O-CB 3.28Å; R74-T77 PolarHBondContact O-N 3.45Å; R74-R78 WeakPolarHBondContact O-CG 3.25Å; R74-R78 PolarHBondContact O-N 3.15Å
75	A	64.3	Low	78	Confident	72 Å²	72	55.2 Å²	55.2	60%	0.595	26%	0.262	S	S	*	.	H	α-helix	trans	-60.3	-38.6	176.2	0	0	0	0	0	112.8	F73	F73-A75 PolarHBondContact O-N 2.81Å; F73-A75 VanDerWaalsContact O-N 3.12Å
76	V	62.5	Low	78.2	Confident	70 Å²	70	52.1 Å²	52.1	42%	0.424	25%	0.25	S	C	.	.	H	α-helix	trans	-67.8	-44.7	175	-179.3	0	0	0	0	109.6	V46 F73 R74 R78 S79 Y80	V46-V76 HydrophobicContact CG2-CG1 4.4Å; F73-V76 WeakPolarHBondContact O-CA 3.25Å; F73-V76 WeakPolarHBondContact O-CB 3.42Å; F73-V76 PolarHBondContact O-N 3.06Å; R74-V76 VanDerWaalsContact C-N 3.3Å; R74-V76 PolarHBondContact O-N 3.2Å; V76-R78 VanDerWaalsContact C-N 3.28Å; V76-R78 PolarHBondContact O-N 3.48Å; V76-S79 PolarHBondContact O-N 3.2Å; V76-S79 PolarHBondContact O-OG 2.96Å; V76-Y80 HydrophobicContact CG1-CE2 4.06Å; V76-Y80 VanDerWaalsContact O-CD2 3.31Å; V76-Y80 WeakPolarHBondContact O-CD2 3.42Å
77	T	71.1	Confident	78.5	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-55.7	-39.6	177.1	-48.8	0	0	0	0	112.4	T67 F73 R74 S79 Y80 Y81	T67-T77 HydrophobicContact CG2-CG2 3.94Å; F73-T77 PolarHBondContact O-N 3.01Å; F73-T77 VanDerWaalsContact O-N 3.11Å; F73-T77 PolarHBondContact O-OG1 3.42Å; R74-T77 WeakPolarHBondContact O-CB 3.28Å; R74-T77 PolarHBondContact O-N 3.45Å; T77-S79 PolarHBondContact O-N 2.89Å; T77-S79 VanDerWaalsContact O-N 3.12Å; T77-Y80 PolarHBondContact O-N 3.25Å; T77-Y81 HydrophobicContact CG2-CD2 4.29Å; T77-Y81 HydrophobicContact CG2-CE2 3.58Å; T77-Y81 VanDerWaalsContact O-CD2 3.24Å; T77-Y81 WeakPolarHBondContact O-CD2 3.33Å
78	R	76.6	Confident	79.2	Confident	125 Å²	125	52 Å²	52	47%	0.472	25%	0.25	S	C	.	.	H	α-helix	trans	-52.1	-37.5	179.9	-71.7	-164.7	174.9	110.8	2.6	113.6	R74 V76 Y80 Y81 L112	R74-R78 WeakPolarHBondContact O-CG 3.25Å; R74-R78 PolarHBondContact O-N 3.15Å; V76-R78 VanDerWaalsContact C-N 3.28Å; V76-R78 PolarHBondContact O-N 3.48Å; R78-Y80 VanDerWaalsContact C-N 3.26Å; R78-Y80 PolarHBondContact O-N 3Å; R78-Y81 PolarHBondContact O-N 3.1Å; R78-L112 HydrophobicContact CB-CD1 4.21Å; R78-L112 HydrophobicContact CG-CD1 3.71Å
79	S	81.4	Confident	80.1	Confident	79 Å²	79	52 Å²	52	55%	0.552	25%	0.249	S	C	*	.	H	α-helix	trans	-66.4	-26.9	-179.8	69.3	0	0	0	0	113.5	V76 T77	V76-S79 PolarHBondContact O-N 3.2Å; V76-S79 PolarHBondContact O-OG 2.96Å; T77-S79 PolarHBondContact O-N 2.89Å; T77-S79 VanDerWaalsContact O-N 3.12Å
80	Y	85.9	Confident	81.3	Confident	59 Å²	59	51.5 Å²	51.5	23%	0.231	24%	0.244	C	C	.	.	H	α-helix	trans	-84.4	-22.8	-177.2	-67.6	-85.5	0	0	0	113.3	K13 I15 V46 W65 V76 T77 R78 R82	K13-Y80 WeakPolarHBondContact CE-O 2.87Å; K13-Y80 PolarHBondContact NZ-O 2.81Å; I15-Y80 WeakPolarHBondContact CG2-O 3.43Å; V46-Y80 HydrophobicContact CB-CE1 4.29Å; V46-Y80 HydrophobicContact CB-CE2 4.06Å; V46-Y80 HydrophobicContact CG1-CD1 4.09Å; V46-Y80 HydrophobicContact CG1-CE1 3.78Å; V46-Y80 HydrophobicContact CG1-CE2 4.26Å; V46-Y80 HydrophobicContact CG1-CG 4.44Å; V46-Y80 HydrophobicContact CG2-CD2 3.76Å; V46-Y80 HydrophobicContact CG2-CE1 4.36Å; V46-Y80 HydrophobicContact CG2-CE2 3.33Å; V46-Y80 HydrophobicContact CG2-CG 4.43Å; W65-Y80 HydrophobicContact CB-CD1 4.26Å; W65-Y80 AromaticContact CD2-CD1 3.75Å; W65-Y80 HydrophobicContact CD2-CD1 3.75Å; W65-Y80 AromaticContact CD2-CE1 3.98Å; W65-Y80 HydrophobicContact CD2-CE1 3.98Å; W65-Y80 AromaticContact CE3-CD1 3.61Å; W65-Y80 HydrophobicContact CE3-CD1 3.61Å; W65-Y80 AromaticContact CE3-CE1 3.35Å; W65-Y80 HydrophobicContact CE3-CE1 3.35Å; W65-Y80 HydrophobicContact CG-CD1 4.07Å; W65-Y80 HydrophobicContact CH2-CE1 4.3Å; W65-Y80 HydrophobicContact CZ3-CD1 4.19Å; W65-Y80 AromaticContact CZ3-CE1 3.55Å; W65-Y80 HydrophobicContact CZ3-CE1 3.55Å; V76-Y80 HydrophobicContact CG1-CE2 4.06Å; V76-Y80 VanDerWaalsContact O-CD2 3.31Å; V76-Y80 WeakPolarHBondContact O-CD2 3.42Å; T77-Y80 PolarHBondContact O-N 3.25Å; R78-Y80 VanDerWaalsContact C-N 3.26Å; R78-Y80 PolarHBondContact O-N 3Å; Y80-R82 VanDerWaalsContact C-N 3.28Å; Y80-R82 PolarHBondContact O-N 3.12Å
81	Y	88.9	Confident	82.6	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-38.1	175.4	-76.1	-89.9	0	0	0	112.6	I15 I17 T77 R78 G83 A84 A109 L112 T113	I15-Y81 HydrophobicContact CD1-CD1 3.25Å; I15-Y81 HydrophobicContact CD1-CE1 3.63Å; I15-Y81 HydrophobicContact CD1-CG 3.86Å; I17-Y81 HydrophobicContact CD1-CE1 4.02Å; I17-Y81 HydrophobicContact CG2-CE1 4.03Å; T77-Y81 HydrophobicContact CG2-CD2 4.29Å; T77-Y81 HydrophobicContact CG2-CE2 3.58Å; T77-Y81 VanDerWaalsContact O-CD2 3.24Å; T77-Y81 WeakPolarHBondContact O-CD2 3.33Å; R78-Y81 PolarHBondContact O-N 3.1Å; Y81-G83 PolarHBondContact O-N 3.26Å; Y81-A84 WeakPolarHBondContact O-CB 3.5Å; Y81-A84 PolarHBondContact O-N 3.24Å; Y81-A109 HydrophobicContact CE1-CB 3.99Å; Y81-L112 CarbonylContact C-O 3.48Å; Y81-L112 VanDerWaalsContact CB-CB 3.47Å; Y81-L112 HydrophobicContact CD1-CB 4.15Å; Y81-L112 HydrophobicContact CD2-CB 4.29Å; Y81-L112 HydrophobicContact CD2-CD1 3.82Å; Y81-L112 HydrophobicContact CE2-CD1 4.08Å; Y81-L112 HydrophobicContact CG-CB 3.74Å; Y81-L112 HydrophobicContact CG-CD1 4.11Å; Y81-T113 HydrophobicContact CD1-CG2 3.66Å; Y81-T113 HydrophobicContact CG-CG2 4.35Å
82	R	87.5	Confident	84.4	Confident	168 Å²	168	43.2 Å²	43.2	63%	0.634	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	125.1	-176.7	-172.7	176.2	-174	167.7	3.4	110.8	K13 Y80 A84 E187	K13-R82 PolarHBondContact NZ-O 2.9Å; Y80-R82 VanDerWaalsContact C-N 3.28Å; Y80-R82 PolarHBondContact O-N 3.12Å; R82-A84 VanDerWaalsContact C-N 3.31Å; R82-A84 PolarHBondContact O-N 2.74Å; R82-E187 IonicContact CZ-OE1 3.49Å; R82-E187 IonicContact NE-OE1 3.48Å; R82-E187 PolarHBondContact NE-OE1 3.01Å; R82-E187 IonicContact NH2-OE1 2.73Å; R82-E187 PolarHBondContact NH2-OE1 3.12Å
83	G	88.3	Confident	86.1	Confident	11 Å²	11	34.2 Å²	34.2	11%	0.113	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	24.4	179.1	0	0	0	0	0	114.1	K13 Y81 G189	K13-G83 WeakPolarHBondContact CD-O 3.41Å; Y81-G83 PolarHBondContact O-N 3.26Å; G83-G189 WeakPolarHBondContact O-CA 3.3Å
84	A	93.4	Very high	87.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.			trans	-75	128	166.5	0	0	0	0	0	110.1	I15 Y81 R82 T113 T117	I15-A84 HydrophobicContact CD1-CB 4.07Å; I15-A84 HydrophobicContact CG1-CB 4.11Å; I15-A84 HydrophobicContact CG2-CB 3.94Å; Y81-A84 WeakPolarHBondContact O-CB 3.5Å; Y81-A84 PolarHBondContact O-N 3.24Å; R82-A84 VanDerWaalsContact C-N 3.31Å; R82-A84 PolarHBondContact O-N 2.74Å; A84-T113 HydrophobicContact CB-CG2 4.16Å; A84-T117 PolarHBondContact O-OG1 3.48Å
85	A	95.2	Very high	89.3	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.033	17%	0.17	C	C	.	.	S	Bend	trans	-82.5	-31.1	170.7	0	0	0	0	0	111.6	F12 K13 V118 I172 V190	F12-A85 HydrophobicContact CB-CB 4.47Å; K13-A85 PolarHBondContact O-N 2.98Å; A85-V118 PolarHBondContact O-N 3.29Å; A85-I172 HydrophobicContact CB-CD1 4.02Å; A85-I172 HydrophobicContact CB-CG2 4.35Å; A85-I172 WeakPolarHBondContact O-CD1 3.42Å; A85-V190 HydrophobicContact CB-CG2 3.9Å
86	G	96.9	Very high	90.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.7	176.7	0	0	0	0	0	112.4	K13 Y14 I15 V118	K13-G86 PolarHBondContact O-N 3.16Å; Y14-G86 VanDerWaalsContact CA-O 3.29Å; Y14-G86 WeakPolarHBondContact CA-O 3.37Å; I15-G86 PolarHBondContact N-O 3.05Å; G86-V118 CarbonylContact C-O 3.59Å; G86-V118 VanDerWaalsContact CA-O 3.23Å; G86-V118 WeakPolarHBondContact CA-O 3.35Å
87	A	96.7	Very high	92.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.2	171.1	0	0	0	0	0	110.3	I15 T117 V118 I119 I120	I15-A87 HydrophobicContact CD1-CB 4.05Å; I15-A87 HydrophobicContact CG1-CB 3.76Å; I15-A87 WeakPolarHBondContact O-CA 3.41Å; A87-T117 HydrophobicContact CB-CG2 4.27Å; A87-V118 PolarHBondContact N-O 3.04Å; A87-I119 HydrophobicContact CB-CG1 4.24Å; A87-I119 HydrophobicContact CB-CG2 4.46Å; A87-I119 WeakPolarHBondContact O-CA 3.31Å; A87-I120 PolarHBondContact O-N 2.7Å
88	L	98.2	Very high	93.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	102.9	174.3	-76.1	72.6	0	0	0	107.6	Y14 I15 I16 I17 I120 I122 F165	Y14-L88 HydrophobicContact CD2-CD1 3.38Å; Y14-L88 HydrophobicContact CE2-CD1 3.9Å; Y14-L88 HydrophobicContact CG-CD1 3.99Å; I15-L88 PolarHBondContact O-N 2.99Å; I16-L88 WeakPolarHBondContact CA-O 3.24Å; I16-L88 HydrophobicContact CB-CB 4.46Å; I16-L88 HydrophobicContact CG1-CB 4.32Å; I16-L88 HydrophobicContact CG2-CB 4.1Å; I17-L88 PolarHBondContact N-O 2.91Å; L88-I120 HydrophobicContact CB-CG2 4.29Å; L88-I120 HydrophobicContact CD1-CG2 4.25Å; L88-I120 HydrophobicContact CG-CG2 3.71Å; L88-I122 HydrophobicContact CB-CD1 3.96Å; L88-I122 HydrophobicContact CD2-CD1 3.79Å; L88-I122 HydrophobicContact CG-CD1 3.91Å; L88-F165 HydrophobicContact CD2-CD1 3.76Å; L88-F165 HydrophobicContact CD2-CD2 4.09Å; L88-F165 HydrophobicContact CD2-CE1 3.37Å; L88-F165 HydrophobicContact CD2-CE2 3.77Å; L88-F165 HydrophobicContact CD2-CG 4.1Å; L88-F165 HydrophobicContact CD2-CZ 3.4Å
89	M	97.5	Very high	94.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.6	179.1	-174.3	167.8	68.6	0	0	109.2	I17 L102 W105 L106 I119 I120 L121 I122 F142 L148	I17-M89 HydrophobicContact CD1-CB 4.32Å; I17-M89 HydrophobicContact CD1-CG 4.35Å; I17-M89 HydrophobicContact CG1-CB 4.05Å; I17-M89 HydrophobicContact CG1-CG 4.2Å; M89-L102 HydrophobicContact CE-CB 4.46Å; M89-L102 HydrophobicContact CE-CD2 4.05Å; M89-L102 HydrophobicContact CG-CD2 3.68Å; M89-L102 HydrophobicContact SD-CD2 4Å; M89-W105 HydrophobicContact CG-CB 4.24Å; M89-W105 HydrophobicContact SD-CB 3.79Å; M89-L106 HydrophobicContact CE-CB 4.16Å; M89-L106 HydrophobicContact CE-CD1 4.42Å; M89-L106 HydrophobicContact SD-CB 4Å; M89-I119 HydrophobicContact CB-CG2 4.38Å; M89-I120 PolarHBondContact N-O 3.45Å; M89-L121 HydrophobicContact CE-CD1 3.93Å; M89-L121 HydrophobicContact CG-CD1 4.42Å; M89-L121 CarbonylContact O-C 3.59Å; M89-L121 WeakPolarHBondContact O-CA 3.35Å; M89-I122 PolarHBondContact O-N 3.01Å; M89-F142 HydrophobicContact CE-CE1 4.04Å; M89-L148 HydrophobicContact CE-CD1 3.64Å
90	V	98.3	Very high	95.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	-168.4	-169.3	0	0	0	0	110.9	I16 I17 V22 K24 L27 I122 N124	I16-V90 HydrophobicContact CG2-CG2 3.66Å; I17-V90 PolarHBondContact O-N 3.04Å; V22-V90 HydrophobicContact CB-CG1 4.23Å; V22-V90 HydrophobicContact CG2-CB 3.89Å; V22-V90 HydrophobicContact CG2-CG1 3.78Å; K24-V90 HydrophobicContact CG-CB 4.22Å; K24-V90 HydrophobicContact CG-CG2 4.27Å; L27-V90 HydrophobicContact CD1-CG1 3.8Å; L27-V90 HydrophobicContact CD1-CG2 3.87Å; V90-I122 WeakPolarHBondContact CA-O 3.4Å; V90-I122 HydrophobicContact CG2-CB 4.37Å; V90-I122 HydrophobicContact CG2-CD1 4.41Å; V90-N124 HydrophobicContact CG1-CB 3.75Å
91	Y	98.4	Very high	96.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	169	165.2	74	-78.6	0	0	0	110.6	I93 Y99 L102 L121 I122 N124 V134 A139 F150	Y91-I93 HydrophobicContact CE2-CB 4.5Å; Y91-I93 HydrophobicContact CE2-CG2 3.9Å; Y91-Y99 HydrophobicContact CD2-CD2 4.47Å; Y91-Y99 HydrophobicContact CE2-CD2 4.48Å; Y91-L102 HydrophobicContact CD1-CD1 3.97Å; Y91-L102 HydrophobicContact CD1-CD2 4.42Å; Y91-L102 HydrophobicContact CG-CD1 4.21Å; Y91-L121 HydrophobicContact CD1-CD1 3.65Å; Y91-L121 HydrophobicContact CD1-CG 4.26Å; Y91-L121 HydrophobicContact CE1-CD1 3.94Å; Y91-L121 HydrophobicContact CE1-CD2 4.33Å; Y91-L121 HydrophobicContact CE1-CG 4.03Å; Y91-I122 WeakPolarHBondContact CD1-O 3.38Å; Y91-I122 PolarHBondContact N-O 3.35Å; Y91-N124 PolarHBondContact O-N 3.29Å; Y91-V134 HydrophobicContact CD2-CG1 4.43Å; Y91-V134 HydrophobicContact CD2-CG2 4.26Å; Y91-V134 HydrophobicContact CE2-CB 3.85Å; Y91-V134 HydrophobicContact CE2-CG1 3.64Å; Y91-V134 HydrophobicContact CE2-CG2 4.09Å; Y91-A139 HydrophobicContact CE1-CB 4.13Å; Y91-A139 WeakPolarHBondContact OH-CB 3.5Å; Y91-F150 HydrophobicContact CE1-CE2 4.25Å
92	D	98.4	Very high	96.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121	176.4	178.9	-9.6	0	0	0	109.2	V22 T94 R95 T98 K125	V22-D92 HydrophobicContact CB-CB 4.25Å; V22-D92 HydrophobicContact CG1-CB 4.1Å; D92-T94 PolarHBondContact O-N 2.98Å; D92-T94 VanDerWaalsContact O-N 3.12Å; D92-T94 PolarHBondContact OD1-N 2.89Å; D92-T94 PolarHBondContact OD1-OG1 3.46Å; D92-T94 VanDerWaalsContact OD1-OG1 3.13Å; D92-R95 HydrophobicContact CB-CB 4.11Å; D92-R95 PolarHBondContact O-N 3.27Å; D92-R95 WeakPolarHBondContact OD2-CD 3.49Å; D92-T98 HydrophobicContact CB-CG2 4.41Å; D92-T98 PolarHBondContact N-OG1 2.9Å; D92-T98 PolarHBondContact O-OG1 2.88Å; D92-K125 WeakPolarHBondContact OD1-CD 3.42Å; D92-K125 WeakPolarHBondContact OD2-CD 3.46Å; D92-K125 WeakPolarHBondContact OD2-CE 3.24Å; D92-K125 IonicContact OD2-NZ 2.7Å; D92-K125 PolarHBondContact OD2-NZ 3.45Å
93	I	98.7	Very high	97	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21	-177.1	67.4	156.3	0	0	0	113	Y91 N124 K125 R132 D133 V134	Y91-I93 HydrophobicContact CE2-CB 4.5Å; Y91-I93 HydrophobicContact CE2-CG2 3.9Å; I93-N124 PolarHBondContact N-O 2.84Å; I93-N124 VanDerWaalsContact N-O 3.08Å; I93-K125 WeakPolarHBondContact CD1-O 3.34Å; I93-K125 WeakPolarHBondContact CG1-O 3.38Å; I93-R132 HydrophobicContact CD1-CB 4.49Å; I93-D133 PolarHBondContact O-N 3.49Å; I93-V134 PolarHBondContact O-N 2.91Å
94	T	98.4	Very high	97.3	Very high	27 Å²	27	26.7 Å²	26.7	17%	0.166	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.7	179.9	83	0	0	0	0	112.7	D92 L128 Q131	D92-T94 PolarHBondContact O-N 2.98Å; D92-T94 VanDerWaalsContact O-N 3.12Å; D92-T94 PolarHBondContact OD1-N 2.89Å; D92-T94 PolarHBondContact OD1-OG1 3.46Å; D92-T94 VanDerWaalsContact OD1-OG1 3.13Å; T94-L128 HydrophobicContact CG2-CB 3.56Å; T94-L128 HydrophobicContact CG2-CD1 3.95Å; T94-L128 HydrophobicContact CG2-CG 4.41Å; T94-Q131 WeakPolarHBondContact CA-O 3.29Å; T94-Q131 VanDerWaalsContact CB-O 3.24Å; T94-Q131 WeakPolarHBondContact CB-O 3.31Å; T94-Q131 HydrophobicContact CG2-CB 3.84Å
95	R	98.2	Very high	97.3	Very high	81 Å²	81	26.8 Å²	26.8	31%	0.306	14%	0.143	S	C	.	.			trans	-136.1	94.7	-176	-74.4	174.2	40.4	-163.7	-3.5	111.9	M20 D92 S97 T98	M20-R95 PolarHBondContact O-NH1 2.99Å; M20-R95 VanDerWaalsContact O-NH1 3.09Å; M20-R95 PolarHBondContact O-NH2 3.3Å; M20-R95 VanDerWaalsContact O-NH2 3.1Å; D92-R95 HydrophobicContact CB-CB 4.11Å; D92-R95 PolarHBondContact O-N 3.27Å; D92-R95 WeakPolarHBondContact OD2-CD 3.49Å; R95-S97 PolarHBondContact O-N 3.24Å; R95-S97 VanDerWaalsContact O-N 3.09Å; R95-T98 HydrophobicContact CB-CG2 3.9Å; R95-T98 PolarHBondContact O-N 2.91Å; R95-T98 PolarHBondContact O-OG1 3.27Å
96	R	98.4	Very high	97.3	Very high	57 Å²	57	26.9 Å²	26.9	22%	0.215	14%	0.143	C	C	.	.	H	α-helix	trans	-46.1	-41	175.2	-177.8	52.6	46.2	177.2	21	115.1	T98 Y99 N100 D133 E138	R96-T98 PolarHBondContact O-N 2.83Å; R96-Y99 WeakPolarHBondContact O-CB 3.3Å; R96-Y99 PolarHBondContact O-N 2.92Å; R96-Y99 VanDerWaalsContact O-N 3.14Å; R96-N100 WeakPolarHBondContact CD-OD1 3.22Å; R96-N100 PolarHBondContact O-N 3.49Å; R96-N100 PolarHBondContact O-OD1 3.31Å; R96-D133 WeakPolarHBondContact CB-OD2 3.28Å; R96-D133 PolarHBondContact N-OD2 2.88Å; R96-D133 IonicContact NE-OD1 2.98Å; R96-D133 PolarHBondContact NH2-O 3.42Å; R96-E138 IonicContact CZ-OE1 3.65Å; R96-E138 IonicContact CZ-OE2 3.35Å; R96-E138 IonicContact NH1-OE1 3.99Å; R96-E138 PolarHBondContact NH1-OE1 3.43Å; R96-E138 IonicContact NH1-OE2 3.52Å; R96-E138 PolarHBondContact NH1-OE2 3.18Å; R96-E138 IonicContact NH2-OE1 3.75Å; R96-E138 PolarHBondContact NH2-OE1 3.03Å; R96-E138 IonicContact NH2-OE2 2.75Å; R96-E138 PolarHBondContact NH2-OE2 3.08Å
97	S	97.8	Very high	97.2	Very high	59 Å²	59	30.4 Å²	30.4	41%	0.413	16%	0.164	S	C	.	.	H	α-helix	trans	-59.2	-35.3	-178.4	54.6	0	0	0	0	112.8	R95 Y99 N100 H101	R95-S97 PolarHBondContact O-N 3.24Å; R95-S97 VanDerWaalsContact O-N 3.09Å; S97-Y99 VanDerWaalsContact C-N 3.35Å; S97-N100 PolarHBondContact O-N 2.85Å; S97-H101 VanDerWaalsContact O-CG 3.23Å; S97-H101 PolarHBondContact O-N 3.44Å; S97-H101 PolarHBondContact O-ND1 3.47Å
98	T	97.4	Very high	97	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-70.7	-34	179.3	68.6	0	0	0	0	112.3	D19 V22 D92 R95 R96	D19-T98 HydrophobicContact CB-CG2 3.9Å; V22-T98 HydrophobicContact CG1-CG2 3.71Å; D92-T98 HydrophobicContact CB-CG2 4.41Å; D92-T98 PolarHBondContact N-OG1 2.9Å; D92-T98 PolarHBondContact O-OG1 2.88Å; R95-T98 HydrophobicContact CB-CG2 3.9Å; R95-T98 PolarHBondContact O-N 2.91Å; R95-T98 PolarHBondContact O-OG1 3.27Å; R96-T98 PolarHBondContact O-N 2.83Å
99	Y	98.5	Very high	96.8	Very high	35 Å²	35	31.7 Å²	31.7	14%	0.137	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-45.9	171.2	172.5	-94.9	0	0	0	111.3	Y91 R96 S97 H101 L102 V134 E138 A139 F142	Y91-Y99 HydrophobicContact CD2-CD2 4.47Å; Y91-Y99 HydrophobicContact CE2-CD2 4.48Å; R96-Y99 WeakPolarHBondContact O-CB 3.3Å; R96-Y99 PolarHBondContact O-N 2.92Å; R96-Y99 VanDerWaalsContact O-N 3.14Å; S97-Y99 VanDerWaalsContact C-N 3.35Å; Y99-H101 PolarHBondContact O-N 3.16Å; Y99-H101 VanDerWaalsContact O-N 3.13Å; Y99-L102 HydrophobicContact CD2-CD1 3.48Å; Y99-L102 VanDerWaalsContact CD2-CD1 3.48Å; Y99-L102 HydrophobicContact CE2-CD1 3.95Å; Y99-L102 HydrophobicContact CG-CD1 4.2Å; Y99-L102 WeakPolarHBondContact O-CB 3.32Å; Y99-L102 WeakPolarHBondContact O-CG 3.13Å; Y99-L102 PolarHBondContact O-N 2.55Å; Y99-V134 HydrophobicContact CD2-CG1 3.71Å; Y99-V134 HydrophobicContact CE2-CG1 4.21Å; Y99-V134 HydrophobicContact CG-CG1 3.95Å; Y99-V134 HydrophobicContact CG-CG2 4.23Å; Y99-E138 PolarHBondContact OH-O 3.2Å; Y99-A139 HydrophobicContact CD2-CB 4.49Å; Y99-A139 HydrophobicContact CE2-CB 4.09Å; Y99-F142 HydrophobicContact CE2-CB 4.39Å
100	N	98.1	Very high	96.7	Very high	97 Å²	97	37.4 Å²	37.4	52%	0.519	19%	0.193	S	C	.	.	H	α-helix	trans	-60.9	-26.5	179.4	-67	-9	0	0	0	112.9	R96 S97	R96-N100 WeakPolarHBondContact CD-OD1 3.22Å; R96-N100 PolarHBondContact O-N 3.49Å; R96-N100 PolarHBondContact O-OD1 3.31Å; S97-N100 PolarHBondContact O-N 2.85Å
101	H	96.3	Very high	96.4	Very high	83 Å²	83	43 Å²	43	38%	0.384	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.7	176.6	-61.2	156.1	0	0	0	114.1	D19 S97 Y99 S103 S104 W105	D19-H101 IonicContact OD1-CG 3.18Å; D19-H101 IonicContact OD1-ND1 2.7Å; D19-H101 IonicContact OD2-CE1 3.35Å; D19-H101 IonicContact OD2-CG 2.64Å; D19-H101 IonicContact OD2-ND1 3.39Å; D19-H101 PolarHBondContact OD2-ND1 2.89Å; S97-H101 VanDerWaalsContact O-CG 3.23Å; S97-H101 PolarHBondContact O-N 3.44Å; S97-H101 PolarHBondContact O-ND1 3.47Å; Y99-H101 PolarHBondContact O-N 3.16Å; Y99-H101 VanDerWaalsContact O-N 3.13Å; H101-S103 VanDerWaalsContact C-N 3.27Å; H101-S103 PolarHBondContact O-N 3.33Å; H101-S104 WeakPolarHBondContact O-CB 3.43Å; H101-S104 PolarHBondContact O-N 3.27Å; H101-W105 VanDerWaalsContact O-CD1 3.25Å; H101-W105 PolarHBondContact O-N 3.39Å
102	L	97.1	Very high	96.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.6	-39.1	-178.7	-73.1	173	0	0	0	112.7	M89 Y91 Y99 S104 W105 L106 L121 F142	M89-L102 HydrophobicContact CE-CB 4.46Å; M89-L102 HydrophobicContact CE-CD2 4.05Å; M89-L102 HydrophobicContact CG-CD2 3.68Å; M89-L102 HydrophobicContact SD-CD2 4Å; Y91-L102 HydrophobicContact CD1-CD1 3.97Å; Y91-L102 HydrophobicContact CD1-CD2 4.42Å; Y91-L102 HydrophobicContact CG-CD1 4.21Å; Y99-L102 HydrophobicContact CD2-CD1 3.48Å; Y99-L102 VanDerWaalsContact CD2-CD1 3.48Å; Y99-L102 HydrophobicContact CE2-CD1 3.95Å; Y99-L102 HydrophobicContact CG-CD1 4.2Å; Y99-L102 WeakPolarHBondContact O-CB 3.32Å; Y99-L102 WeakPolarHBondContact O-CG 3.13Å; Y99-L102 PolarHBondContact O-N 2.55Å; L102-S104 VanDerWaalsContact C-N 3.27Å; L102-S104 PolarHBondContact O-N 2.85Å; L102-W105 PolarHBondContact O-N 2.81Å; L102-W105 VanDerWaalsContact O-N 3.15Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.07Å; L102-L106 PolarHBondContact O-N 3.34Å; L102-L121 HydrophobicContact CD1-CD1 3.7Å; L102-L121 HydrophobicContact CD1-CD2 4.26Å; L102-L121 HydrophobicContact CD2-CD1 3.58Å; L102-L121 HydrophobicContact CG-CD1 4.28Å; L102-F142 HydrophobicContact CB-CE1 4.03Å; L102-F142 HydrophobicContact CB-CZ 3.86Å; L102-F142 HydrophobicContact CD1-CD1 4.45Å; L102-F142 HydrophobicContact CD1-CE1 4.31Å
103	S	96.5	Very high	95.8	Very high	66 Å²	66	46.5 Å²	46.5	46%	0.462	24%	0.242	S	C	.	.	H	α-helix	trans	-58.5	-40.3	177.1	-57.9	0	0	0	0	112	H101 L106 T107	H101-S103 VanDerWaalsContact C-N 3.27Å; H101-S103 PolarHBondContact O-N 3.33Å; S103-L106 PolarHBondContact O-N 3.09Å; S103-T107 PolarHBondContact O-N 3.17Å; S103-T107 PolarHBondContact O-OG1 2.87Å
104	S	94	Very high	95.3	Very high	48 Å²	48	47.4 Å²	47.4	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-66.1	-44.2	176.2	-177.1	0	0	0	0	111.4	H101 L102 L106 T107 D108	H101-S104 WeakPolarHBondContact O-CB 3.43Å; H101-S104 PolarHBondContact O-N 3.27Å; L102-S104 VanDerWaalsContact C-N 3.27Å; L102-S104 PolarHBondContact O-N 2.85Å; S104-L106 VanDerWaalsContact C-N 3.32Å; S104-L106 PolarHBondContact O-N 3.43Å; S104-T107 PolarHBondContact O-N 2.98Å; S104-D108 PolarHBondContact O-N 3.39Å; S104-D108 VanDerWaalsContact O-N 3.08Å
105	W	94	Very high	94.8	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-37.7	177.9	-72.4	113	0	0	0	112.2	I17 G18 D19 M89 H101 L102 D108 A109	I17-W105 HydrophobicContact CB-CE3 4.03Å; I17-W105 HydrophobicContact CB-CZ3 4.32Å; I17-W105 HydrophobicContact CD1-CB 4.37Å; G18-W105 VanDerWaalsContact C-CZ2 3.44Å; G18-W105 WeakPolarHBondContact O-CZ2 3.36Å; D19-W105 PolarHBondContact OD1-NE1 3.5Å; M89-W105 HydrophobicContact CG-CB 4.24Å; M89-W105 HydrophobicContact SD-CB 3.79Å; H101-W105 VanDerWaalsContact O-CD1 3.25Å; H101-W105 PolarHBondContact O-N 3.39Å; L102-W105 PolarHBondContact O-N 2.81Å; L102-W105 VanDerWaalsContact O-N 3.15Å; W105-D108 PolarHBondContact O-N 2.88Å; W105-A109 WeakPolarHBondContact O-CB 3.35Å; W105-A109 PolarHBondContact O-N 2.85Å
106	L	96	Very high	94.4	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-68.6	-42.6	177.4	-179.7	59.6	0	0	0	111.9	M89 L102 S103 S104 D108 A109 R110 I119 F142 N146 L148	M89-L106 HydrophobicContact CE-CB 4.16Å; M89-L106 HydrophobicContact CE-CD1 4.42Å; M89-L106 HydrophobicContact SD-CB 4Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.07Å; L102-L106 PolarHBondContact O-N 3.34Å; S103-L106 PolarHBondContact O-N 3.09Å; S104-L106 VanDerWaalsContact C-N 3.32Å; S104-L106 PolarHBondContact O-N 3.43Å; L106-D108 VanDerWaalsContact C-N 3.35Å; L106-A109 PolarHBondContact O-N 3.34Å; L106-R110 HydrophobicContact CD1-CG 4.15Å; L106-R110 WeakPolarHBondContact O-CG 3.45Å; L106-R110 PolarHBondContact O-N 3.31Å; L106-I119 HydrophobicContact CD1-CD1 3.83Å; L106-F142 HydrophobicContact CD2-CE1 4.46Å; L106-F142 HydrophobicContact CD2-CZ 4.11Å; L106-N146 HydrophobicContact CD2-CB 3.81Å; L106-N146 VanDerWaalsContact CD2-OD1 3.31Å; L106-N146 WeakPolarHBondContact CD2-OD1 3.42Å; L106-L148 HydrophobicContact CD1-CD1 4.29Å; L106-L148 HydrophobicContact CD1-CD2 3.81Å; L106-L148 HydrophobicContact CD2-CD1 4.35Å
107	T	95.1	Very high	94.2	Very high	75 Å²	75	50.1 Å²	50.1	46%	0.46	28%	0.278	S	S	.	.	H	α-helix	trans	-59.1	-47	173.7	-62.6	0	0	0	0	111	S103 S104 A109 R110 N111	S103-T107 PolarHBondContact O-N 3.17Å; S103-T107 PolarHBondContact O-OG1 2.87Å; S104-T107 PolarHBondContact O-N 2.98Å; T107-A109 PolarHBondContact O-N 3.27Å; T107-R110 PolarHBondContact O-N 2.82Å; T107-N111 WeakPolarHBondContact CG2-ND2 3.36Å; T107-N111 VanDerWaalsContact O-CB 3.29Å; T107-N111 WeakPolarHBondContact O-CB 3.41Å; T107-N111 PolarHBondContact O-N 2.7Å; T107-N111 PolarHBondContact O-ND2 2.9Å
108	D	92.2	Very high	94.2	Very high	26 Å²	26	47.9 Å²	47.9	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-43.6	176.6	-79.7	-23.1	0	0	0	111.4	S104 W105 L106 N111 L112	S104-D108 PolarHBondContact O-N 3.39Å; S104-D108 VanDerWaalsContact O-N 3.08Å; W105-D108 PolarHBondContact O-N 2.88Å; L106-D108 VanDerWaalsContact C-N 3.35Å; D108-N111 PolarHBondContact O-N 3.36Å; D108-L112 HydrophobicContact CB-CD1 4.3Å; D108-L112 WeakPolarHBondContact O-CB 3.42Å; D108-L112 WeakPolarHBondContact O-CG 2.89Å; D108-L112 PolarHBondContact O-N 2.87Å
109	A	93.4	Very high	94.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.9	-55.1	176.7	0	0	0	0	0	111.7	I17 Y81 W105 L106 T107 N111 L112 T113 I119	I17-A109 HydrophobicContact CD1-CB 3.97Å; Y81-A109 HydrophobicContact CE1-CB 3.99Å; W105-A109 WeakPolarHBondContact O-CB 3.35Å; W105-A109 PolarHBondContact O-N 2.85Å; L106-A109 PolarHBondContact O-N 3.34Å; T107-A109 PolarHBondContact O-N 3.27Å; A109-N111 VanDerWaalsContact C-N 3.26Å; A109-N111 PolarHBondContact O-N 3.01Å; A109-L112 PolarHBondContact O-N 2.84Å; A109-T113 WeakPolarHBondContact O-CB 3.25Å; A109-T113 WeakPolarHBondContact O-CG2 3.37Å; A109-T113 PolarHBondContact O-N 3.41Å; A109-T113 PolarHBondContact O-OG1 3.45Å; A109-I119 HydrophobicContact CB-CD1 3.99Å
110	R	94.8	Very high	94.3	Very high	120 Å²	120	47 Å²	47	45%	0.453	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-32.6	-178.7	-73	-179.2	173.8	157.2	-1.1	113.5	L106 T107 I119 N146	L106-R110 HydrophobicContact CD1-CG 4.15Å; L106-R110 WeakPolarHBondContact O-CG 3.45Å; L106-R110 PolarHBondContact O-N 3.31Å; T107-R110 PolarHBondContact O-N 2.82Å; R110-I119 HydrophobicContact CG-CD1 4.3Å; R110-N146 PolarHBondContact NH1-OD1 3.23Å; R110-N146 PolarHBondContact NH2-O 2.86Å; R110-N146 PolarHBondContact NH2-OD1 2.95Å
111	N	93.5	Very high	94.3	Very high	120 Å²	120	42.3 Å²	42.3	64%	0.642	23%	0.234	S	C	*	.	H	α-helix	trans	-82.3	-25.3	-178.7	-70.6	-18.3	0	0	0	113.6	T107 D108 A109	T107-N111 WeakPolarHBondContact CG2-ND2 3.36Å; T107-N111 VanDerWaalsContact O-CB 3.29Å; T107-N111 WeakPolarHBondContact O-CB 3.41Å; T107-N111 PolarHBondContact O-N 2.7Å; T107-N111 PolarHBondContact O-ND2 2.9Å; D108-N111 PolarHBondContact O-N 3.36Å; A109-N111 VanDerWaalsContact C-N 3.26Å; A109-N111 PolarHBondContact O-N 3.01Å
112	L	91.5	Very high	94.4	Very high	57 Å²	57	38.4 Å²	38.4	30%	0.298	22%	0.216	S	C	.	.	H	α-helix	trans	-112.7	-14.1	-170.4	-57.7	173.8	0	0	0	113.7	R78 Y81 D108 A109	R78-L112 HydrophobicContact CB-CD1 4.21Å; R78-L112 HydrophobicContact CG-CD1 3.71Å; Y81-L112 CarbonylContact C-O 3.48Å; Y81-L112 VanDerWaalsContact CB-CB 3.47Å; Y81-L112 HydrophobicContact CD1-CB 4.15Å; Y81-L112 HydrophobicContact CD2-CB 4.29Å; Y81-L112 HydrophobicContact CD2-CD1 3.82Å; Y81-L112 HydrophobicContact CE2-CD1 4.08Å; Y81-L112 HydrophobicContact CG-CB 3.74Å; Y81-L112 HydrophobicContact CG-CD1 4.11Å; D108-L112 HydrophobicContact CB-CD1 4.3Å; D108-L112 WeakPolarHBondContact O-CB 3.42Å; D108-L112 WeakPolarHBondContact O-CG 2.89Å; D108-L112 PolarHBondContact O-N 2.87Å; A109-L112 PolarHBondContact O-N 2.84Å
113	T	91.5	Very high	94.5	Very high	17 Å²	17	38.4 Å²	38.4	10%	0.104	22%	0.216	C	C	.	.	S	Bend	trans	-99.5	178.6	171.8	73.2	0	0	0	0	111.4	I15 Y81 A84 A109 T117	I15-T113 HydrophobicContact CD1-CG2 4.15Å; Y81-T113 HydrophobicContact CD1-CG2 3.66Å; Y81-T113 HydrophobicContact CG-CG2 4.35Å; A84-T113 HydrophobicContact CB-CG2 4.16Å; A109-T113 WeakPolarHBondContact O-CB 3.25Å; A109-T113 WeakPolarHBondContact O-CG2 3.37Å; A109-T113 PolarHBondContact O-N 3.41Å; A109-T113 PolarHBondContact O-OG1 3.45Å; T113-T117 WeakPolarHBondContact CB-OG1 3.4Å; T113-T117 HydrophobicContact CG2-CG2 4.2Å; T113-T117 VanDerWaalsContact OG1-CB 3.3Å; T113-T117 WeakPolarHBondContact OG1-CB 3.48Å; T113-T117 PolarHBondContact OG1-OG1 3.19Å; T113-T117 VanDerWaalsContact OG1-OG1 3.12Å
114	N	87.7	Confident	94.6	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	20%	0.195	C	C	.	.			trans	-74.1	156.9	173.1	74	49.8	0	0	0	110.4	N116 T117 E187 S188	N114-N116 PolarHBondContact O-N 2.86Å; N114-N116 VanDerWaalsContact OD1-CA 3.25Å; N114-N116 WeakPolarHBondContact OD1-CA 3.43Å; N114-N116 WeakPolarHBondContact OD1-CB 3.48Å; N114-N116 PolarHBondContact OD1-N 2.94Å; N114-T117 VanDerWaalsContact CG-OG1 3.24Å; N114-T117 PolarHBondContact N-OG1 3.15Å; N114-T117 WeakPolarHBondContact O-CB 3.38Å; N114-T117 PolarHBondContact O-N 2.8Å; N114-T117 VanDerWaalsContact O-N 3.16Å; N114-T117 PolarHBondContact O-OG1 3.44Å; N114-T117 WeakPolarHBondContact OD1-CA 3.39Å; N114-T117 PolarHBondContact OD1-N 3.38Å; N114-T117 PolarHBondContact OD1-OG1 3.36Å; N114-E187 PolarHBondContact ND2-O 2.89Å; N114-S188 VanDerWaalsContact ND2-C 3.28Å; N114-S188 VanDerWaalsContact ND2-CA 3.32Å; N114-S188 WeakPolarHBondContact ND2-CA 3.34Å; N114-S188 PolarHBondContact ND2-O 3.45Å
115	P	89.2	Confident	94.8	Very high	131 Å²	131	35.6 Å²	35.6	85%	0.851	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.1	178.6	-25.6	35.5	0	0	0	114.7
116	N	90.1	Very high	95	Very high	76 Å²	76	36.2 Å²	36.2	41%	0.406	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	5.3	-179.1	-65	-33.6	0	0	0	112.8	N114 V118 S180 L181	N114-N116 PolarHBondContact O-N 2.86Å; N114-N116 VanDerWaalsContact OD1-CA 3.25Å; N114-N116 WeakPolarHBondContact OD1-CA 3.43Å; N114-N116 WeakPolarHBondContact OD1-CB 3.48Å; N114-N116 PolarHBondContact OD1-N 2.94Å; N116-V118 PolarHBondContact O-N 3.49Å; N116-S180 PolarHBondContact ND2-O 2.81Å; N116-S180 VanDerWaalsContact ND2-O 3.12Å; N116-L181 HydrophobicContact CB-CD2 3.47Å; N116-L181 VanDerWaalsContact CB-CD2 3.47Å; N116-L181 HydrophobicContact CB-CG 4.33Å
117	T	94.5	Very high	95.1	Very high	15 Å²	15	38.4 Å²	38.4	9%	0.092	21%	0.207	C	C	.	.			trans	-66.4	124.9	-177.1	-66.1	0	0	0	0	107.9	A84 A87 T113 N114 I119	A84-T117 PolarHBondContact O-OG1 3.48Å; A87-T117 HydrophobicContact CB-CG2 4.27Å; T113-T117 WeakPolarHBondContact CB-OG1 3.4Å; T113-T117 HydrophobicContact CG2-CG2 4.2Å; T113-T117 VanDerWaalsContact OG1-CB 3.3Å; T113-T117 WeakPolarHBondContact OG1-CB 3.48Å; T113-T117 PolarHBondContact OG1-OG1 3.19Å; T113-T117 VanDerWaalsContact OG1-OG1 3.12Å; N114-T117 VanDerWaalsContact CG-OG1 3.24Å; N114-T117 PolarHBondContact N-OG1 3.15Å; N114-T117 WeakPolarHBondContact O-CB 3.38Å; N114-T117 PolarHBondContact O-N 2.8Å; N114-T117 VanDerWaalsContact O-N 3.16Å; N114-T117 PolarHBondContact O-OG1 3.44Å; N114-T117 WeakPolarHBondContact OD1-CA 3.39Å; N114-T117 PolarHBondContact OD1-N 3.38Å; N114-T117 PolarHBondContact OD1-OG1 3.36Å; T117-I119 HydrophobicContact CG2-CG1 4.43Å; T117-I119 PolarHBondContact O-N 3.32Å
118	V	97.2	Very high	95.2	Very high	11 Å²	11	36.9 Å²	36.9	7%	0.067	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122	176.9	173.9	0	0	0	0	108.6	A85 G86 A87 N116 L149 A168 K171 I172	A85-V118 PolarHBondContact O-N 3.29Å; G86-V118 CarbonylContact C-O 3.59Å; G86-V118 VanDerWaalsContact CA-O 3.23Å; G86-V118 WeakPolarHBondContact CA-O 3.35Å; A87-V118 PolarHBondContact N-O 3.04Å; N116-V118 PolarHBondContact O-N 3.49Å; V118-L149 HydrophobicContact CG1-CD1 3.73Å; V118-L149 HydrophobicContact CG1-CG 4.42Å; V118-A168 HydrophobicContact CG1-CB 4.39Å; V118-K171 HydrophobicContact CG1-CB 3.99Å; V118-K171 HydrophobicContact CG1-CG 3.93Å; V118-K171 HydrophobicContact CG2-CB 4.18Å; V118-K171 HydrophobicContact CG2-CG 3.72Å; V118-I172 HydrophobicContact CB-CD1 4.28Å; V118-I172 HydrophobicContact CB-CG1 3.71Å; V118-I172 HydrophobicContact CG2-CB 4.46Å; V118-I172 HydrophobicContact CG2-CG1 3.48Å; V118-I172 VanDerWaalsContact CG2-CG1 3.48Å
119	I	98.1	Very high	95.4	Very high	16 Å²	16	40.7 Å²	40.7	8%	0.082	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.6	178.3	-51.7	-179.4	0	0	0	108.5	A87 M89 L106 A109 R110 T117 L148 L149	A87-I119 HydrophobicContact CB-CG1 4.24Å; A87-I119 HydrophobicContact CB-CG2 4.46Å; A87-I119 WeakPolarHBondContact O-CA 3.31Å; M89-I119 HydrophobicContact CB-CG2 4.38Å; L106-I119 HydrophobicContact CD1-CD1 3.83Å; A109-I119 HydrophobicContact CB-CD1 3.99Å; R110-I119 HydrophobicContact CG-CD1 4.3Å; T117-I119 HydrophobicContact CG2-CG1 4.43Å; T117-I119 PolarHBondContact O-N 3.32Å; I119-L148 HydrophobicContact CB-CD2 3.86Å; I119-L148 HydrophobicContact CD1-CD2 4.48Å; I119-L148 HydrophobicContact CG2-CD2 3.95Å; I119-L149 PolarHBondContact O-N 2.96Å
120	I	98.7	Very high	95.7	Very high	2 Å²	2	46 Å²	46	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.3	171	-175.2	169.3	0	0	0	109.6	A87 L88 M89 I122 L149 L151 A164 A168	A87-I120 PolarHBondContact O-N 2.7Å; L88-I120 HydrophobicContact CB-CG2 4.29Å; L88-I120 HydrophobicContact CD1-CG2 4.25Å; L88-I120 HydrophobicContact CG-CG2 3.71Å; M89-I120 PolarHBondContact N-O 3.45Å; I120-I122 HydrophobicContact CD1-CG1 4.47Å; I120-I122 HydrophobicContact CG1-CG1 4.13Å; I120-I122 HydrophobicContact CG2-CD1 4.25Å; I120-I122 HydrophobicContact CG2-CG1 4.36Å; I120-L149 CarbonylContact C-O 3.43Å; I120-L149 WeakPolarHBondContact CA-O 3.31Å; I120-L149 HydrophobicContact CB-CB 3.86Å; I120-L149 HydrophobicContact CD1-CB 4.15Å; I120-L149 HydrophobicContact CG1-CB 3.73Å; I120-L151 HydrophobicContact CD1-CD2 4.19Å; I120-L151 HydrophobicContact CD1-CG 4.2Å; I120-A164 HydrophobicContact CD1-CB 4.4Å; I120-A164 WeakPolarHBondContact CD1-O 3.08Å; I120-A168 HydrophobicContact CG2-CB 4.26Å
121	L	98.8	Very high	95.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.5	169.1	177.8	62.7	0	0	0	109.4	M89 Y91 L102 F142 A143 L148 L149 F150 L151	M89-L121 HydrophobicContact CE-CD1 3.93Å; M89-L121 HydrophobicContact CG-CD1 4.42Å; M89-L121 CarbonylContact O-C 3.59Å; M89-L121 WeakPolarHBondContact O-CA 3.35Å; Y91-L121 HydrophobicContact CD1-CD1 3.65Å; Y91-L121 HydrophobicContact CD1-CG 4.26Å; Y91-L121 HydrophobicContact CE1-CD1 3.94Å; Y91-L121 HydrophobicContact CE1-CD2 4.33Å; Y91-L121 HydrophobicContact CE1-CG 4.03Å; L102-L121 HydrophobicContact CD1-CD1 3.7Å; L102-L121 HydrophobicContact CD1-CD2 4.26Å; L102-L121 HydrophobicContact CD2-CD1 3.58Å; L102-L121 HydrophobicContact CG-CD1 4.28Å; L121-F142 HydrophobicContact CD2-CD1 3.8Å; L121-F142 HydrophobicContact CD2-CE1 4.36Å; L121-A143 HydrophobicContact CB-CB 4.47Å; L121-A143 HydrophobicContact CD2-CB 4.1Å; L121-L148 HydrophobicContact CB-CD1 4.32Å; L121-L149 PolarHBondContact N-O 2.81Å; L121-F150 HydrophobicContact CB-CD2 3.97Å; L121-F150 HydrophobicContact CD2-CD2 3.78Å; L121-F150 HydrophobicContact CD2-CE2 4.06Å; L121-F150 HydrophobicContact CG-CD2 3.76Å; L121-F150 HydrophobicContact CG-CE2 4.13Å; L121-F150 WeakPolarHBondContact O-CA 3.12Å; L121-L151 PolarHBondContact O-N 3.26Å
122	I	98.8	Very high	96.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.8	-178.2	-56.1	169.9	0	0	0	109.1	L27 L88 M89 V90 Y91 I120 N124 L151 A153 A164	L27-I122 HydrophobicContact CD1-CG2 4.21Å; L88-I122 HydrophobicContact CB-CD1 3.96Å; L88-I122 HydrophobicContact CD2-CD1 3.79Å; L88-I122 HydrophobicContact CG-CD1 3.91Å; M89-I122 PolarHBondContact O-N 3.01Å; V90-I122 WeakPolarHBondContact CA-O 3.4Å; V90-I122 HydrophobicContact CG2-CB 4.37Å; V90-I122 HydrophobicContact CG2-CD1 4.41Å; Y91-I122 WeakPolarHBondContact CD1-O 3.38Å; Y91-I122 PolarHBondContact N-O 3.35Å; I120-I122 HydrophobicContact CD1-CG1 4.47Å; I120-I122 HydrophobicContact CG1-CG1 4.13Å; I120-I122 HydrophobicContact CG2-CD1 4.25Å; I120-I122 HydrophobicContact CG2-CG1 4.36Å; I122-N124 PolarHBondContact O-N 2.71Å; I122-L151 WeakPolarHBondContact CA-O 3.37Å; I122-L151 HydrophobicContact CG1-CD1 4.49Å; I122-L151 HydrophobicContact CG2-CD1 4.21Å; I122-A153 HydrophobicContact CG2-CB 3.98Å; I122-A164 HydrophobicContact CD1-CB 3.76Å; I122-A164 HydrophobicContact CG1-CB 4.28Å
123	G	98.8	Very high	96.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	100.9	165.5	0	0	0	0	0	110	L151 E152 A153	G123-L151 PolarHBondContact N-O 3.13Å; G123-E152 CarbonylContact O-C 3.6Å; G123-E152 WeakPolarHBondContact O-CA 3.38Å; G123-E152 WeakPolarHBondContact O-CB 3.31Å; G123-A153 PolarHBondContact O-N 3.34Å
124	N	98.6	Very high	96.7	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	162.5	-178.1	-170	38.9	0	0	0	112	V22 L27 V90 Y91 I93 I122 A153 A155	V22-N124 PolarHBondContact O-ND2 3.13Å; L27-N124 HydrophobicContact CD1-CB 4.37Å; V90-N124 HydrophobicContact CG1-CB 3.75Å; Y91-N124 PolarHBondContact O-N 3.29Å; I93-N124 PolarHBondContact N-O 2.84Å; I93-N124 VanDerWaalsContact N-O 3.08Å; I122-N124 PolarHBondContact O-N 2.71Å; N124-A153 CarbonylContact C-O 3.58Å; N124-A153 VanDerWaalsContact CA-O 3.3Å; N124-A153 WeakPolarHBondContact CA-O 3.33Å; N124-A153 PolarHBondContact OD1-O 2.8Å; N124-A155 PolarHBondContact OD1-N 3.34Å; N124-A155 VanDerWaalsContact OD1-N 3.12Å
125	K	97.9	Very high	97.2	Very high	52 Å²	52	45.5 Å²	45.5	23%	0.226	26%	0.257	C	S	.	.			trans	71.7	35.1	-176.6	-46.4	-170.2	-168.8	169.8	0	113.6	G21 D92 I93 D127 L128 A153	G21-K125 PolarHBondContact O-NZ 3.28Å; D92-K125 WeakPolarHBondContact OD1-CD 3.42Å; D92-K125 WeakPolarHBondContact OD2-CD 3.46Å; D92-K125 WeakPolarHBondContact OD2-CE 3.24Å; D92-K125 IonicContact OD2-NZ 2.7Å; D92-K125 PolarHBondContact OD2-NZ 3.45Å; I93-K125 WeakPolarHBondContact CD1-O 3.34Å; I93-K125 WeakPolarHBondContact CG1-O 3.38Å; K125-D127 PolarHBondContact O-N 3.45Å; K125-L128 HydrophobicContact CB-CD1 4.05Å; K125-L128 HydrophobicContact CB-CG 4.26Å; K125-L128 HydrophobicContact CD-CD1 3.98Å; K125-L128 WeakPolarHBondContact O-CB 3.49Å; K125-L128 PolarHBondContact O-N 3Å; K125-A153 PolarHBondContact N-O 3.27Å
126	A	98.1	Very high	97.7	Very high	15 Å²	15	43.5 Å²	43.5	12%	0.124	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-54.7	-21.2	173.2	0	0	0	0	0	113.7	L128 E152 A153	A126-L128 PolarHBondContact O-N 2.7Å; A126-E152 HydrophobicContact CB-CB 4.34Å; A126-A153 WeakPolarHBondContact CB-O 3.37Å; A126-A153 PolarHBondContact N-O 3.49Å
127	D	97.9	Very high	98.1	Very high	51 Å²	51	45.9 Å²	45.9	27%	0.273	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-66.9	-13.3	172.3	62.6	-76.5	0	0	0	114.2	K125 S154 K156 T157	K125-D127 PolarHBondContact O-N 3.45Å; D127-S154 WeakPolarHBondContact CB-OG 3.05Å; D127-S154 VanDerWaalsContact CG-OG 3.28Å; D127-S154 WeakPolarHBondContact OD1-CB 3.39Å; D127-S154 PolarHBondContact OD1-OG 2.7Å; D127-K156 WeakPolarHBondContact OD2-CD 3.39Å; D127-K156 IonicContact OD2-NZ 2.7Å; D127-T157 HydrophobicContact CB-CG2 3.91Å
128	L	97.7	Very high	98.3	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.225	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-101.3	37.4	179.8	-57.5	-176.7	0	0	0	112.5	T94 K125 A126 A130 Q131 R132	T94-L128 HydrophobicContact CG2-CB 3.56Å; T94-L128 HydrophobicContact CG2-CD1 3.95Å; T94-L128 HydrophobicContact CG2-CG 4.41Å; K125-L128 HydrophobicContact CB-CD1 4.05Å; K125-L128 HydrophobicContact CB-CG 4.26Å; K125-L128 HydrophobicContact CD-CD1 3.98Å; K125-L128 WeakPolarHBondContact O-CB 3.49Å; K125-L128 PolarHBondContact O-N 3Å; A126-L128 PolarHBondContact O-N 2.7Å; L128-A130 PolarHBondContact O-N 2.71Å; L128-A130 VanDerWaalsContact O-N 3.11Å; L128-Q131 HydrophobicContact CB-CB 4.5Å; L128-Q131 CarbonylContact O-C 3.5Å; L128-Q131 WeakPolarHBondContact O-CA 3.24Å; L128-Q131 PolarHBondContact O-N 3.12Å; L128-R132 PolarHBondContact O-N 2.85Å
129	E	97.6	Very high	98.3	Very high	107 Å²	107	47 Å²	47	50%	0.5	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-49.7	-39.8	-177.5	-172	57.8	-147.5	0	0	113.8	Q131 R132	E129-Q131 PolarHBondContact O-N 3.35Å; E129-Q131 VanDerWaalsContact O-N 3.11Å; E129-R132 VanDerWaalsContact CD-NE 3.26Å; E129-R132 WeakPolarHBondContact O-CB 3.29Å; E129-R132 PolarHBondContact O-N 3.47Å; E129-R132 IonicContact OE1-CZ 3.45Å; E129-R132 IonicContact OE1-NE 3.35Å; E129-R132 PolarHBondContact OE1-NE 2.88Å; E129-R132 IonicContact OE1-NH2 2.65Å; E129-R132 IonicContact OE2-CZ 3.79Å; E129-R132 VanDerWaalsContact OE2-CZ 3.25Å; E129-R132 IonicContact OE2-NE 2.86Å; E129-R132 PolarHBondContact OE2-NE 2.7Å; E129-R132 IonicContact OE2-NH2 2.67Å; E129-R132 PolarHBondContact OE2-NH2 3.2Å
130	A	98	Very high	98.3	Very high	110 Å²	110	50.2 Å²	50.2	91%	0.909	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-65.3	-14.8	178.6	0	0	0	0	0	114.3	L128	L128-A130 PolarHBondContact O-N 2.71Å; L128-A130 VanDerWaalsContact O-N 3.11Å
131	Q	98.1	Very high	98.3	Very high	123 Å²	123	55.3 Å²	55.3	58%	0.575	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-111	10.9	178.2	-59.4	175.3	40.4	0	0	111.6	T94 L128 E129 D133	T94-Q131 WeakPolarHBondContact CA-O 3.29Å; T94-Q131 VanDerWaalsContact CB-O 3.24Å; T94-Q131 WeakPolarHBondContact CB-O 3.31Å; T94-Q131 HydrophobicContact CG2-CB 3.84Å; L128-Q131 HydrophobicContact CB-CB 4.5Å; L128-Q131 CarbonylContact O-C 3.5Å; L128-Q131 WeakPolarHBondContact O-CA 3.24Å; L128-Q131 PolarHBondContact O-N 3.12Å; E129-Q131 PolarHBondContact O-N 3.35Å; E129-Q131 VanDerWaalsContact O-N 3.11Å; Q131-D133 PolarHBondContact O-N 3.07Å
132	R	98.6	Very high	98.3	Very high	58 Å²	58	56.3 Å²	56.3	22%	0.219	29%	0.286	C	S	.	.			trans	-57.2	125	-179.5	179.7	179.2	-70.1	-83.7	3.3	110.3	I93 L128 E129 V134 E152	I93-R132 HydrophobicContact CD1-CB 4.49Å; L128-R132 PolarHBondContact O-N 2.85Å; E129-R132 VanDerWaalsContact CD-NE 3.26Å; E129-R132 WeakPolarHBondContact O-CB 3.29Å; E129-R132 PolarHBondContact O-N 3.47Å; E129-R132 IonicContact OE1-CZ 3.45Å; E129-R132 IonicContact OE1-NE 3.35Å; E129-R132 PolarHBondContact OE1-NE 2.88Å; E129-R132 IonicContact OE1-NH2 2.65Å; E129-R132 IonicContact OE2-CZ 3.79Å; E129-R132 VanDerWaalsContact OE2-CZ 3.25Å; E129-R132 IonicContact OE2-NE 2.86Å; E129-R132 PolarHBondContact OE2-NE 2.7Å; E129-R132 IonicContact OE2-NH2 2.67Å; E129-R132 PolarHBondContact OE2-NH2 3.2Å; R132-V134 VanDerWaalsContact CD-O 3.27Å; R132-V134 WeakPolarHBondContact CD-O 3.45Å; R132-V134 WeakPolarHBondContact CG-O 3.47Å; R132-V134 PolarHBondContact NH1-O 3.15Å; R132-E152 IonicContact CZ-OE1 3.25Å; R132-E152 IonicContact CZ-OE2 2.7Å; R132-E152 IonicContact NH1-OE1 3.63Å; R132-E152 PolarHBondContact NH1-OE1 3.16Å; R132-E152 IonicContact NH1-OE2 3.86Å; R132-E152 PolarHBondContact NH1-OE2 3.17Å; R132-E152 IonicContact NH2-OE1 2.7Å; R132-E152 IonicContact NH2-OE2 3.72Å; R132-E152 PolarHBondContact NH2-OE2 2.92Å
133	D	98.4	Very high	98.3	Very high	82 Å²	82	56.3 Å²	56.3	44%	0.439	29%	0.286	S	S	.	.			trans	-108.3	-33.4	174.5	-169.7	5.7	0	0	0	109.4	I93 R96 Q131	I93-D133 PolarHBondContact O-N 3.49Å; R96-D133 WeakPolarHBondContact CB-OD2 3.28Å; R96-D133 PolarHBondContact N-OD2 2.88Å; R96-D133 IonicContact NE-OD1 2.98Å; R96-D133 PolarHBondContact NH2-O 3.42Å; Q131-D133 PolarHBondContact O-N 3.07Å
134	V	98.5	Very high	98.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	-100.6	119.2	177.4	-170.1	0	0	0	0	111.8	Y91 I93 Y99 R132 E138 A139	Y91-V134 HydrophobicContact CD2-CG1 4.43Å; Y91-V134 HydrophobicContact CD2-CG2 4.26Å; Y91-V134 HydrophobicContact CE2-CB 3.85Å; Y91-V134 HydrophobicContact CE2-CG1 3.64Å; Y91-V134 HydrophobicContact CE2-CG2 4.09Å; I93-V134 PolarHBondContact O-N 2.91Å; Y99-V134 HydrophobicContact CD2-CG1 3.71Å; Y99-V134 HydrophobicContact CE2-CG1 4.21Å; Y99-V134 HydrophobicContact CG-CG1 3.95Å; Y99-V134 HydrophobicContact CG-CG2 4.23Å; R132-V134 VanDerWaalsContact CD-O 3.27Å; R132-V134 WeakPolarHBondContact CD-O 3.45Å; R132-V134 WeakPolarHBondContact CG-O 3.47Å; R132-V134 PolarHBondContact NH1-O 3.15Å; V134-E138 WeakPolarHBondContact CA-OE1 3.46Å; V134-E138 HydrophobicContact CG1-CG 3.9Å; V134-A139 HydrophobicContact CG1-CB 4.26Å
135	T	98.4	Very high	98.3	Very high	61 Å²	61	68.6 Å²	68.6	37%	0.374	34%	0.344	S	S	.	.			trans	-70.3	153	177.1	74.5	0	0	0	0	111.1	E137 E138	T135-E137 VanDerWaalsContact C-N 3.27Å; T135-E137 PolarHBondContact O-N 2.99Å; T135-E138 PolarHBondContact N-OE1 3.28Å; T135-E138 WeakPolarHBondContact O-CG 3.38Å; T135-E138 WeakPolarHBondContact OG1-CG 3.34Å; T135-E138 PolarHBondContact OG1-N 3.24Å; T135-E138 PolarHBondContact OG1-OE1 3.19Å
136	Y	98.5	Very high	98.3	Very high	88 Å²	88	68 Å²	68	35%	0.345	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-40.9	175.3	179	-92.6	0	0	0	110.5	A139 K140 F150 E152	Y136-A139 PolarHBondContact O-N 2.9Å; Y136-K140 HydrophobicContact CD1-CD 4.44Å; Y136-K140 HydrophobicContact CE1-CB 4.32Å; Y136-K140 HydrophobicContact CE1-CD 3.67Å; Y136-K140 WeakPolarHBondContact O-CB 3.49Å; Y136-K140 PolarHBondContact O-N 3.06Å; Y136-F150 AromaticContact CD2-CE1 3.83Å; Y136-F150 HydrophobicContact CD2-CE1 3.83Å; Y136-F150 HydrophobicContact CD2-CZ 4.19Å; Y136-F150 HydrophobicContact CE1-CE1 4.29Å; Y136-F150 HydrophobicContact CE2-CD1 4.3Å; Y136-F150 AromaticContact CE2-CE1 3.47Å; Y136-F150 HydrophobicContact CE2-CE1 3.47Å; Y136-F150 VanDerWaalsContact CE2-CE1 3.47Å; Y136-F150 HydrophobicContact CE2-CZ 4.16Å; Y136-F150 HydrophobicContact CG-CE1 4.37Å; Y136-F150 AromaticContact CZ-CE1 3.72Å; Y136-E152 HydrophobicContact CD2-CG 3.86Å; Y136-E152 HydrophobicContact CE2-CG 4.19Å
137	E	98.5	Very high	98.2	Very high	127 Å²	127	70.8 Å²	70.8	59%	0.593	37%	0.373	S	S	*	.	H	α-helix	trans	-64.6	-43.8	-175	-66.9	69.6	-152.3	0	0	112.4	T135 K140 Q141	T135-E137 VanDerWaalsContact C-N 3.27Å; T135-E137 PolarHBondContact O-N 2.99Å; E137-K140 PolarHBondContact O-N 3.42Å; E137-Q141 VanDerWaalsContact O-CB 3.3Å; E137-Q141 WeakPolarHBondContact O-CB 3.39Å; E137-Q141 PolarHBondContact O-N 3.21Å
138	E	98.2	Very high	98.2	Very high	49 Å²	49	69.3 Å²	69.3	23%	0.229	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-38	-178.7	72.6	-175.3	129.2	0	0	111.8	R96 Y99 V134 T135 Q141 F142	R96-E138 IonicContact CZ-OE1 3.65Å; R96-E138 IonicContact CZ-OE2 3.35Å; R96-E138 IonicContact NH1-OE1 3.99Å; R96-E138 PolarHBondContact NH1-OE1 3.43Å; R96-E138 IonicContact NH1-OE2 3.52Å; R96-E138 PolarHBondContact NH1-OE2 3.18Å; R96-E138 IonicContact NH2-OE1 3.75Å; R96-E138 PolarHBondContact NH2-OE1 3.03Å; R96-E138 IonicContact NH2-OE2 2.75Å; R96-E138 PolarHBondContact NH2-OE2 3.08Å; Y99-E138 PolarHBondContact OH-O 3.2Å; V134-E138 WeakPolarHBondContact CA-OE1 3.46Å; V134-E138 HydrophobicContact CG1-CG 3.9Å; T135-E138 PolarHBondContact N-OE1 3.28Å; T135-E138 WeakPolarHBondContact O-CG 3.38Å; T135-E138 WeakPolarHBondContact OG1-CG 3.34Å; T135-E138 PolarHBondContact OG1-N 3.24Å; T135-E138 PolarHBondContact OG1-OE1 3.19Å; E138-Q141 PolarHBondContact O-N 2.88Å; E138-F142 WeakPolarHBondContact O-CB 3.2Å; E138-F142 PolarHBondContact O-N 2.81Å
139	A	98.5	Very high	98.3	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-72.2	-37.2	178.1	0	0	0	0	0	111.8	Y91 Y99 V134 Y136 F142 A143 F150	Y91-A139 HydrophobicContact CE1-CB 4.13Å; Y91-A139 WeakPolarHBondContact OH-CB 3.5Å; Y99-A139 HydrophobicContact CD2-CB 4.49Å; Y99-A139 HydrophobicContact CE2-CB 4.09Å; V134-A139 HydrophobicContact CG1-CB 4.26Å; Y136-A139 PolarHBondContact O-N 2.9Å; A139-F142 PolarHBondContact O-N 3.42Å; A139-A143 PolarHBondContact O-N 3.37Å; A139-F150 HydrophobicContact CB-CE2 3.7Å; A139-F150 HydrophobicContact CB-CZ 3.63Å
140	K	98.7	Very high	98.3	Very high	84 Å²	84	66.4 Å²	66.4	37%	0.365	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-47.5	170.9	-176.1	175.1	171.4	-171.4	0	111.3	Y136 E137 F142 A143 E144 F150	Y136-K140 HydrophobicContact CD1-CD 4.44Å; Y136-K140 HydrophobicContact CE1-CB 4.32Å; Y136-K140 HydrophobicContact CE1-CD 3.67Å; Y136-K140 WeakPolarHBondContact O-CB 3.49Å; Y136-K140 PolarHBondContact O-N 3.06Å; E137-K140 PolarHBondContact O-N 3.42Å; K140-F142 VanDerWaalsContact C-N 3.35Å; K140-F142 PolarHBondContact O-N 3.1Å; K140-A143 WeakPolarHBondContact O-CB 3.38Å; K140-A143 PolarHBondContact O-N 2.84Å; K140-A143 VanDerWaalsContact O-N 3.16Å; K140-E144 WeakPolarHBondContact CE-OE1 3.42Å; K140-E144 HydrophobicContact CG-CG 4.5Å; K140-E144 IonicContact NZ-OE1 3.49Å; K140-E144 WeakPolarHBondContact O-CG 3.25Å; K140-E144 PolarHBondContact O-N 3.2Å; K140-F150 HydrophobicContact CB-CD1 3.66Å; K140-F150 HydrophobicContact CB-CE1 3.58Å; K140-F150 HydrophobicContact CB-CZ 4.49Å; K140-F150 HydrophobicContact CG-CD1 3.94Å; K140-F150 HydrophobicContact CG-CE1 4.3Å
141	Q	98.6	Very high	98.4	Very high	108 Å²	108	62.3 Å²	62.3	51%	0.505	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-46.2	177.5	-178.6	179.2	-9	0	0	111	E137 E138 A143 E144 E145	E137-Q141 VanDerWaalsContact O-CB 3.3Å; E137-Q141 WeakPolarHBondContact O-CB 3.39Å; E137-Q141 PolarHBondContact O-N 3.21Å; E138-Q141 PolarHBondContact O-N 2.88Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 2.84Å; Q141-E144 PolarHBondContact O-N 3.3Å; Q141-E145 HydrophobicContact CG-CG 4.33Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.37Å; Q141-E145 PolarHBondContact NE2-OE1 2.75Å; Q141-E145 WeakPolarHBondContact O-CB 3.43Å; Q141-E145 WeakPolarHBondContact O-CG 3.22Å; Q141-E145 PolarHBondContact O-N 2.79Å
142	F	98.7	Very high	98.4	Very high	21 Å²	21	57.2 Å²	57.2	9%	0.092	29%	0.29	C	S	.	.	H	α-helix	trans	-56.8	-41.5	175.6	174.5	-87.2	0	0	0	112.1	M89 Y99 L102 L106 L121 E138 A139 K140 N146 L148	M89-F142 HydrophobicContact CE-CE1 4.04Å; Y99-F142 HydrophobicContact CE2-CB 4.39Å; L102-F142 HydrophobicContact CB-CE1 4.03Å; L102-F142 HydrophobicContact CB-CZ 3.86Å; L102-F142 HydrophobicContact CD1-CD1 4.45Å; L102-F142 HydrophobicContact CD1-CE1 4.31Å; L106-F142 HydrophobicContact CD2-CE1 4.46Å; L106-F142 HydrophobicContact CD2-CZ 4.11Å; L121-F142 HydrophobicContact CD2-CD1 3.8Å; L121-F142 HydrophobicContact CD2-CE1 4.36Å; E138-F142 WeakPolarHBondContact O-CB 3.2Å; E138-F142 PolarHBondContact O-N 2.81Å; A139-F142 PolarHBondContact O-N 3.42Å; K140-F142 VanDerWaalsContact C-N 3.35Å; K140-F142 PolarHBondContact O-N 3.1Å; F142-N146 WeakPolarHBondContact O-CB 3.32Å; F142-N146 PolarHBondContact O-N 3.09Å; F142-N146 PolarHBondContact O-ND2 3.39Å; F142-L148 HydrophobicContact CD1-CD1 4.48Å; F142-L148 HydrophobicContact CE1-CD1 4.05Å
143	A	98.6	Very high	98.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-44.9	177.1	0	0	0	0	0	112.5	L121 A139 K140 Q141 N146 G147 L148 F150	L121-A143 HydrophobicContact CB-CB 4.47Å; L121-A143 HydrophobicContact CD2-CB 4.1Å; A139-A143 PolarHBondContact O-N 3.37Å; K140-A143 WeakPolarHBondContact O-CB 3.38Å; K140-A143 PolarHBondContact O-N 2.84Å; K140-A143 VanDerWaalsContact O-N 3.16Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 2.84Å; A143-N146 CarbonylContact O-C 3.47Å; A143-N146 PolarHBondContact O-N 3.04Å; A143-G147 PolarHBondContact O-N 3.27Å; A143-L148 HydrophobicContact CB-CB 4.04Å; A143-L148 PolarHBondContact O-N 3.18Å; A143-F150 HydrophobicContact CB-CB 3.57Å; A143-F150 HydrophobicContact CB-CD2 4.33Å; A143-F150 HydrophobicContact CB-CG 4.07Å
144	E	98.3	Very high	98.4	Very high	128 Å²	128	50.6 Å²	50.6	60%	0.598	26%	0.259	S	S	*	.	H	α-helix	trans	-61.4	-47.3	178.1	-72.9	176.8	172.3	0	0	111.6	K140 Q141 N146 G147	K140-E144 WeakPolarHBondContact CE-OE1 3.42Å; K140-E144 HydrophobicContact CG-CG 4.5Å; K140-E144 IonicContact NZ-OE1 3.49Å; K140-E144 WeakPolarHBondContact O-CG 3.25Å; K140-E144 PolarHBondContact O-N 3.2Å; Q141-E144 PolarHBondContact O-N 3.3Å; E144-N146 PolarHBondContact O-N 2.86Å; E144-N146 VanDerWaalsContact O-N 3.16Å; E144-G147 PolarHBondContact O-N 3.13Å; E144-G147 VanDerWaalsContact O-N 3.13Å
145	E	98.2	Very high	98.3	Very high	134 Å²	134	50.7 Å²	50.7	63%	0.626	26%	0.26	S	S	*	.	H	α-helix	trans	-60.2	-26.1	176.7	-72.8	176.7	-177.5	0	0	112.8	Q141	Q141-E145 HydrophobicContact CG-CG 4.33Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.37Å; Q141-E145 PolarHBondContact NE2-OE1 2.75Å; Q141-E145 WeakPolarHBondContact O-CB 3.43Å; Q141-E145 WeakPolarHBondContact O-CG 3.22Å; Q141-E145 PolarHBondContact O-N 2.79Å
146	N	97.8	Very high	98.2	Very high	39 Å²	39	53.2 Å²	53.2	21%	0.209	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	5.3	-179.7	-75.1	-78	0	0	0	114.2	L106 R110 F142 A143 E144 L148	L106-N146 HydrophobicContact CD2-CB 3.81Å; L106-N146 VanDerWaalsContact CD2-OD1 3.31Å; L106-N146 WeakPolarHBondContact CD2-OD1 3.42Å; R110-N146 PolarHBondContact NH1-OD1 3.23Å; R110-N146 PolarHBondContact NH2-O 2.86Å; R110-N146 PolarHBondContact NH2-OD1 2.95Å; F142-N146 WeakPolarHBondContact O-CB 3.32Å; F142-N146 PolarHBondContact O-N 3.09Å; F142-N146 PolarHBondContact O-ND2 3.39Å; A143-N146 CarbonylContact O-C 3.47Å; A143-N146 PolarHBondContact O-N 3.04Å; E144-N146 PolarHBondContact O-N 2.86Å; E144-N146 VanDerWaalsContact O-N 3.16Å; N146-L148 VanDerWaalsContact C-N 3.29Å; N146-L148 HydrophobicContact CB-CD1 4.01Å; N146-L148 HydrophobicContact CB-CD2 4.16Å; N146-L148 HydrophobicContact CB-CG 3.76Å; N146-L148 WeakPolarHBondContact O-CD2 3.36Å; N146-L148 PolarHBondContact O-N 2.88Å
147	G	97	Very high	98.1	Very high	73 Å²	73	53.1 Å²	53.1	75%	0.753	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	35.4	-179.6	0	0	0	0	0	113.9	A143 E144	A143-G147 PolarHBondContact O-N 3.27Å; E144-G147 PolarHBondContact O-N 3.13Å; E144-G147 VanDerWaalsContact O-N 3.13Å
148	L	98.4	Very high	98.1	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.105	26%	0.26	C	S	.	.			trans	-97	149.1	179.2	-42.7	179.6	0	0	0	110.1	M89 L106 I119 L121 F142 A143 N146	M89-L148 HydrophobicContact CE-CD1 3.64Å; L106-L148 HydrophobicContact CD1-CD1 4.29Å; L106-L148 HydrophobicContact CD1-CD2 3.81Å; L106-L148 HydrophobicContact CD2-CD1 4.35Å; I119-L148 HydrophobicContact CB-CD2 3.86Å; I119-L148 HydrophobicContact CD1-CD2 4.48Å; I119-L148 HydrophobicContact CG2-CD2 3.95Å; L121-L148 HydrophobicContact CB-CD1 4.32Å; F142-L148 HydrophobicContact CD1-CD1 4.48Å; F142-L148 HydrophobicContact CE1-CD1 4.05Å; A143-L148 HydrophobicContact CB-CB 4.04Å; A143-L148 PolarHBondContact O-N 3.18Å; N146-L148 VanDerWaalsContact C-N 3.29Å; N146-L148 HydrophobicContact CB-CD1 4.01Å; N146-L148 HydrophobicContact CB-CD2 4.16Å; N146-L148 HydrophobicContact CB-CG 3.76Å; N146-L148 WeakPolarHBondContact O-CD2 3.36Å; N146-L148 PolarHBondContact O-N 2.88Å
149	L	98.4	Very high	98.1	Very high	53 Å²	53	50.9 Å²	50.9	28%	0.277	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	150.6	160.7	-60	176.2	0	0	0	108.5	V118 I119 I120 L121 E167 K171	V118-L149 HydrophobicContact CG1-CD1 3.73Å; V118-L149 HydrophobicContact CG1-CG 4.42Å; I119-L149 PolarHBondContact O-N 2.96Å; I120-L149 CarbonylContact C-O 3.43Å; I120-L149 WeakPolarHBondContact CA-O 3.31Å; I120-L149 HydrophobicContact CB-CB 3.86Å; I120-L149 HydrophobicContact CD1-CB 4.15Å; I120-L149 HydrophobicContact CG1-CB 3.73Å; L121-L149 PolarHBondContact N-O 2.81Å; L149-E167 HydrophobicContact CD1-CB 4.48Å; L149-K171 HydrophobicContact CD1-CB 4.09Å
150	F	98.6	Very high	98	Very high	37 Å²	37	53.8 Å²	53.8	16%	0.162	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	137.8	-179.6	177.4	-112.9	0	0	0	112.5	Y91 L121 Y136 A139 K140 A143 E152	Y91-F150 HydrophobicContact CE1-CE2 4.25Å; L121-F150 HydrophobicContact CB-CD2 3.97Å; L121-F150 HydrophobicContact CD2-CD2 3.78Å; L121-F150 HydrophobicContact CD2-CE2 4.06Å; L121-F150 HydrophobicContact CG-CD2 3.76Å; L121-F150 HydrophobicContact CG-CE2 4.13Å; L121-F150 WeakPolarHBondContact O-CA 3.12Å; Y136-F150 AromaticContact CD2-CE1 3.83Å; Y136-F150 HydrophobicContact CD2-CE1 3.83Å; Y136-F150 HydrophobicContact CD2-CZ 4.19Å; Y136-F150 HydrophobicContact CE1-CE1 4.29Å; Y136-F150 HydrophobicContact CE2-CD1 4.3Å; Y136-F150 AromaticContact CE2-CE1 3.47Å; Y136-F150 HydrophobicContact CE2-CE1 3.47Å; Y136-F150 VanDerWaalsContact CE2-CE1 3.47Å; Y136-F150 HydrophobicContact CE2-CZ 4.16Å; Y136-F150 HydrophobicContact CG-CE1 4.37Å; Y136-F150 AromaticContact CZ-CE1 3.72Å; A139-F150 HydrophobicContact CB-CE2 3.7Å; A139-F150 HydrophobicContact CB-CZ 3.63Å; K140-F150 HydrophobicContact CB-CD1 3.66Å; K140-F150 HydrophobicContact CB-CE1 3.58Å; K140-F150 HydrophobicContact CB-CZ 4.49Å; K140-F150 HydrophobicContact CG-CD1 3.94Å; K140-F150 HydrophobicContact CG-CE1 4.3Å; A143-F150 HydrophobicContact CB-CB 3.57Å; A143-F150 HydrophobicContact CB-CD2 4.33Å; A143-F150 HydrophobicContact CB-CG 4.07Å; F150-E152 HydrophobicContact CZ-CG 4.04Å
151	L	98.5	Very high	98	Very high	23 Å²	23	49.8 Å²	49.8	12%	0.12	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	169.6	162.7	59.2	77.8	0	0	0	110.7	I120 L121 I122 G123 A153 N160 D163 A164	I120-L151 HydrophobicContact CD1-CD2 4.19Å; I120-L151 HydrophobicContact CD1-CG 4.2Å; L121-L151 PolarHBondContact O-N 3.26Å; I122-L151 WeakPolarHBondContact CA-O 3.37Å; I122-L151 HydrophobicContact CG1-CD1 4.49Å; I122-L151 HydrophobicContact CG2-CD1 4.21Å; G123-L151 PolarHBondContact N-O 3.13Å; L151-A153 HydrophobicContact CD1-CB 4.01Å; L151-N160 HydrophobicContact CD1-CB 4.11Å; L151-D163 HydrophobicContact CD2-CB 4.19Å; L151-A164 HydrophobicContact CD1-CB 3.99Å; L151-A164 HydrophobicContact CD2-CB 4.21Å
152	E	98.7	Very high	98	Very high	17 Å²	17	46.8 Å²	46.8	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	147.6	166	-64	-169.1	157.9	0	0	110.5	G123 A126 R132 Y136 F150 N160	G123-E152 CarbonylContact O-C 3.6Å; G123-E152 WeakPolarHBondContact O-CA 3.38Å; G123-E152 WeakPolarHBondContact O-CB 3.31Å; A126-E152 HydrophobicContact CB-CB 4.34Å; R132-E152 IonicContact CZ-OE1 3.25Å; R132-E152 IonicContact CZ-OE2 2.7Å; R132-E152 IonicContact NH1-OE1 3.63Å; R132-E152 PolarHBondContact NH1-OE1 3.16Å; R132-E152 IonicContact NH1-OE2 3.86Å; R132-E152 PolarHBondContact NH1-OE2 3.17Å; R132-E152 IonicContact NH2-OE1 2.7Å; R132-E152 IonicContact NH2-OE2 3.72Å; R132-E152 PolarHBondContact NH2-OE2 2.92Å; Y136-E152 HydrophobicContact CD2-CG 3.86Å; Y136-E152 HydrophobicContact CE2-CG 4.19Å; F150-E152 HydrophobicContact CZ-CG 4.04Å; E152-N160 WeakPolarHBondContact O-CB 3.19Å; E152-N160 PolarHBondContact O-ND2 2.91Å
153	A	98.6	Very high	97.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	161.9	-177.4	0	0	0	0	0	111.5	L27 I122 G123 N124 K125 A126 L151 E159 N160 V161	L27-A153 HydrophobicContact CD2-CB 4.33Å; I122-A153 HydrophobicContact CG2-CB 3.98Å; G123-A153 PolarHBondContact O-N 3.34Å; N124-A153 CarbonylContact C-O 3.58Å; N124-A153 VanDerWaalsContact CA-O 3.3Å; N124-A153 WeakPolarHBondContact CA-O 3.33Å; N124-A153 PolarHBondContact OD1-O 2.8Å; K125-A153 PolarHBondContact N-O 3.27Å; A126-A153 WeakPolarHBondContact CB-O 3.37Å; A126-A153 PolarHBondContact N-O 3.49Å; L151-A153 HydrophobicContact CD1-CB 4.01Å; A153-E159 VanDerWaalsContact CA-O 3.29Å; A153-E159 WeakPolarHBondContact CA-O 3.45Å; A153-E159 WeakPolarHBondContact CB-O 3.48Å; A153-N160 HydrophobicContact CB-CB 4.14Å; A153-V161 HydrophobicContact CB-CG2 4.41Å
154	S	98.2	Very high	97.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.			trans	-124.8	110	166.2	172.4	0	0	0	0	109.8	D127 K156 T157 G158 E159 V161	D127-S154 WeakPolarHBondContact CB-OG 3.05Å; D127-S154 VanDerWaalsContact CG-OG 3.28Å; D127-S154 WeakPolarHBondContact OD1-CB 3.39Å; D127-S154 PolarHBondContact OD1-OG 2.7Å; S154-K156 PolarHBondContact O-N 3.3Å; S154-K156 PolarHBondContact OG-N 2.88Å; S154-T157 VanDerWaalsContact CB-OG1 3.22Å; S154-T157 WeakPolarHBondContact CB-OG1 3.46Å; S154-T157 PolarHBondContact O-N 3.4Å; S154-T157 PolarHBondContact OG-N 2.67Å; S154-T157 VanDerWaalsContact OG-N 3.07Å; S154-T157 PolarHBondContact OG-OG1 3.12Å; S154-G158 CarbonylContact O-C 3.55Å; S154-G158 VanDerWaalsContact O-CA 3.31Å; S154-G158 WeakPolarHBondContact O-CA 3.42Å; S154-G158 PolarHBondContact O-N 3.28Å; S154-E159 PolarHBondContact N-O 2.65Å; S154-E159 PolarHBondContact O-N 3.21Å; S154-V161 WeakPolarHBondContact O-CG2 3.43Å
155	A	96.9	Very high	97.9	Very high	2 Å²	2	43 Å²	43	2%	0.017	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.6	169	0	0	0	0	0	112.6	C26 L27 Q30 F36 N124	C26-A155 HydrophobicContact CB-CB 3.6Å; L27-A155 HydrophobicContact CD2-CB 3.95Å; L27-A155 HydrophobicContact CG-CB 4.14Å; Q30-A155 WeakPolarHBondContact CG-O 3.47Å; Q30-A155 PolarHBondContact NE2-O 3.04Å; F36-A155 HydrophobicContact CD2-CB 4.36Å; F36-A155 WeakPolarHBondContact CD2-O 3.47Å; F36-A155 HydrophobicContact CE2-CB 4.47Å; N124-A155 PolarHBondContact OD1-N 3.34Å; N124-A155 VanDerWaalsContact OD1-N 3.12Å
156	K	96.5	Very high	97.9	Very high	115 Å²	115	38 Å²	38	50%	0.5	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-48.6	-179.5	-174.8	-171	-176.6	-178.7	0	112.3	F36 D127 S154	F36-K156 HydrophobicContact CD1-CB 4.33Å; F36-K156 HydrophobicContact CD1-CG 3.96Å; F36-K156 HydrophobicContact CD2-CB 4.17Å; F36-K156 HydrophobicContact CE1-CB 4.19Å; F36-K156 HydrophobicContact CE1-CG 3.85Å; F36-K156 HydrophobicContact CE2-CB 4.03Å; F36-K156 HydrophobicContact CG-CB 4.31Å; F36-K156 HydrophobicContact CG-CG 4.38Å; F36-K156 HydrophobicContact CZ-CB 4.04Å; F36-K156 HydrophobicContact CZ-CG 4.18Å; D127-K156 WeakPolarHBondContact OD2-CD 3.39Å; D127-K156 IonicContact OD2-NZ 2.7Å; S154-K156 PolarHBondContact O-N 3.3Å; S154-K156 PolarHBondContact OG-N 2.88Å
157	T	96.7	Very high	97.9	Very high	86 Å²	86	39.6 Å²	39.6	53%	0.528	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-20.3	-178.1	66.6	0	0	0	0	112.4	D127 S154 E159	D127-T157 HydrophobicContact CB-CG2 3.91Å; S154-T157 VanDerWaalsContact CB-OG1 3.22Å; S154-T157 WeakPolarHBondContact CB-OG1 3.46Å; S154-T157 PolarHBondContact O-N 3.4Å; S154-T157 PolarHBondContact OG-N 2.67Å; S154-T157 VanDerWaalsContact OG-N 3.07Å; S154-T157 PolarHBondContact OG-OG1 3.12Å; T157-E159 VanDerWaalsContact C-N 3.3Å; T157-E159 VanDerWaalsContact OG1-CB 3.28Å; T157-E159 WeakPolarHBondContact OG1-CB 3.35Å; T157-E159 PolarHBondContact OG1-N 2.99Å
158	G	96.9	Very high	97.9	Very high	28 Å²	28	36.1 Å²	36.1	29%	0.289	19%	0.188	S	C	.	.			trans	86.7	-1.4	-172.1	0	0	0	0	0	113.6	S154 N160 V161	S154-G158 CarbonylContact O-C 3.55Å; S154-G158 VanDerWaalsContact O-CA 3.31Å; S154-G158 WeakPolarHBondContact O-CA 3.42Å; S154-G158 PolarHBondContact O-N 3.28Å; G158-N160 PolarHBondContact O-N 2.79Å; G158-V161 PolarHBondContact O-N 3.05Å
159	E	98.2	Very high	97.9	Very high	101 Å²	101	35.2 Å²	35.2	47%	0.472	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	127.5	178	-178.6	175.7	-169.3	0	0	111.4	A153 S154 T157 V161	A153-E159 VanDerWaalsContact CA-O 3.29Å; A153-E159 WeakPolarHBondContact CA-O 3.45Å; A153-E159 WeakPolarHBondContact CB-O 3.48Å; S154-E159 PolarHBondContact N-O 2.65Å; S154-E159 PolarHBondContact O-N 3.21Å; T157-E159 VanDerWaalsContact C-N 3.3Å; T157-E159 VanDerWaalsContact OG1-CB 3.28Å; T157-E159 WeakPolarHBondContact OG1-CB 3.35Å; T157-E159 PolarHBondContact OG1-N 2.99Å; E159-V161 PolarHBondContact O-N 2.86Å
160	N	98.1	Very high	97.8	Very high	60 Å²	60	36.9 Å²	36.9	32%	0.321	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	8.2	-179.1	-56.8	-26	0	0	0	115.9	L151 E152 A153 G158 D163 A164	L151-N160 HydrophobicContact CD1-CB 4.11Å; E152-N160 WeakPolarHBondContact O-CB 3.19Å; E152-N160 PolarHBondContact O-ND2 2.91Å; A153-N160 HydrophobicContact CB-CB 4.14Å; G158-N160 PolarHBondContact O-N 2.79Å; N160-D163 PolarHBondContact O-N 3.21Å; N160-A164 PolarHBondContact O-N 2.77Å
161	V	98.2	Very high	97.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-44.5	177.3	177.8	0	0	0	0	109.8	L27 Q30 F31 A153 S154 G158 E159 F165	L27-V161 HydrophobicContact CD2-CG1 4.24Å; L27-V161 HydrophobicContact CD2-CG2 3.79Å; Q30-V161 HydrophobicContact CB-CG1 4.18Å; Q30-V161 HydrophobicContact CG-CB 4.26Å; Q30-V161 HydrophobicContact CG-CG1 4.03Å; Q30-V161 HydrophobicContact CG-CG2 4.01Å; F31-V161 HydrophobicContact CB-CG1 3.99Å; A153-V161 HydrophobicContact CB-CG2 4.41Å; S154-V161 WeakPolarHBondContact O-CG2 3.43Å; G158-V161 PolarHBondContact O-N 3.05Å; E159-V161 PolarHBondContact O-N 2.86Å; V161-F165 HydrophobicContact CG1-CE2 4.34Å; V161-F165 VanDerWaalsContact O-CD2 3.24Å; V161-F165 WeakPolarHBondContact O-CD2 3.31Å
162	E	97.4	Very high	97.6	Very high	45 Å²	45	37.6 Å²	37.6	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-48.6	176.2	-164.2	73.8	-166.2	0	0	110.7	K34 R51 A164 F165 L166	K34-E162 IonicContact NZ-OE2 3.12Å; K34-E162 PolarHBondContact NZ-OE2 3.46Å; R51-E162 IonicContact CZ-OE1 3.99Å; R51-E162 VanDerWaalsContact CZ-OE1 3.23Å; R51-E162 IonicContact CZ-OE2 3.87Å; R51-E162 VanDerWaalsContact NH1-CD 3.32Å; R51-E162 IonicContact NH1-OE1 3.13Å; R51-E162 PolarHBondContact NH1-OE1 3.45Å; R51-E162 VanDerWaalsContact NH1-OE1 3.12Å; R51-E162 IonicContact NH1-OE2 3.91Å; R51-E162 PolarHBondContact NH1-OE2 3.12Å; R51-E162 IonicContact NH2-OE1 3.45Å; R51-E162 PolarHBondContact NH2-OE1 3.02Å; R51-E162 IonicContact NH2-OE2 2.71Å; R51-E162 PolarHBondContact NH2-OE2 3.28Å; E162-A164 VanDerWaalsContact C-N 3.28Å; E162-A164 PolarHBondContact O-N 3.37Å; E162-F165 PolarHBondContact O-N 3.02Å; E162-L166 HydrophobicContact CG-CD1 3.96Å; E162-L166 HydrophobicContact CG-CD2 4.05Å; E162-L166 VanDerWaalsContact O-CD1 3.29Å; E162-L166 WeakPolarHBondContact O-CD1 3.22Å; E162-L166 PolarHBondContact O-N 3Å
163	D	98.2	Very high	97.4	Very high	68 Å²	68	37.8 Å²	37.8	36%	0.364	19%	0.19	S	C	.	.	H	α-helix	trans	-60.1	-37.6	-176.6	-58.7	-51.9	0	0	0	112.1	L151 N160 F165 L166 E167	L151-D163 HydrophobicContact CD2-CB 4.19Å; N160-D163 PolarHBondContact O-N 3.21Å; D163-F165 VanDerWaalsContact C-N 3.32Å; D163-F165 PolarHBondContact O-N 3.33Å; D163-L166 PolarHBondContact O-N 2.99Å; D163-E167 WeakPolarHBondContact O-CB 3.48Å; D163-E167 VanDerWaalsContact O-CG 3.31Å; D163-E167 WeakPolarHBondContact O-CG 3.4Å; D163-E167 PolarHBondContact O-N 3.09Å
164	A	98.1	Very high	97.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56	-44.4	177.6	0	0	0	0	0	113.3	I120 I122 L151 N160 E162	I120-A164 HydrophobicContact CD1-CB 4.4Å; I120-A164 WeakPolarHBondContact CD1-O 3.08Å; I122-A164 HydrophobicContact CD1-CB 3.76Å; I122-A164 HydrophobicContact CG1-CB 4.28Å; L151-A164 HydrophobicContact CD1-CB 3.99Å; L151-A164 HydrophobicContact CD2-CB 4.21Å; N160-A164 PolarHBondContact O-N 2.77Å; E162-A164 VanDerWaalsContact C-N 3.28Å; E162-A164 PolarHBondContact O-N 3.37Å
165	F	98.2	Very high	97	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-78.9	-36.2	-179.5	-71.1	-98.8	0	0	0	111.5	Y14 I16 F31 L62 I64 L88 V161 E162 D163 A169	Y14-F165 AromaticContact CD2-CD1 3.93Å; Y14-F165 HydrophobicContact CD2-CD1 3.93Å; Y14-F165 HydrophobicContact CD2-CE1 4.47Å; Y14-F165 HydrophobicContact CE2-CD1 4.14Å; Y14-F165 PolarHBondContact OH-O 3.29Å; I16-F165 HydrophobicContact CD1-CE1 4.49Å; I16-F165 HydrophobicContact CD1-CZ 4.21Å; F31-F165 HydrophobicContact CB-CD2 4.02Å; F31-F165 HydrophobicContact CB-CE2 3.69Å; F31-F165 HydrophobicContact CB-CZ 4.04Å; F31-F165 AromaticContact CD1-CD1 3.88Å; F31-F165 HydrophobicContact CD1-CD1 3.88Å; F31-F165 HydrophobicContact CD1-CD2 4.2Å; F31-F165 HydrophobicContact CD1-CE1 4.04Å; F31-F165 HydrophobicContact CD1-CE2 4.34Å; F31-F165 AromaticContact CD1-CG 3.96Å; F31-F165 HydrophobicContact CD1-CG 3.96Å; F31-F165 HydrophobicContact CD1-CZ 4.26Å; F31-F165 HydrophobicContact CD2-CB 4Å; F31-F165 AromaticContact CD2-CD2 3.62Å; F31-F165 HydrophobicContact CD2-CD2 3.62Å; F31-F165 HydrophobicContact CD2-CE2 4.2Å; F31-F165 AromaticContact CD2-CG 3.81Å; F31-F165 HydrophobicContact CD2-CG 3.81Å; F31-F165 HydrophobicContact CE1-CB 4.18Å; F31-F165 AromaticContact CE1-CD1 3.91Å; F31-F165 HydrophobicContact CE1-CD1 3.91Å; F31-F165 HydrophobicContact CE1-CE1 4.48Å; F31-F165 AromaticContact CE1-CG 3.99Å; F31-F165 HydrophobicContact CE1-CG 3.99Å; F31-F165 HydrophobicContact CE2-CB 3.56Å; F31-F165 HydrophobicContact CE2-CD2 4.11Å; F31-F165 AromaticContact CE2-CG 3.86Å; F31-F165 HydrophobicContact CE2-CG 3.86Å; F31-F165 HydrophobicContact CG-CB 4.48Å; F31-F165 HydrophobicContact CG-CD1 4.2Å; F31-F165 AromaticContact CG-CD2 3.67Å; F31-F165 HydrophobicContact CG-CD2 3.67Å; F31-F165 HydrophobicContact CG-CE1 4.35Å; F31-F165 AromaticContact CG-CE2 3.83Å; F31-F165 HydrophobicContact CG-CE2 3.83Å; F31-F165 AromaticContact CG-CG 3.86Å; F31-F165 HydrophobicContact CG-CG 3.86Å; F31-F165 HydrophobicContact CG-CZ 4.16Å; F31-F165 HydrophobicContact CZ-CB 3.66Å; F31-F165 HydrophobicContact CZ-CD1 4.27Å; F31-F165 AromaticContact CZ-CG 3.94Å; F31-F165 HydrophobicContact CZ-CG 3.94Å; L62-F165 HydrophobicContact CD1-CB 4.17Å; L62-F165 HydrophobicContact CD1-CD1 4.33Å; I64-F165 HydrophobicContact CD1-CD1 3.82Å; I64-F165 HydrophobicContact CD1-CE1 3.57Å; I64-F165 HydrophobicContact CG1-CD1 4.4Å; I64-F165 HydrophobicContact CG1-CE1 4.12Å; I64-F165 HydrophobicContact CG2-CE1 4.07Å; L88-F165 HydrophobicContact CD2-CD1 3.76Å; L88-F165 HydrophobicContact CD2-CD2 4.09Å; L88-F165 HydrophobicContact CD2-CE1 3.37Å; L88-F165 HydrophobicContact CD2-CE2 3.77Å; L88-F165 HydrophobicContact CD2-CG 4.1Å; L88-F165 HydrophobicContact CD2-CZ 3.4Å; V161-F165 HydrophobicContact CG1-CE2 4.34Å; V161-F165 VanDerWaalsContact O-CD2 3.24Å; V161-F165 WeakPolarHBondContact O-CD2 3.31Å; E162-F165 PolarHBondContact O-N 3.02Å; D163-F165 VanDerWaalsContact C-N 3.32Å; D163-F165 PolarHBondContact O-N 3.33Å; F165-A169 WeakPolarHBondContact O-CB 3.44Å; F165-A169 PolarHBondContact O-N 3.12Å; F165-A169 VanDerWaalsContact O-N 3.17Å
166	L	97.9	Very high	96.7	Very high	30 Å²	30	43.9 Å²	43.9	16%	0.157	22%	0.22	C	C	.	.	H	α-helix	trans	-72.9	-40.7	-177.7	-90.6	62	0	0	0	112.4	F31 I53 E162 D163 A169 K170	F31-L166 HydrophobicContact CE2-CD1 4.05Å; F31-L166 HydrophobicContact CZ-CD1 4.45Å; I53-L166 HydrophobicContact CB-CD1 4.46Å; I53-L166 HydrophobicContact CD1-CD1 4.1Å; I53-L166 HydrophobicContact CD1-CG 4.36Å; I53-L166 HydrophobicContact CG2-CD1 4.07Å; E162-L166 HydrophobicContact CG-CD1 3.96Å; E162-L166 HydrophobicContact CG-CD2 4.05Å; E162-L166 VanDerWaalsContact O-CD1 3.29Å; E162-L166 WeakPolarHBondContact O-CD1 3.22Å; E162-L166 PolarHBondContact O-N 3Å; D163-L166 PolarHBondContact O-N 2.99Å; L166-A169 WeakPolarHBondContact O-CB 3.3Å; L166-A169 PolarHBondContact O-N 3.25Å; L166-A169 VanDerWaalsContact O-N 3.09Å; L166-K170 WeakPolarHBondContact O-CB 3.28Å; L166-K170 VanDerWaalsContact O-CG 3.28Å; L166-K170 WeakPolarHBondContact O-CG 3.18Å; L166-K170 PolarHBondContact O-N 3.14Å
167	E	97.8	Very high	96.4	Very high	73 Å²	73	43.7 Å²	43.7	34%	0.341	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-43.6	177.6	-72.6	-53.9	127.7	0	0	111.7	L149 D163 A169 K170 K171	L149-E167 HydrophobicContact CD1-CB 4.48Å; D163-E167 WeakPolarHBondContact O-CB 3.48Å; D163-E167 VanDerWaalsContact O-CG 3.31Å; D163-E167 WeakPolarHBondContact O-CG 3.4Å; D163-E167 PolarHBondContact O-N 3.09Å; E167-A169 VanDerWaalsContact C-N 3.25Å; E167-A169 PolarHBondContact O-N 3.33Å; E167-K170 PolarHBondContact O-N 3.31Å; E167-K170 WeakPolarHBondContact OE1-CD 3.45Å; E167-K170 IonicContact OE1-NZ 3.23Å; E167-K170 PolarHBondContact OE1-NZ 3.32Å; E167-K171 PolarHBondContact O-N 3.16Å
168	A	97.9	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-40.5	171.3	0	0	0	0	0	111.4	Y14 V118 I120 K171 I172	Y14-A168 HydrophobicContact CE2-CB 4.11Å; Y14-A168 WeakPolarHBondContact OH-CB 3.38Å; V118-A168 HydrophobicContact CG1-CB 4.39Å; I120-A168 HydrophobicContact CG2-CB 4.26Å; A168-K171 PolarHBondContact O-N 3.04Å; A168-I172 WeakPolarHBondContact O-CD1 3.42Å; A168-I172 VanDerWaalsContact O-CG1 3.25Å; A168-I172 WeakPolarHBondContact O-CG1 3.48Å; A168-I172 PolarHBondContact O-N 3.47Å
169	A	97.5	Very high	95.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.5	-40.4	-177.3	0	0	0	0	0	111.8	F12 Y14 I53 V55 F165 L166 E167 K171 I172 Y173	F12-A169 HydrophobicContact CD2-CB 4.37Å; F12-A169 HydrophobicContact CE2-CB 4.39Å; Y14-A169 WeakPolarHBondContact OH-CA 3.47Å; Y14-A169 VanDerWaalsContact OH-CB 3.29Å; Y14-A169 WeakPolarHBondContact OH-CB 3.29Å; Y14-A169 PolarHBondContact OH-N 2.73Å; I53-A169 HydrophobicContact CD1-CB 3.55Å; V55-A169 HydrophobicContact CG2-CB 3.95Å; F165-A169 WeakPolarHBondContact O-CB 3.44Å; F165-A169 PolarHBondContact O-N 3.12Å; F165-A169 VanDerWaalsContact O-N 3.17Å; L166-A169 WeakPolarHBondContact O-CB 3.3Å; L166-A169 PolarHBondContact O-N 3.25Å; L166-A169 VanDerWaalsContact O-N 3.09Å; E167-A169 VanDerWaalsContact C-N 3.25Å; E167-A169 PolarHBondContact O-N 3.33Å; A169-K171 VanDerWaalsContact C-N 3.33Å; A169-K171 PolarHBondContact O-N 3.43Å; A169-I172 PolarHBondContact O-N 3.44Å; A169-Y173 VanDerWaalsContact O-CB 3.31Å; A169-Y173 WeakPolarHBondContact O-CB 3.16Å; A169-Y173 PolarHBondContact O-N 2.95Å
170	K	97.5	Very high	94.7	Very high	88 Å²	88	44.1 Å²	44.1	38%	0.383	24%	0.235	S	C	.	.	H	α-helix	trans	-57.2	-47.3	172.6	-73.1	169.1	-170.3	173.6	0	110.6	V55 L166 E167 Y173 Q174	V55-K170 HydrophobicContact CG1-CB 4.34Å; V55-K170 HydrophobicContact CG1-CG 3.79Å; V55-K170 HydrophobicContact CG2-CG 4.49Å; L166-K170 WeakPolarHBondContact O-CB 3.28Å; L166-K170 VanDerWaalsContact O-CG 3.28Å; L166-K170 WeakPolarHBondContact O-CG 3.18Å; L166-K170 PolarHBondContact O-N 3.14Å; E167-K170 PolarHBondContact O-N 3.31Å; E167-K170 WeakPolarHBondContact OE1-CD 3.45Å; E167-K170 IonicContact OE1-NZ 3.23Å; E167-K170 PolarHBondContact OE1-NZ 3.32Å; K170-Y173 PolarHBondContact O-N 3.22Å; K170-Q174 WeakPolarHBondContact O-CB 3.36Å; K170-Q174 PolarHBondContact O-N 2.86Å
171	K	96.7	Very high	93.8	Very high	74 Å²	74	41.9 Å²	41.9	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-66.7	-42.2	-179.7	-175.5	56.2	176.7	163.5	0	112.6	V118 L149 E167 A168 A169 Y173 Q174 N175	V118-K171 HydrophobicContact CG1-CB 3.99Å; V118-K171 HydrophobicContact CG1-CG 3.93Å; V118-K171 HydrophobicContact CG2-CB 4.18Å; V118-K171 HydrophobicContact CG2-CG 3.72Å; L149-K171 HydrophobicContact CD1-CB 4.09Å; E167-K171 PolarHBondContact O-N 3.16Å; A168-K171 PolarHBondContact O-N 3.04Å; A169-K171 VanDerWaalsContact C-N 3.33Å; A169-K171 PolarHBondContact O-N 3.43Å; K171-Y173 VanDerWaalsContact C-N 3.35Å; K171-Q174 PolarHBondContact O-N 2.92Å; K171-N175 WeakPolarHBondContact CE-OD1 3.27Å; K171-N175 PolarHBondContact NZ-OD1 3.43Å; K171-N175 VanDerWaalsContact O-CG 3.23Å; K171-N175 PolarHBondContact O-N 3.48Å; K171-N175 PolarHBondContact O-OD1 3.02Å
172	I	95.6	Very high	92.8	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-46.2	174.3	-66.1	162.3	0	0	0	110.1	F12 Y14 A85 V118 A168 A169 Q174 N175 I176 L181 V190	F12-I172 HydrophobicContact CD1-CG2 4.16Å; F12-I172 HydrophobicContact CD2-CB 4.1Å; F12-I172 HydrophobicContact CD2-CD1 4.12Å; F12-I172 HydrophobicContact CD2-CG2 3.85Å; F12-I172 HydrophobicContact CE1-CG2 3.91Å; F12-I172 HydrophobicContact CE2-CB 3.75Å; F12-I172 HydrophobicContact CE2-CG2 3.54Å; F12-I172 HydrophobicContact CG-CG2 4.17Å; F12-I172 HydrophobicContact CZ-CB 4.23Å; F12-I172 HydrophobicContact CZ-CG2 3.59Å; Y14-I172 HydrophobicContact CD1-CD1 4.45Å; Y14-I172 HydrophobicContact CE1-CD1 3.44Å; Y14-I172 VanDerWaalsContact CE1-CD1 3.44Å; A85-I172 HydrophobicContact CB-CD1 4.02Å; A85-I172 HydrophobicContact CB-CG2 4.35Å; A85-I172 WeakPolarHBondContact O-CD1 3.42Å; V118-I172 HydrophobicContact CB-CD1 4.28Å; V118-I172 HydrophobicContact CB-CG1 3.71Å; V118-I172 HydrophobicContact CG2-CB 4.46Å; V118-I172 HydrophobicContact CG2-CG1 3.48Å; V118-I172 VanDerWaalsContact CG2-CG1 3.48Å; A168-I172 WeakPolarHBondContact O-CD1 3.42Å; A168-I172 VanDerWaalsContact O-CG1 3.25Å; A168-I172 WeakPolarHBondContact O-CG1 3.48Å; A168-I172 PolarHBondContact O-N 3.47Å; A169-I172 PolarHBondContact O-N 3.44Å; I172-Q174 VanDerWaalsContact C-N 3.34Å; I172-Q174 PolarHBondContact O-N 2.93Å; I172-N175 WeakPolarHBondContact O-CB 3.38Å; I172-N175 PolarHBondContact O-N 2.82Å; I172-I176 HydrophobicContact CG2-CD1 4.4Å; I172-I176 WeakPolarHBondContact O-CG1 3.22Å; I172-I176 PolarHBondContact O-N 3.07Å; I172-L181 HydrophobicContact CG2-CD1 4.14Å; I172-V190 HydrophobicContact CG2-CG2 3.85Å
173	Y	95	Very high	91.8	Very high	22 Å²	22	46.8 Å²	46.8	9%	0.086	25%	0.25	C	S	.	.	H	α-helix	trans	-62.6	-41	178.7	-176.4	-107.2	0	0	0	112.2	Y10 V55 Q58 I60 A169 K170 K171 N175 I176 Q177	Y10-Y173 HydrophobicContact CD2-CE2 4.38Å; Y10-Y173 HydrophobicContact CE2-CD2 4.31Å; Y10-Y173 AromaticContact CE2-CE2 3.77Å; Y10-Y173 HydrophobicContact CE2-CE2 3.77Å; V55-Y173 HydrophobicContact CG1-CD1 4.24Å; V55-Y173 HydrophobicContact CG1-CG 4.38Å; Q58-Y173 HydrophobicContact CB-CE2 4.27Å; Q58-Y173 HydrophobicContact CG-CE2 3.78Å; Q58-Y173 VanDerWaalsContact CG-OH 3.3Å; Q58-Y173 WeakPolarHBondContact CG-OH 3.42Å; I60-Y173 HydrophobicContact CD1-CD2 4.41Å; A169-Y173 VanDerWaalsContact O-CB 3.31Å; A169-Y173 WeakPolarHBondContact O-CB 3.16Å; A169-Y173 PolarHBondContact O-N 2.95Å; K170-Y173 PolarHBondContact O-N 3.22Å; K171-Y173 VanDerWaalsContact C-N 3.35Å; Y173-N175 PolarHBondContact O-N 2.81Å; Y173-I176 WeakPolarHBondContact O-CB 3.05Å; Y173-I176 PolarHBondContact O-N 3.18Å; Y173-I176 VanDerWaalsContact O-N 3.15Å; Y173-Q177 HydrophobicContact CD1-CG 4.19Å; Y173-Q177 HydrophobicContact CE1-CG 3.77Å; Y173-Q177 HydrophobicContact CE2-CG 4.49Å; Y173-Q177 WeakPolarHBondContact O-CG 3.24Å; Y173-Q177 PolarHBondContact O-N 3.43Å; Y173-Q177 PolarHBondContact OH-NE2 3.31Å
174	Q	94.4	Very high	90.6	Very high	96 Å²	96	50.8 Å²	50.8	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-47.1	173	-174.9	-178.7	12.4	0	0	111.3	K170 K171 I172 I176 Q177 D178	K170-Q174 WeakPolarHBondContact O-CB 3.36Å; K170-Q174 PolarHBondContact O-N 2.86Å; K171-Q174 PolarHBondContact O-N 2.92Å; I172-Q174 VanDerWaalsContact C-N 3.34Å; I172-Q174 PolarHBondContact O-N 2.93Å; Q174-I176 PolarHBondContact O-N 3.21Å; Q174-Q177 PolarHBondContact O-N 3.23Å; Q174-D178 VanDerWaalsContact O-CG 3.3Å; Q174-D178 PolarHBondContact O-N 2.59Å
175	N	92.8	Very high	89.4	Confident	20 Å²	20	52.5 Å²	52.5	11%	0.107	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-31.6	177.2	-69.7	-0.6	0	0	0	112.5	K171 I172 Y173 S180 L181	K171-N175 WeakPolarHBondContact CE-OD1 3.27Å; K171-N175 PolarHBondContact NZ-OD1 3.43Å; K171-N175 VanDerWaalsContact O-CG 3.23Å; K171-N175 PolarHBondContact O-N 3.48Å; K171-N175 PolarHBondContact O-OD1 3.02Å; I172-N175 WeakPolarHBondContact O-CB 3.38Å; I172-N175 PolarHBondContact O-N 2.82Å; Y173-N175 PolarHBondContact O-N 2.81Å; N175-S180 VanDerWaalsContact C-OG 3.32Å; N175-S180 VanDerWaalsContact CA-OG 3.25Å; N175-S180 WeakPolarHBondContact CA-OG 3Å; N175-S180 VanDerWaalsContact CB-OG 3.25Å; N175-S180 WeakPolarHBondContact CB-OG 3.08Å; N175-S180 PolarHBondContact O-N 3.04Å; N175-S180 PolarHBondContact O-OG 3.13Å; N175-L181 HydrophobicContact CB-CD1 3.54Å; N175-L181 HydrophobicContact CB-CG 3.98Å; N175-L181 PolarHBondContact O-N 2.96Å
176	I	90.8	Very high	88	Confident	14 Å²	14	57.2 Å²	57.2	7%	0.072	33%	0.325	C	S	.	.	H	α-helix	trans	-68.1	-47.6	171.8	-62.3	167.4	0	0	0	110.7	Y10 F12 I172 Y173 Q174 D178 G179 L181 L183 V190	Y10-I176 HydrophobicContact CD1-CD1 4.25Å; Y10-I176 HydrophobicContact CE1-CD1 4.22Å; Y10-I176 HydrophobicContact CE1-CG2 4.47Å; F12-I176 HydrophobicContact CE1-CD1 3.67Å; F12-I176 HydrophobicContact CZ-CD1 3.73Å; I172-I176 HydrophobicContact CG2-CD1 4.4Å; I172-I176 WeakPolarHBondContact O-CG1 3.22Å; I172-I176 PolarHBondContact O-N 3.07Å; Y173-I176 WeakPolarHBondContact O-CB 3.05Å; Y173-I176 PolarHBondContact O-N 3.18Å; Y173-I176 VanDerWaalsContact O-N 3.15Å; Q174-I176 PolarHBondContact O-N 3.21Å; I176-D178 VanDerWaalsContact C-N 3.28Å; I176-D178 PolarHBondContact O-N 2.95Å; I176-G179 PolarHBondContact O-N 3.44Å; I176-G179 VanDerWaalsContact O-N 3.1Å; I176-L181 HydrophobicContact CG1-CB 4.23Å; I176-L181 HydrophobicContact CG1-CD1 3.73Å; I176-L183 HydrophobicContact CD1-CD2 4.15Å; I176-L183 HydrophobicContact CG1-CD2 3.99Å; I176-L183 HydrophobicContact CG2-CD1 3.96Å; I176-L183 HydrophobicContact CG2-CD2 3.99Å; I176-L183 HydrophobicContact CG2-CG 4.3Å; I176-V190 HydrophobicContact CD1-CG1 3.72Å; I176-V190 HydrophobicContact CD1-CG2 4.24Å
177	Q	90.5	Very high	86.9	Confident	111 Å²	111	60.8 Å²	60.8	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-37.1	-179.3	-65	-56.2	-74.9	0	0	112	Y173 Q174 G179	Y173-Q177 HydrophobicContact CD1-CG 4.19Å; Y173-Q177 HydrophobicContact CE1-CG 3.77Å; Y173-Q177 HydrophobicContact CE2-CG 4.49Å; Y173-Q177 WeakPolarHBondContact O-CG 3.24Å; Y173-Q177 PolarHBondContact O-N 3.43Å; Y173-Q177 PolarHBondContact OH-NE2 3.31Å; Q174-Q177 PolarHBondContact O-N 3.23Å; Q177-G179 PolarHBondContact O-N 3.37Å
178	D	90.8	Very high	86.1	Confident	106 Å²	106	57.7 Å²	57.7	57%	0.567	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-3.2	178.5	-63.2	-17.5	0	0	0	112.6	Q174 I176 S180	Q174-D178 VanDerWaalsContact O-CG 3.3Å; Q174-D178 PolarHBondContact O-N 2.59Å; I176-D178 VanDerWaalsContact C-N 3.28Å; I176-D178 PolarHBondContact O-N 2.95Å; D178-S180 PolarHBondContact O-N 2.99Å
179	G	84.3	Confident	85.4	Confident	62 Å²	62	58.2 Å²	58.2	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	9.8	-178.1	0	0	0	0	0	114.4	I176 Q177 L181	I176-G179 PolarHBondContact O-N 3.44Å; I176-G179 VanDerWaalsContact O-N 3.1Å; Q177-G179 PolarHBondContact O-N 3.37Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.87Å
180	S	81.2	Confident	84.9	Confident	55 Å²	55	58.5 Å²	58.5	39%	0.385	34%	0.335	S	S	.	.			trans	-75.1	-15.2	178.9	70.2	0	0	0	0	113.6	N116 N175 D178	N116-S180 PolarHBondContact ND2-O 2.81Å; N116-S180 VanDerWaalsContact ND2-O 3.12Å; N175-S180 VanDerWaalsContact C-OG 3.32Å; N175-S180 VanDerWaalsContact CA-OG 3.25Å; N175-S180 WeakPolarHBondContact CA-OG 3Å; N175-S180 VanDerWaalsContact CB-OG 3.25Å; N175-S180 WeakPolarHBondContact CB-OG 3.08Å; N175-S180 PolarHBondContact O-N 3.04Å; N175-S180 PolarHBondContact O-OG 3.13Å; D178-S180 PolarHBondContact O-N 2.99Å
181	L	79.7	Confident	84.4	Confident	13 Å²	13	59.7 Å²	59.7	7%	0.068	34%	0.342	C	S	.	.	S	Bend	trans	-109.6	119.1	176.7	-81	167.5	0	0	0	110.9	N116 I172 N175 I176 G179 L183	N116-L181 HydrophobicContact CB-CD2 3.47Å; N116-L181 VanDerWaalsContact CB-CD2 3.47Å; N116-L181 HydrophobicContact CB-CG 4.33Å; I172-L181 HydrophobicContact CG2-CD1 4.14Å; N175-L181 HydrophobicContact CB-CD1 3.54Å; N175-L181 HydrophobicContact CB-CG 3.98Å; N175-L181 PolarHBondContact O-N 2.96Å; I176-L181 HydrophobicContact CG1-CB 4.23Å; I176-L181 HydrophobicContact CG1-CD1 3.73Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.87Å; L181-L183 PolarHBondContact O-N 3.08Å
182	D	75.9	Confident	83.9	Confident	93 Å²	93	60.5 Å²	60.5	50%	0.497	35%	0.346	S	S	.	.			trans	-74.6	107	168.6	-178.3	8.1	0	0	0	110.2	N184 A185 S188	D182-N184 PolarHBondContact O-N 2.83Å; D182-N184 WeakPolarHBondContact OD1-CB 3.44Å; D182-N184 PolarHBondContact OD1-N 2.7Å; D182-A185 HydrophobicContact CB-CB 4.12Å; D182-A185 PolarHBondContact O-N 2.87Å; D182-S188 WeakPolarHBondContact O-CB 3.39Å
183	L	76.4	Confident	83.1	Confident	56 Å²	56	65 Å²	65	29%	0.293	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.9	179	-63.5	-179.6	0	0	0	113.5	I176 L181 V190 H192	I176-L183 HydrophobicContact CD1-CD2 4.15Å; I176-L183 HydrophobicContact CG1-CD2 3.99Å; I176-L183 HydrophobicContact CG2-CD1 3.96Å; I176-L183 HydrophobicContact CG2-CD2 3.99Å; I176-L183 HydrophobicContact CG2-CG 4.3Å; L181-L183 PolarHBondContact O-N 3.08Å; L183-V190 HydrophobicContact CD2-CB 4.12Å; L183-V190 HydrophobicContact CD2-CG1 3.55Å; L183-H192 HydrophobicContact CD1-CB 4.43Å
184	N	73	Confident	81.5	Confident	153 Å²	153	68.8 Å²	68.8	82%	0.818	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.7	177.4	-60.2	-51.5	0	0	0	112.1	D182 A186	D182-N184 PolarHBondContact O-N 2.83Å; D182-N184 WeakPolarHBondContact OD1-CB 3.44Å; D182-N184 PolarHBondContact OD1-N 2.7Å; N184-A186 PolarHBondContact O-N 3.35Å
185	A	73.3	Confident	79.8	Confident	36 Å²	36	68.5 Å²	68.5	30%	0.298	40%	0.402	S	S	.	.			trans	-73	114.7	174.5	0	0	0	0	0	109.8	D182 E187 S188	D182-A185 HydrophobicContact CB-CB 4.12Å; D182-A185 PolarHBondContact O-N 2.87Å; A185-E187 PolarHBondContact O-N 2.9Å; A185-S188 WeakPolarHBondContact O-CB 3.42Å; A185-S188 PolarHBondContact O-N 2.72Å; A185-S188 PolarHBondContact O-OG 2.86Å
186	A	68.4	Low	77.8	Confident	99 Å²	99	71.4 Å²	71.4	82%	0.818	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-56	-21.5	175.5	0	0	0	0	0	113	N184	N184-A186 PolarHBondContact O-N 3.35Å
187	E	76.5	Confident	75.5	Confident	104 Å²	104	76.5 Å²	76.5	49%	0.486	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-85.9	-6.8	-179.2	-52.6	-163.7	146.5	0	0	113.7	R82 N114 A185 G189	R82-E187 IonicContact CZ-OE1 3.49Å; R82-E187 IonicContact NE-OE1 3.48Å; R82-E187 PolarHBondContact NE-OE1 3.01Å; R82-E187 IonicContact NH2-OE1 2.73Å; R82-E187 PolarHBondContact NH2-OE1 3.12Å; N114-E187 PolarHBondContact ND2-O 2.89Å; A185-E187 PolarHBondContact O-N 2.9Å; E187-G189 PolarHBondContact O-N 2.95Å
188	S	80.5	Confident	73.3	Confident	8 Å²	8	79.7 Å²	79.7	6%	0.056	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-65	-25	177.8	67	0	0	0	0	113	N114 D182 A185 V190	N114-S188 VanDerWaalsContact ND2-C 3.28Å; N114-S188 VanDerWaalsContact ND2-CA 3.32Å; N114-S188 WeakPolarHBondContact ND2-CA 3.34Å; N114-S188 PolarHBondContact ND2-O 3.45Å; D182-S188 WeakPolarHBondContact O-CB 3.39Å; A185-S188 WeakPolarHBondContact O-CB 3.42Å; A185-S188 PolarHBondContact O-N 2.72Å; A185-S188 PolarHBondContact O-OG 2.86Å; S188-V190 PolarHBondContact O-N 3.39Å; S188-V190 PolarHBondContact OG-N 2.64Å; S188-V190 PolarHBondContact OG-O 2.7Å
189	G	82.7	Confident	70.6	Confident	12 Å²	12	77.9 Å²	77.9	12%	0.124	48%	0.484	C	S	.	.	S	Bend	trans	72.1	6.4	-173	0	0	0	0	0	114.8	K13 G83 E187	K13-G189 PolarHBondContact N-O 2.61Å; G83-G189 WeakPolarHBondContact O-CA 3.3Å; E187-G189 PolarHBondContact O-N 2.95Å
190	V	86.7	Confident	68.4	Low	6 Å²	6	78.4 Å²	78.4	4%	0.036	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.4	176.6	177.1	0	0	0	0	108.8	Y10 I11 F12 A85 I172 I176 L183 S188	Y10-V190 HydrophobicContact CD1-CG1 4.02Å; I11-V190 WeakPolarHBondContact O-CA 3.2Å; F12-V190 HydrophobicContact CD1-CB 4.27Å; F12-V190 HydrophobicContact CD1-CG1 3.94Å; F12-V190 HydrophobicContact CD1-CG2 3.78Å; F12-V190 HydrophobicContact CE1-CB 4.35Å; F12-V190 HydrophobicContact CE1-CG1 3.67Å; F12-V190 HydrophobicContact CE1-CG2 3.88Å; A85-V190 HydrophobicContact CB-CG2 3.9Å; I172-V190 HydrophobicContact CG2-CG2 3.85Å; I176-V190 HydrophobicContact CD1-CG1 3.72Å; I176-V190 HydrophobicContact CD1-CG2 4.24Å; L183-V190 HydrophobicContact CD2-CB 4.12Å; L183-V190 HydrophobicContact CD2-CG1 3.55Å; S188-V190 PolarHBondContact O-N 3.39Å; S188-V190 PolarHBondContact OG-N 2.64Å; S188-V190 PolarHBondContact OG-O 2.7Å
191	Q	87.6	Confident	66.3	Low	113 Å²	113	86.6 Å²	86.6	53%	0.528	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.5	168.9	-55.2	176.8	10.6	0	0	109.1	Y10 I11	Y10-Q191 CarbonylContact C-O 3.58Å; Y10-Q191 VanDerWaalsContact CA-O 3.28Å; Y10-Q191 WeakPolarHBondContact CA-O 3.37Å; I11-Q191 HydrophobicContact CB-CB 4.11Å; I11-Q191 HydrophobicContact CD1-CB 4.49Å; I11-Q191 HydrophobicContact CG1-CB 4.47Å; I11-Q191 PolarHBondContact N-O 2.74Å; I11-Q191 PolarHBondContact O-N 3.18Å
192	H	86.3	Confident	64.4	Low	91 Å²	91	94.2 Å²	94.2	42%	0.421	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.6	123.8	169.7	-179.6	-123.2	0	0	0	109.4	S9 Y10 L183 P194	S9-H192 PolarHBondContact O-CD2 3.15Å; Y10-H192 HydrophobicContact CD1-CB 4.16Å; Y10-H192 AromaticContact CD1-CD2 3.94Å; Y10-H192 HydrophobicContact CE1-CB 3.97Å; Y10-H192 AromaticContact CE1-CD2 3.4Å; Y10-H192 WeakPolarHBondContact CE1-CD2 3.2Å; Y10-H192 AromaticContact CE1-CG 3.95Å; Y10-H192 AromaticContact CZ-CD2 3.59Å; L183-H192 HydrophobicContact CD1-CB 4.43Å; H192-P194 WeakPolarHBondContact O-CD 3.46Å
193	K	78.5	Confident	62.6	Low	94 Å²	94	95.6 Å²	95.6	41%	0.409	56%	0.564	S	S	.	*			trans	-95.5	111.9	168.5	-73.3	-167.6	172.5	-173.6	0	107.8	Y8 S9 S195	Y8-K193 HydrophobicContact CD2-CD 4.27Å; Y8-K193 HydrophobicContact CE2-CD 3.6Å; Y8-K193 HydrophobicContact CE2-CG 4.4Å; Y8-K193 PolarHBondContact OH-NZ 3.48Å; S9-K193 PolarHBondContact O-N 3.41Å; K193-S195 PolarHBondContact O-N 3.21Å; K193-S195 VanDerWaalsContact O-N 3.11Å
194	P	61.9	Low	60.7	Low	103 Å²	103	98.2 Å²	98.2	67%	0.669	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.4	165.5	-15.3	28.4	0	0	0	107.1	H192 A196	H192-P194 WeakPolarHBondContact O-CD 3.46Å; P194-A196 PolarHBondContact O-N 3.03Å
195	S	57.9	Low	59	Low	90 Å²	90	99.4 Å²	99.4	63%	0.629	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-54.2	117.3	167.1	29	0	0	0	0	106.9	K193	K193-S195 PolarHBondContact O-N 3.21Å; K193-S195 VanDerWaalsContact O-N 3.11Å
196	A	51.6	Low	57.4	Low	81 Å²	81	103.5 Å²	103.5	67%	0.669	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-51.1	130.5	174.8	0	0	0	0	0	107.7	P194 Q198	P194-A196 PolarHBondContact O-N 3.03Å; A196-Q198 PolarHBondContact O-N 3.11Å
197	P	42.6	Very low	56	Low	121 Å²	121	107.5 Å²	107.5	79%	0.786	61%	0.613	S	S	*	*			trans	-56.7	113.2	-177.9	18.1	-28.3	0	0	0	108.7	G199	P197-G199 PolarHBondContact O-N 3.42Å
198	Q	42.9	Very low	54.3	Low	177 Å²	177	108.3 Å²	108.3	83%	0.827	63%	0.627	S	S	*	*	S	Bend	trans	-63.1	109.2	170.8	-75.3	-177.9	6.9	0	0	107.2	A196	A196-Q198 PolarHBondContact O-N 3.11Å
199	G	35.5	Very low	52.4	Low	68 Å²	68	117 Å²	117	70%	0.701	67%	0.667	S	S	*	*			trans	85.7	69.9	167.6	0	0	0	0	0	114.8	P197 R201	P197-G199 PolarHBondContact O-N 3.42Å; G199-R201 PolarHBondContact O-N 2.84Å
200	G	36.8	Very low	50.5	Low	74 Å²	74	128.2 Å²	128.2	76%	0.763	71%	0.705	S	S	*	*			trans	-62.8	88.8	142.4	0	0	0	0	0	108	L202	G200-L202 PolarHBondContact O-N 3.22Å; G200-L202 VanDerWaalsContact O-N 3.15Å
201	R	37.9	Very low	48.4	Very low	227 Å²	227	137.1 Å²	137.1	86%	0.857	75%	0.746	S	S	*	*			trans	-51.7	117.7	171.8	-160	174.5	-169	177.2	1.9	106.6	G199 T203	G199-R201 PolarHBondContact O-N 2.84Å; R201-T203 VanDerWaalsContact C-N 3.31Å; R201-T203 PolarHBondContact O-N 2.7Å
202	L	40	Very low	46	Very low	173 Å²	173	135.5 Å²	135.5	91%	0.906	76%	0.76	S	S	*	*			trans	-52.9	100.3	169.7	-74.9	159.6	0	0	0	107.2	G200 S204	G200-L202 PolarHBondContact O-N 3.22Å; G200-L202 VanDerWaalsContact O-N 3.15Å; L202-S204 PolarHBondContact O-N 2.98Å; L202-S204 VanDerWaalsContact O-N 3.08Å
203	T	38.1	Very low	43.7	Very low	122 Å²	122	137 Å²	137	75%	0.748	78%	0.779	S	S	*	*			trans	-67.2	105.7	166.9	43.6	0	0	0	0	105.5	R201 E205	R201-T203 VanDerWaalsContact C-N 3.31Å; R201-T203 PolarHBondContact O-N 2.7Å; T203-E205 VanDerWaalsContact C-N 3.33Å; T203-E205 PolarHBondContact O-N 3.24Å
204	S	36.6	Very low	41.9	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	80%	0.798	S	S	*	*			trans	-55.7	99.9	164.1	50.8	0	0	0	0	107.6	L202	L202-S204 PolarHBondContact O-N 2.98Å; L202-S204 VanDerWaalsContact O-N 3.08Å
205	E	37.4	Very low	41.5	Very low	177 Å²	177	140.6 Å²	140.6	83%	0.827	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-64.3	133	170.5	-78.3	-178.1	135	0	0	108.9	T203	T203-E205 VanDerWaalsContact C-N 3.33Å; T203-E205 PolarHBondContact O-N 3.24Å
206	P	39.7	Very low	40.7	Very low	122 Å²	122	143.2 Å²	143.2	79%	0.792	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73	135	-176.8	-9.2	25.3	0	0	0	110.7
207	Q	39	Very low	40.2	Very low	184 Å²	184	146.4 Å²	146.4	86%	0.86	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-57	130.5	169.3	-75.9	175.3	-17.3	0	0	110.7	Q209	Q207-Q209 PolarHBondContact O-N 3.11Å
208	P	39.8	Very low	40	Very low	121 Å²	121	147.8 Å²	147.8	79%	0.786	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-71.2	122.6	173	26.3	-29.7	0	0	0	110.1	R210	P208-R210 PolarHBondContact O-N 3.05Å
209	Q	40.9	Very low	39.9	Very low	191 Å²	191	146.1 Å²	146.1	89%	0.893	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-61.1	123.9	169.7	-77.1	174.9	-15	0	0	109.1	Q207 E211	Q207-Q209 PolarHBondContact O-N 3.11Å; Q209-E211 PolarHBondContact O-N 2.86Å
210	R	43.6	Very low	40.1	Very low	247 Å²	247	151 Å²	151	93%	0.932	86%	0.863	S	S	*	*			trans	-65.8	111.3	176.2	-73.8	177.4	170.3	-177	-4	109.7	P208	P208-R210 PolarHBondContact O-N 3.05Å
211	E	42.4	Very low	40.4	Very low	192 Å²	192	156.1 Å²	156.1	90%	0.897	87%	0.869	S	S	*	*			trans	-70.3	136	159.6	-78.8	-176.8	149.7	0	0	110	Q209	Q209-E211 PolarHBondContact O-N 2.86Å
212	G	37.8	Very low	40.5	Very low	79 Å²	79	151.1 Å²	151.1	81%	0.814	87%	0.87	S	S	*	*			trans	-72.9	146.9	178.6	0	0	0	0	0	112.5
213	C	36.8	Very low	40.6	Very low	122 Å²	122	149.4 Å²	149.4	82%	0.824	87%	0.868	S	S	*	*			trans	-132.4	100.5	156.3	-169.1	0	0	0	0	106
214	G	40.5	Very low	40.8	Very low	78 Å²	78	151.7 Å²	151.7	80%	0.804	88%	0.878	S	S	*	*			trans	-95.9	116.9	166.9	0	0	0	0	0	107.9
215	C	54.8	Low	41.2	Very low	196 Å²	196	155.4 Å²	155.4	100%	1.324	89%	0.887	S	S	*	*			trans	-125.5	0	156.4	-71	0	0	0	0	106.4

Retrieved 215 of 215 residues in 79.7 ms (Link to these results)

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