A0A077Z4U6_TRITR Loading...

Large ribosomal subunit protein uL14

AlphaFold DB , UniProt , Accession A0A077Z4U6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 aa.

						>A0A077Z4U6_TRITR|A0A077Z4U6
MSKRGRGGTSGSKFRISLGLPVGAVINCADNTGAKNLYIIAVYGVRGRLNRLPSAAVGDMVVASVKKGKPELRKKVMQAVVIRQRKPYRRKDGTFIYFEDNAGVIVNNKGEMKGSAITGPVAKECADLWPRVAANASSVA
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.5	Very low	59.3	Low	241 Å²	241	125.6 Å²	125.6	100%	1.187	70%	0.701	S	S	*	*				0	120.6	0	-74.5	-174.8	-118.6	0	0	109.1	K3	M1-K3 PolarHBondContact O-N 3.25Å
2	S	58.3	Low	61.3	Low	115 Å²	115	124.8 Å²	124.8	80%	0.804	71%	0.71	S	S	*	*			trans	-57.7	128.1	172.4	164.9	0	0	0	0	109.6	R4	S2-R4 PolarHBondContact O-N 2.93Å
3	K	56.5	Low	63.5	Low	201 Å²	201	119.8 Å²	119.8	87%	0.874	68%	0.675	S	S	*	*			trans	-59.3	105.3	172.7	-83.2	179.7	177.3	170.2	0	107	M1 G5	M1-K3 PolarHBondContact O-N 3.25Å; K3-G5 PolarHBondContact O-N 3.23Å
4	R	50.6	Low	65.4	Low	240 Å²	240	119.4 Å²	119.4	91%	0.906	66%	0.663	S	S	*	*			trans	-49.1	110.9	172.2	-81.9	-178.7	170.5	168.1	-2.5	107.6	S2 R6	S2-R4 PolarHBondContact O-N 2.93Å; R4-R6 PolarHBondContact O-N 3.36Å
5	G	51.6	Low	67.2	Low	68 Å²	68	126.9 Å²	126.9	70%	0.701	68%	0.677	S	S	*	*			trans	-52.3	124.2	-178.7	0	0	0	0	0	109.2	K3 G7	K3-G5 PolarHBondContact O-N 3.23Å; G5-G7 PolarHBondContact O-N 3.5Å
6	R	50.1	Low	68.9	Low	253 Å²	253	120 Å²	120	96%	0.955	64%	0.64	S	S	*	*	S	Bend	trans	-68.4	-10.8	-174.8	-107.5	177.8	168.1	167.6	-4.1	113.6	R4	R4-R6 PolarHBondContact O-N 3.36Å
7	G	57	Low	70.5	Confident	48 Å²	48	116.1 Å²	116.1	50%	0.495	62%	0.624	S	S	.	*	S	Bend	trans	-109.7	139	177.8	0	0	0	0	0	111.5	G5 T9	G5-G7 PolarHBondContact O-N 3.5Å; G7-T9 PolarHBondContact O-N 2.81Å
8	G	65.3	Low	72	Confident	37 Å²	37	115.3 Å²	115.3	38%	0.381	62%	0.619	S	S	.	*			trans	-82.3	9.9	179.4	0	0	0	0	0	115.1	K109	G8-K109 WeakPolarHBondContact CA-O 3.48Å; G8-K109 PolarHBondContact N-O 2.82Å
9	T	73	Confident	73.3	Confident	66 Å²	66	110.6 Å²	110.6	41%	0.405	60%	0.601	S	S	.	*			trans	-80.9	124.6	168.3	-170.2	0	0	0	0	110	G7 L128	G7-T9 PolarHBondContact O-N 2.81Å; T9-L128 CarbonylContact C-O 3.54Å; T9-L128 WeakPolarHBondContact CA-O 3.36Å
10	S	70.5	Confident	74.5	Confident	49 Å²	49	105.3 Å²	105.3	34%	0.343	57%	0.572	S	S	.	*			trans	-90.3	100.5	173.9	42.6	0	0	0	0	110.2	D127 L128 P130	S10-D127 PolarHBondContact OG-O 2.77Å; S10-L128 PolarHBondContact N-O 3.27Å; S10-L128 WeakPolarHBondContact O-CD2 3.35Å; S10-L128 PolarHBondContact OG-O 2.92Å; S10-L128 VanDerWaalsContact OG-O 3.08Å; S10-P130 WeakPolarHBondContact OG-CD 3.48Å
11	G	77.1	Confident	75.6	Confident	64 Å²	64	102.6 Å²	102.6	66%	0.66	56%	0.56	S	S	*	*	S	Bend	trans	88.9	-157.9	167.9	0	0	0	0	0	115.2
12	S	83.5	Confident	78.2	Confident	115 Å²	115	92.9 Å²	92.9	80%	0.804	51%	0.514	S	S	*	.			trans	-116.3	136.8	-175.7	55.7	0	0	0	0	111.1
13	K	89	Confident	80.1	Confident	60 Å²	60	88.9 Å²	88.9	26%	0.261	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-78.2	132.8	-179.9	179.3	174.1	162.3	-178.1	0	111.2	A56 V57 D59 L128	K13-A56 PolarHBondContact NZ-O 2.96Å; K13-V57 WeakPolarHBondContact CE-O 3.5Å; K13-V57 PolarHBondContact NZ-O 2.82Å; K13-D59 VanDerWaalsContact CD-OD1 3.25Å; K13-D59 WeakPolarHBondContact CD-OD1 3.13Å; K13-D59 IonicContact NZ-OD1 2.74Å; K13-D59 PolarHBondContact NZ-OD1 2.9Å; K13-D59 IonicContact NZ-OD2 2.79Å; K13-D59 PolarHBondContact NZ-OD2 2.9Å; K13-L128 HydrophobicContact CB-CD1 3.7Å; K13-L128 HydrophobicContact CB-CD2 4.37Å; K13-L128 HydrophobicContact CD-CD1 4.08Å; K13-L128 HydrophobicContact CG-CD1 3.92Å
14	F	91	Very high	82.1	Confident	114 Å²	114	80.3 Å²	80.3	50%	0.5	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-69.8	141.8	168.7	-171.7	-103.2	0	0	0	110.8	I16 K91	F14-I16 HydrophobicContact CD1-CG2 4.36Å; F14-I16 PolarHBondContact O-N 2.92Å; F14-K91 HydrophobicContact CD1-CG 4.36Å; F14-K91 VanDerWaalsContact CD2-CE 3.49Å; F14-K91 HydrophobicContact CD2-CG 4.45Å; F14-K91 HydrophobicContact CE1-CG 4.34Å; F14-K91 HydrophobicContact CE2-CG 4.42Å; F14-K91 HydrophobicContact CG-CG 4.41Å; F14-K91 HydrophobicContact CZ-CG 4.37Å
15	R	91.7	Very high	84.3	Confident	233 Å²	233	72.4 Å²	72.4	88%	0.879	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-68.4	119	-177.6	-171.1	178.1	-179.5	-173.8	-2	110.4
16	I	95.1	Very high	86.5	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.082	40%	0.403	C	S	.	.			trans	-124.6	165	176.9	57.6	171.2	0	0	0	110.7	F14 L18 A56 V57 Y88	F14-I16 HydrophobicContact CD1-CG2 4.36Å; F14-I16 PolarHBondContact O-N 2.92Å; I16-L18 PolarHBondContact O-N 3.16Å; I16-A56 HydrophobicContact CD1-CB 3.69Å; I16-A56 HydrophobicContact CG1-CB 3.67Å; I16-V57 HydrophobicContact CD1-CB 4.12Å; I16-Y88 HydrophobicContact CB-CD2 4.11Å; I16-Y88 HydrophobicContact CB-CG 4.26Å; I16-Y88 HydrophobicContact CD1-CD2 4.23Å; I16-Y88 HydrophobicContact CD1-CE2 4.4Å; I16-Y88 HydrophobicContact CD1-CG 4.39Å; I16-Y88 HydrophobicContact CG2-CD2 3.83Å; I16-Y88 HydrophobicContact CG2-CG 4.47Å
17	S	96.5	Very high	88.8	Confident	53 Å²	53	60.6 Å²	60.6	37%	0.371	38%	0.375	S	S	.	.			trans	-58.2	123.6	179	-58.3	0	0	0	0	111.5	G19 A56 Q84	S17-G19 PolarHBondContact O-N 3.22Å; S17-A56 WeakPolarHBondContact O-CB 3.34Å; S17-Q84 PolarHBondContact O-NE2 2.68Å; S17-Q84 PolarHBondContact O-OE1 3.21Å
18	L	96.5	Very high	90.8	Very high	103 Å²	103	59.2 Å²	59.2	54%	0.539	36%	0.358	S	S	.	.			trans	-74.6	118.2	175.2	-56.5	177.6	0	0	0	109.7	I16 A56	I16-L18 PolarHBondContact O-N 3.16Å; L18-A56 HydrophobicContact CD2-CB 3.9Å
19	G	96.3	Very high	92.3	Very high	26 Å²	26	57.7 Å²	57.7	27%	0.268	34%	0.341	S	S	.	.			trans	-109.6	-13.2	-176.6	0	0	0	0	0	114.6	S17 A55	S17-G19 PolarHBondContact O-N 3.22Å; G19-A55 PolarHBondContact N-O 3.16Å; G19-A55 VanDerWaalsContact N-O 3.11Å
20	L	98	Very high	93.4	Very high	3 Å²	3	55 Å²	55	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	87.6	-167.6	-60.9	175.1	0	0	0	111.2	A24 I26 I39 S54 A55 V81 N101	L20-A24 HydrophobicContact CD2-CB 4.32Å; L20-I26 HydrophobicContact CD1-CG2 4.08Å; L20-I26 HydrophobicContact CD2-CG2 3.75Å; L20-I39 HydrophobicContact CB-CD1 3.92Å; L20-I39 HydrophobicContact CD1-CD1 4.28Å; L20-S54 CarbonylContact O-C 3.46Å; L20-S54 WeakPolarHBondContact O-CA 3.5Å; L20-A55 HydrophobicContact CB-CB 4.34Å; L20-A55 PolarHBondContact N-O 3.48Å; L20-A55 PolarHBondContact O-N 3.49Å; L20-V81 HydrophobicContact CD1-CB 4.37Å; L20-V81 HydrophobicContact CD1-CG1 3.51Å; L20-V81 HydrophobicContact CD1-CG2 3.88Å; L20-N101 HydrophobicContact CD2-CB 3.96Å
21	P	97.8	Very high	94.5	Very high	50 Å²	50	56.9 Å²	56.9	33%	0.325	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	163.7	172.2	30.3	-35.1	0	0	0	111.5	G23 A24 L52 P53 S54	P21-G23 PolarHBondContact O-N 3.41Å; P21-A24 WeakPolarHBondContact O-CB 3.28Å; P21-A24 PolarHBondContact O-N 3.25Å; P21-A24 VanDerWaalsContact O-N 3.1Å; P21-L52 HydrophobicContact CB-CB 4.44Å; P21-L52 HydrophobicContact CB-CD1 4.5Å; P21-P53 WeakPolarHBondContact CA-O 3.5Å; P21-S54 WeakPolarHBondContact CA-OG 3.18Å
22	V	97.7	Very high	95.4	Very high	36 Å²	36	54.7 Å²	54.7	22%	0.218	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	141.8	163.9	-66.3	0	0	0	0	110.4	A24 I39 I40 L52 P53	V22-A24 VanDerWaalsContact C-N 3.33Å; V22-I39 HydrophobicContact CG1-CG2 4.49Å; V22-I40 VanDerWaalsContact CG1-O 3.25Å; V22-I40 WeakPolarHBondContact CG1-O 3.46Å; V22-L52 HydrophobicContact CG2-CB 4.11Å; V22-L52 HydrophobicContact CG2-CD2 3.96Å; V22-L52 HydrophobicContact CG2-CG 4.49Å; V22-P53 HydrophobicContact CG1-CB 4.04Å; V22-P53 HydrophobicContact CG1-CG 4.31Å; V22-P53 PolarHBondContact N-O 3.06Å
23	G	97.1	Very high	96	Very high	31 Å²	31	50.5 Å²	50.5	32%	0.32	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-14.9	-172.1	0	0	0	0	0	114.9	P21 V25 Y38 I39	P21-G23 PolarHBondContact O-N 3.41Å; G23-V25 PolarHBondContact O-N 3.29Å; G23-Y38 WeakPolarHBondContact CA-OH 3.35Å; G23-Y38 VanDerWaalsContact O-CE2 3.31Å; G23-Y38 WeakPolarHBondContact O-CE2 3.22Å; G23-I39 PolarHBondContact N-O 2.91Å
24	A	98.2	Very high	96.3	Very high	21 Å²	21	48 Å²	48	17%	0.174	27%	0.27	C	S	.	.			trans	-64.3	136.4	174.6	0	0	0	0	0	111.4	L20 P21 V22 I39	L20-A24 HydrophobicContact CD2-CB 4.32Å; P21-A24 WeakPolarHBondContact O-CB 3.28Å; P21-A24 PolarHBondContact O-N 3.25Å; P21-A24 VanDerWaalsContact O-N 3.1Å; V22-A24 VanDerWaalsContact C-N 3.33Å; A24-I39 HydrophobicContact CB-CD1 4.34Å; A24-I39 PolarHBondContact O-N 2.8Å
25	V	98	Very high	96.6	Very high	75 Å²	75	49.5 Å²	49.5	46%	0.455	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123	170.6	-179.7	0	0	0	0	108.3	G23 N36 L37 Y38	G23-V25 PolarHBondContact O-N 3.29Å; V25-N36 HydrophobicContact CG1-CB 3.87Å; V25-L37 CarbonylContact C-O 3.53Å; V25-L37 WeakPolarHBondContact CA-O 3.38Å; V25-Y38 HydrophobicContact CG2-CD2 3.71Å
26	I	98.1	Very high	96.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	159.5	178.9	68	176.6	0	0	0	110.6	L20 N36 L37 I39 N101	L20-I26 HydrophobicContact CD1-CG2 4.08Å; L20-I26 HydrophobicContact CD2-CG2 3.75Å; I26-N36 WeakPolarHBondContact O-CA 3.45Å; I26-L37 HydrophobicContact CG1-CB 3.86Å; I26-L37 PolarHBondContact N-O 2.95Å; I26-L37 PolarHBondContact O-N 2.98Å; I26-I39 HydrophobicContact CD1-CD1 4.3Å; I26-I39 HydrophobicContact CG2-CD1 4.35Å; I26-N101 HydrophobicContact CB-CB 4.07Å; I26-N101 HydrophobicContact CG2-CB 3.62Å
27	N	98.3	Very high	97	Very high	71 Å²	71	39.3 Å²	39.3	38%	0.38	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	146.6	174.7	-66.3	-24.4	0	0	0	110.3	D100 N101 A102 G103	N27-D100 PolarHBondContact ND2-OD2 2.87Å; N27-N101 PolarHBondContact N-O 2.68Å; N27-A102 HydrophobicContact CB-CB 4.34Å; N27-A102 CarbonylContact O-C 3.58Å; N27-A102 VanDerWaalsContact O-CA 3.29Å; N27-A102 WeakPolarHBondContact O-CA 3.36Å; N27-G103 PolarHBondContact O-N 2.7Å
28	C	97.8	Very high	97.1	Very high	18 Å²	18	40.6 Å²	40.6	12%	0.122	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.9	166.3	-164.7	0	0	0	0	108.9	D30 A34 K35 L37 G103	C28-D30 VanDerWaalsContact SG-CG 3.54Å; C28-D30 PolarHBondContact SG-OD1 2.91Å; C28-A34 HydrophobicContact CB-CB 3.98Å; C28-A34 WeakPolarHBondContact CB-O 3.38Å; C28-K35 PolarHBondContact N-O 3.48Å; C28-L37 HydrophobicContact CB-CD1 4.2Å; C28-L37 HydrophobicContact CB-CD2 4.46Å; C28-L37 HydrophobicContact CB-CG 4Å; C28-G103 WeakPolarHBondContact CA-O 3.33Å
29	A	97.4	Very high	97.2	Very high	5 Å²	5	35.7 Å²	35.7	4%	0.041	21%	0.211	C	C	.	.			trans	-96.9	-2.3	-178.5	0	0	0	0	0	113.6	I82 A102 G103 V104 I117 T118	A29-I82 HydrophobicContact CB-CD1 3.48Å; A29-I82 VanDerWaalsContact CB-CD1 3.48Å; A29-A102 HydrophobicContact CB-CB 4.2Å; A29-G103 PolarHBondContact N-O 3.19Å; A29-V104 HydrophobicContact CB-CG1 4.18Å; A29-I117 HydrophobicContact CB-CG2 4.02Å; A29-I117 WeakPolarHBondContact O-CA 3.35Å; A29-T118 PolarHBondContact O-N 3.1Å
30	D	95.4	Very high	97.3	Very high	11 Å²	11	38.1 Å²	38.1	6%	0.059	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-90.7	169.1	176.5	69.7	36.8	0	0	0	112.6	C28 T32 V104 I105 A116	C28-D30 VanDerWaalsContact SG-CG 3.54Å; C28-D30 PolarHBondContact SG-OD1 2.91Å; D30-T32 HydrophobicContact CB-CG2 4.49Å; D30-T32 VanDerWaalsContact OD1-CB 3.22Å; D30-T32 WeakPolarHBondContact OD1-CB 3.43Å; D30-T32 VanDerWaalsContact OD1-CG2 3.27Å; D30-T32 WeakPolarHBondContact OD1-CG2 3.45Å; D30-T32 PolarHBondContact OD1-N 2.55Å; D30-T32 PolarHBondContact OD1-OG1 3.5Å; D30-V104 HydrophobicContact CB-CB 4.37Å; D30-V104 HydrophobicContact CB-CG1 3.94Å; D30-I105 WeakPolarHBondContact OD2-CB 3.44Å; D30-I105 PolarHBondContact OD2-N 2.92Å; D30-A116 WeakPolarHBondContact CA-O 3.45Å
31	N	95	Very high	97.2	Very high	87 Å²	87	39.8 Å²	39.8	47%	0.465	23%	0.231	S	C	.	.	S	Bend	trans	-91.7	19.6	177.2	67.1	-23.9	0	0	0	114.1	G33 G114 S115 A116	N31-G33 PolarHBondContact O-N 3.27Å; N31-G114 WeakPolarHBondContact OD1-CA 3.43Å; N31-S115 PolarHBondContact OD1-N 2.94Å; N31-A116 PolarHBondContact N-O 2.94Å; N31-A116 PolarHBondContact OD1-N 3.49Å
32	T	95.5	Very high	97.1	Very high	19 Å²	19	38.1 Å²	38.1	12%	0.117	22%	0.22	C	C	.	.	S	Bend	trans	-67.3	-22.3	178.7	61.7	0	0	0	0	112.9	D30 A34 L72 I105 K113 G114	D30-T32 HydrophobicContact CB-CG2 4.49Å; D30-T32 VanDerWaalsContact OD1-CB 3.22Å; D30-T32 WeakPolarHBondContact OD1-CB 3.43Å; D30-T32 VanDerWaalsContact OD1-CG2 3.27Å; D30-T32 WeakPolarHBondContact OD1-CG2 3.45Å; D30-T32 PolarHBondContact OD1-N 2.55Å; D30-T32 PolarHBondContact OD1-OG1 3.5Å; T32-A34 PolarHBondContact OG1-N 2.83Å; T32-L72 WeakPolarHBondContact O-CD1 3.35Å; T32-I105 WeakPolarHBondContact OG1-CD1 3.49Å; T32-K113 HydrophobicContact CG2-CB 3.98Å; T32-K113 HydrophobicContact CG2-CD 4.36Å; T32-K113 HydrophobicContact CG2-CG 4.02Å; T32-G114 VanDerWaalsContact CG2-N 3.35Å
33	G	94.8	Very high	96.9	Very high	26 Å²	26	41.3 Å²	41.3	27%	0.268	23%	0.229	S	C	.	.	S	Bend	trans	100.1	5.5	-176	0	0	0	0	0	114.1	N31 G68 K69	N31-G33 PolarHBondContact O-N 3.27Å; G33-G68 CarbonylContact O-C 3.49Å; G33-G68 WeakPolarHBondContact O-CA 3.18Å; G33-K69 PolarHBondContact O-N 2.95Å
34	A	97.3	Very high	96.6	Very high	7 Å²	7	44.1 Å²	44.1	6%	0.058	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	145.3	160.6	0	0	0	0	0	110	C28 T32 L37 V65 L72 I105	C28-A34 HydrophobicContact CB-CB 3.98Å; C28-A34 WeakPolarHBondContact CB-O 3.38Å; T32-A34 PolarHBondContact OG1-N 2.83Å; A34-L37 HydrophobicContact CB-CD2 4.33Å; A34-V65 HydrophobicContact CB-CB 4.45Å; A34-V65 HydrophobicContact CB-CG1 3.79Å; A34-V65 HydrophobicContact CB-CG2 3.76Å; A34-L72 HydrophobicContact CB-CD1 4.4Å; A34-I105 HydrophobicContact CB-CD1 3.67Å
35	K	97	Very high	96.2	Very high	146 Å²	146	46.4 Å²	46.4	64%	0.635	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	-43.3	173.9	-65.6	-170.6	175.4	-172.2	0	111.6	C28 K67	C28-K35 PolarHBondContact N-O 3.48Å; K35-K67 WeakPolarHBondContact CA-O 3.45Å; K35-K67 HydrophobicContact CB-CB 4.16Å; K35-K67 WeakPolarHBondContact CB-O 3.43Å; K35-K67 PolarHBondContact N-O 2.81Å
36	N	97.4	Very high	95.9	Very high	36 Å²	36	54 Å²	54	19%	0.193	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130	-177.6	-65.7	78.7	0	0	0	110.7	V25 I26 V65 K66 K67	V25-N36 HydrophobicContact CG1-CB 3.87Å; I26-N36 WeakPolarHBondContact O-CA 3.45Å; N36-V65 WeakPolarHBondContact O-CA 3.38Å; N36-K66 HydrophobicContact CB-CB 4.43Å; N36-K66 PolarHBondContact O-N 2.92Å; N36-K67 HydrophobicContact CB-CB 4.25Å; N36-K67 PolarHBondContact N-O 3.1Å
37	L	98	Very high	95.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.1	174.7	-58.6	174.9	0	0	0	109	V25 I26 C28 A34 A63 V65 A79 I105	V25-L37 CarbonylContact C-O 3.53Å; V25-L37 WeakPolarHBondContact CA-O 3.38Å; I26-L37 HydrophobicContact CG1-CB 3.86Å; I26-L37 PolarHBondContact N-O 2.95Å; I26-L37 PolarHBondContact O-N 2.98Å; C28-L37 HydrophobicContact CB-CD1 4.2Å; C28-L37 HydrophobicContact CB-CD2 4.46Å; C28-L37 HydrophobicContact CB-CG 4Å; A34-L37 HydrophobicContact CB-CD2 4.33Å; L37-A63 HydrophobicContact CB-CB 4.27Å; L37-V65 HydrophobicContact CD2-CG2 4.02Å; L37-A79 HydrophobicContact CD1-CB 3.95Å; L37-I105 HydrophobicContact CD1-CG1 4.41Å; L37-I105 HydrophobicContact CD2-CD1 4.01Å; L37-I105 HydrophobicContact CD2-CG1 3.92Å
38	Y	98.3	Very high	95.3	Very high	79 Å²	79	62.4 Å²	62.4	31%	0.31	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.4	173.4	175.3	-85.6	0	0	0	109.4	G23 V25 I40 A63 S64 K66	G23-Y38 WeakPolarHBondContact CA-OH 3.35Å; G23-Y38 VanDerWaalsContact O-CE2 3.31Å; G23-Y38 WeakPolarHBondContact O-CE2 3.22Å; V25-Y38 HydrophobicContact CG2-CD2 3.71Å; Y38-I40 HydrophobicContact CD1-CG1 3.93Å; Y38-I40 HydrophobicContact CE1-CG1 4.23Å; Y38-A63 CarbonylContact O-C 3.57Å; Y38-A63 WeakPolarHBondContact O-CA 3.27Å; Y38-S64 PolarHBondContact N-O 2.95Å; Y38-S64 PolarHBondContact O-N 2.65Å; Y38-K66 VanDerWaalsContact CB-CE 3.45Å; Y38-K66 HydrophobicContact CG-CG 4.38Å
39	I	98.2	Very high	95.3	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.8	-178.3	-64.8	170.6	0	0	0	109.9	L20 V22 G23 A24 I26 V42 V61	L20-I39 HydrophobicContact CB-CD1 3.92Å; L20-I39 HydrophobicContact CD1-CD1 4.28Å; V22-I39 HydrophobicContact CG1-CG2 4.49Å; G23-I39 PolarHBondContact N-O 2.91Å; A24-I39 HydrophobicContact CB-CD1 4.34Å; A24-I39 PolarHBondContact O-N 2.8Å; I26-I39 HydrophobicContact CD1-CD1 4.3Å; I26-I39 HydrophobicContact CG2-CD1 4.35Å; I39-V42 HydrophobicContact CG2-CG2 4.39Å; I39-V61 HydrophobicContact CG1-CB 4.48Å; I39-V61 HydrophobicContact CG1-CG2 4.2Å; I39-V61 HydrophobicContact CG2-CB 4.26Å; I39-V61 HydrophobicContact CG2-CG1 4.35Å
40	I	97.4	Very high	95.2	Very high	76 Å²	76	76.1 Å²	76.1	39%	0.39	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-43.7	179.9	-58.6	171.5	0	0	0	110.3	V22 Y38 V62 V76	V22-I40 VanDerWaalsContact CG1-O 3.25Å; V22-I40 WeakPolarHBondContact CG1-O 3.46Å; Y38-I40 HydrophobicContact CD1-CG1 3.93Å; Y38-I40 HydrophobicContact CE1-CG1 4.23Å; I40-V62 HydrophobicContact CB-CG1 4.35Å; I40-V62 PolarHBondContact N-O 2.71Å; I40-V76 HydrophobicContact CD1-CG2 4.39Å
41	A	96.8	Very high	95.3	Very high	38 Å²	38	83 Å²	83	31%	0.314	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	164.6	-179.2	0	0	0	0	0	110.9	V61 V62	A41-V61 CarbonylContact O-C 3.55Å; A41-V61 WeakPolarHBondContact O-CA 3.37Å; A41-V61 WeakPolarHBondContact O-CB 3.36Å; A41-V62 HydrophobicContact CB-CB 4.07Å; A41-V62 HydrophobicContact CB-CG2 4.15Å; A41-V62 PolarHBondContact N-O 2.72Å; A41-V62 PolarHBondContact O-N 2.76Å
42	V	96.3	Very high	95.3	Very high	15 Å²	15	84.1 Å²	84.1	9%	0.091	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.4	179.1	-173.3	0	0	0	0	108.5	I39 V45 P53 A55 D59 V61	I39-V42 HydrophobicContact CG2-CG2 4.39Å; V42-V45 HydrophobicContact CB-CG2 3.83Å; V42-V45 HydrophobicContact CG1-CG2 3.68Å; V42-P53 HydrophobicContact CB-CB 4.38Å; V42-P53 HydrophobicContact CG2-CB 4.25Å; V42-A55 HydrophobicContact CG1-CB 3.91Å; V42-A55 HydrophobicContact CG2-CB 3.9Å; V42-D59 HydrophobicContact CG1-CB 4.44Å; V42-V61 HydrophobicContact CG1-CG1 4.3Å; V42-V61 HydrophobicContact CG2-CG1 4.15Å
43	Y	93.5	Very high	95.4	Very high	104 Å²	104	85.3 Å²	85.3	41%	0.408	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	149.3	178.7	-75.9	-93.6	0	0	0	111.3	V45 M60 V62 Q78	Y43-V45 PolarHBondContact O-N 2.81Å; Y43-M60 HydrophobicContact CD2-CB 4.02Å; Y43-M60 HydrophobicContact CD2-CG 3.62Å; Y43-M60 WeakPolarHBondContact CD2-O 3.23Å; Y43-M60 HydrophobicContact CD2-SD 4.1Å; Y43-M60 HydrophobicContact CE2-CG 3.92Å; Y43-M60 HydrophobicContact CE2-SD 4.16Å; Y43-M60 HydrophobicContact CG-CB 4.42Å; Y43-M60 HydrophobicContact CG-CG 4.3Å; Y43-M60 HydrophobicContact CG-SD 4.41Å; Y43-M60 PolarHBondContact N-O 2.86Å; Y43-V62 HydrophobicContact CD2-CG2 4.17Å; Y43-V62 HydrophobicContact CE2-CB 4.49Å; Y43-V62 HydrophobicContact CE2-CG2 3.35Å; Y43-Q78 HydrophobicContact CE2-CG 3.92Å; Y43-Q78 VanDerWaalsContact OH-CD 3.22Å; Y43-Q78 WeakPolarHBondContact OH-CG 3.09Å; Y43-Q78 PolarHBondContact OH-NE2 3.43Å
44	G	90.1	Very high	95.5	Very high	89 Å²	89	85.4 Å²	85.4	92%	0.918	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	5.6	174.4	0	0	0	0	0	115.5
45	V	90.1	Very high	95.5	Very high	69 Å²	69	85 Å²	85	42%	0.418	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-92.5	127.4	177.4	-177.6	0	0	0	0	110.2	V42 Y43 P53	V42-V45 HydrophobicContact CB-CG2 3.83Å; V42-V45 HydrophobicContact CG1-CG2 3.68Å; Y43-V45 PolarHBondContact O-N 2.81Å; V45-P53 HydrophobicContact CB-CB 4.47Å; V45-P53 HydrophobicContact CG1-CB 4.13Å
46	R	90.8	Very high	95.5	Very high	234 Å²	234	78.1 Å²	78.1	88%	0.883	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-78.4	139.3	170.8	-65.2	-175.7	-178	-174.8	0.4	110.2
47	G	90.3	Very high	95.5	Very high	80 Å²	80	76.4 Å²	76.4	83%	0.825	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-62.5	142.8	174.4	0	0	0	0	0	112
48	R	94.8	Very high	95.4	Very high	171 Å²	171	76.5 Å²	76.5	65%	0.645	41%	0.406	S	S	*	.			trans	-144.4	139.6	170.3	179.4	162.1	178	164.5	2.7	108.9	N50 R51	R48-N50 PolarHBondContact O-N 3.23Å; R48-R51 HydrophobicContact CB-CB 4.04Å; R48-R51 HydrophobicContact CG-CB 4.38Å; R48-R51 PolarHBondContact O-N 3.41Å
49	L	96.7	Very high	95.3	Very high	152 Å²	152	74.3 Å²	74.3	80%	0.796	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	128.3	-178.5	-175.5	63.8	0	0	0	110.9	R51	L49-R51 PolarHBondContact O-N 3.23Å; L49-R51 VanDerWaalsContact O-N 3.09Å
50	N	95.9	Very high	95.1	Very high	158 Å²	158	75.4 Å²	75.4	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	19.8	178.8	-57.4	-25.8	0	0	0	115.6	R48	R48-N50 PolarHBondContact O-N 3.23Å
51	R	96.5	Very high	95.1	Very high	156 Å²	156	71.8 Å²	71.8	59%	0.589	39%	0.386	S	S	*	.			trans	-106.4	121.3	176.3	-171.8	172	-61.1	-154.1	-2.5	110.8	R48 L49 P53	R48-R51 HydrophobicContact CB-CB 4.04Å; R48-R51 HydrophobicContact CG-CB 4.38Å; R48-R51 PolarHBondContact O-N 3.41Å; L49-R51 PolarHBondContact O-N 3.23Å; L49-R51 VanDerWaalsContact O-N 3.09Å; R51-P53 WeakPolarHBondContact O-CD 3.4Å
52	L	96.6	Very high	95.1	Very high	110 Å²	110	71.2 Å²	71.2	58%	0.576	38%	0.379	S	S	*	.			trans	-70.3	124.3	172.2	-61.5	-179	0	0	0	110.1	P21 V22 S54	P21-L52 HydrophobicContact CB-CB 4.44Å; P21-L52 HydrophobicContact CB-CD1 4.5Å; V22-L52 HydrophobicContact CG2-CB 4.11Å; V22-L52 HydrophobicContact CG2-CD2 3.96Å; V22-L52 HydrophobicContact CG2-CG 4.49Å; L52-S54 PolarHBondContact O-N 3.17Å; L52-S54 PolarHBondContact O-OG 3.08Å
53	P	97	Very high	95.2	Very high	45 Å²	45	70.5 Å²	70.5	29%	0.292	37%	0.374	S	S	.	.			trans	-55.4	135.7	168	-21.9	32.9	0	0	0	109.3	P21 V22 V42 V45 R51	P21-P53 WeakPolarHBondContact CA-O 3.5Å; V22-P53 HydrophobicContact CG1-CB 4.04Å; V22-P53 HydrophobicContact CG1-CG 4.31Å; V22-P53 PolarHBondContact N-O 3.06Å; V42-P53 HydrophobicContact CB-CB 4.38Å; V42-P53 HydrophobicContact CG2-CB 4.25Å; V45-P53 HydrophobicContact CB-CB 4.47Å; V45-P53 HydrophobicContact CG1-CB 4.13Å; R51-P53 WeakPolarHBondContact O-CD 3.4Å
54	S	97.4	Very high	95.4	Very high	27 Å²	27	66.3 Å²	66.3	19%	0.189	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144.1	-176.1	-57.6	0	0	0	0	110.1	L20 P21 L52	L20-S54 CarbonylContact O-C 3.46Å; L20-S54 WeakPolarHBondContact O-CA 3.5Å; P21-S54 WeakPolarHBondContact CA-OG 3.18Å; L52-S54 PolarHBondContact O-N 3.17Å; L52-S54 PolarHBondContact O-OG 3.08Å
55	A	97.5	Very high	95.7	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	159.5	-180	0	0	0	0	0	111	G19 L20 V42 D59 V61 V81	G19-A55 PolarHBondContact N-O 3.16Å; G19-A55 VanDerWaalsContact N-O 3.11Å; L20-A55 HydrophobicContact CB-CB 4.34Å; L20-A55 PolarHBondContact N-O 3.48Å; L20-A55 PolarHBondContact O-N 3.49Å; V42-A55 HydrophobicContact CG1-CB 3.91Å; V42-A55 HydrophobicContact CG2-CB 3.9Å; A55-D59 WeakPolarHBondContact CA-OD2 3.47Å; A55-D59 HydrophobicContact CB-CB 4.04Å; A55-V61 HydrophobicContact CB-CG1 3.61Å; A55-V81 HydrophobicContact CB-CG2 4.27Å
56	A	97.1	Very high	96	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.			trans	-132.3	-179.6	164.2	0	0	0	0	0	109.8	K13 I16 S17 L18 G58 D59 Q84	K13-A56 PolarHBondContact NZ-O 2.96Å; I16-A56 HydrophobicContact CD1-CB 3.69Å; I16-A56 HydrophobicContact CG1-CB 3.67Å; S17-A56 WeakPolarHBondContact O-CB 3.34Å; L18-A56 HydrophobicContact CD2-CB 3.9Å; A56-G58 PolarHBondContact O-N 2.96Å; A56-D59 PolarHBondContact N-OD2 3.09Å; A56-D59 WeakPolarHBondContact O-CB 3.2Å; A56-D59 PolarHBondContact O-N 3.49Å; A56-Q84 VanDerWaalsContact CA-OE1 3.29Å
57	V	96.7	Very high	96.3	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	134.9	178	-174.1	0	0	0	0	112.4	K13 I16 D59 Q84 Y88 A122 C125	K13-V57 WeakPolarHBondContact CE-O 3.5Å; K13-V57 PolarHBondContact NZ-O 2.82Å; I16-V57 HydrophobicContact CD1-CB 4.12Å; V57-D59 VanDerWaalsContact C-N 3.32Å; V57-D59 PolarHBondContact O-N 2.97Å; V57-Q84 HydrophobicContact CG2-CB 3.67Å; V57-Q84 HydrophobicContact CG2-CG 3.73Å; V57-Y88 HydrophobicContact CG2-CE1 3.94Å; V57-A122 HydrophobicContact CG1-CB 3.44Å; V57-A122 VanDerWaalsContact CG1-CB 3.44Å; V57-C125 HydrophobicContact CG1-CB 3.88Å
58	G	95.4	Very high	96.5	Very high	3 Å²	3	56.4 Å²	56.4	3%	0.031	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-9.5	-176.5	0	0	0	0	0	115.1	A56 V81 W129	A56-G58 PolarHBondContact O-N 2.96Å; G58-V81 PolarHBondContact N-O 2.86Å; G58-W129 PolarHBondContact O-NE1 2.82Å
59	D	95.5	Very high	96.6	Very high	33 Å²	33	53.8 Å²	53.8	18%	0.176	27%	0.271	C	S	.	.			trans	-76.9	142	176	-66.6	-28.7	0	0	0	111.4	K13 V42 A55 A56 V57 V80 V81	K13-D59 VanDerWaalsContact CD-OD1 3.25Å; K13-D59 WeakPolarHBondContact CD-OD1 3.13Å; K13-D59 IonicContact NZ-OD1 2.74Å; K13-D59 PolarHBondContact NZ-OD1 2.9Å; K13-D59 IonicContact NZ-OD2 2.79Å; K13-D59 PolarHBondContact NZ-OD2 2.9Å; V42-D59 HydrophobicContact CG1-CB 4.44Å; A55-D59 WeakPolarHBondContact CA-OD2 3.47Å; A55-D59 HydrophobicContact CB-CB 4.04Å; A56-D59 PolarHBondContact N-OD2 3.09Å; A56-D59 WeakPolarHBondContact O-CB 3.2Å; A56-D59 PolarHBondContact O-N 3.49Å; V57-D59 VanDerWaalsContact C-N 3.32Å; V57-D59 PolarHBondContact O-N 2.97Å; D59-V80 WeakPolarHBondContact O-CA 3.32Å; D59-V81 PolarHBondContact O-N 3.36Å
60	M	95.1	Very high	96.6	Very high	24 Å²	24	51.9 Å²	51.9	12%	0.118	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.3	166.5	-172	179	-84	0	0	109.5	Y43 A79 V80 V106 W129	Y43-M60 HydrophobicContact CD2-CB 4.02Å; Y43-M60 HydrophobicContact CD2-CG 3.62Å; Y43-M60 WeakPolarHBondContact CD2-O 3.23Å; Y43-M60 HydrophobicContact CD2-SD 4.1Å; Y43-M60 HydrophobicContact CE2-CG 3.92Å; Y43-M60 HydrophobicContact CE2-SD 4.16Å; Y43-M60 HydrophobicContact CG-CB 4.42Å; Y43-M60 HydrophobicContact CG-CG 4.3Å; Y43-M60 HydrophobicContact CG-SD 4.41Å; Y43-M60 PolarHBondContact N-O 2.86Å; M60-A79 CarbonylContact C-O 3.52Å; M60-A79 WeakPolarHBondContact CA-O 3.47Å; M60-V80 HydrophobicContact CB-CG2 4.49Å; M60-V80 HydrophobicContact CE-CG2 4.46Å; M60-V106 HydrophobicContact CE-CG2 3.89Å; M60-W129 HydrophobicContact CB-CZ2 4.2Å; M60-W129 HydrophobicContact CE-CH2 3.41Å; M60-W129 VanDerWaalsContact CE-CH2 3.41Å; M60-W129 HydrophobicContact CE-CZ2 4.1Å; M60-W129 HydrophobicContact CE-CZ3 3.89Å
61	V	96.9	Very high	96.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153.2	-179.5	-61.8	0	0	0	0	110.4	I39 A41 V42 A55 Q78 A79 V81	I39-V61 HydrophobicContact CG1-CB 4.48Å; I39-V61 HydrophobicContact CG1-CG2 4.2Å; I39-V61 HydrophobicContact CG2-CB 4.26Å; I39-V61 HydrophobicContact CG2-CG1 4.35Å; A41-V61 CarbonylContact O-C 3.55Å; A41-V61 WeakPolarHBondContact O-CA 3.37Å; A41-V61 WeakPolarHBondContact O-CB 3.36Å; V42-V61 HydrophobicContact CG1-CG1 4.3Å; V42-V61 HydrophobicContact CG2-CG1 4.15Å; A55-V61 HydrophobicContact CB-CG1 3.61Å; V61-Q78 WeakPolarHBondContact O-CA 3.43Å; V61-A79 HydrophobicContact CG2-CB 3.98Å; V61-A79 WeakPolarHBondContact CG2-O 3.46Å; V61-A79 PolarHBondContact N-O 3.01Å; V61-A79 PolarHBondContact O-N 2.84Å; V61-V81 HydrophobicContact CG1-CG2 4.15Å; V61-V81 HydrophobicContact CG2-CG2 4.49Å
62	V	97.1	Very high	96.5	Very high	25 Å²	25	44.6 Å²	44.6	15%	0.152	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.5	164.4	-176.4	0	0	0	0	107.3	I40 A41 Y43 V76	I40-V62 HydrophobicContact CB-CG1 4.35Å; I40-V62 PolarHBondContact N-O 2.71Å; A41-V62 HydrophobicContact CB-CB 4.07Å; A41-V62 HydrophobicContact CB-CG2 4.15Å; A41-V62 PolarHBondContact N-O 2.72Å; A41-V62 PolarHBondContact O-N 2.76Å; Y43-V62 HydrophobicContact CD2-CG2 4.17Å; Y43-V62 HydrophobicContact CE2-CB 4.49Å; Y43-V62 HydrophobicContact CE2-CG2 3.35Å; V62-V76 HydrophobicContact CG1-CG1 3.33Å
63	A	97.7	Very high	96.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	159.3	-176.5	0	0	0	0	0	112.6	L37 Y38 M77 A79	L37-A63 HydrophobicContact CB-CB 4.27Å; Y38-A63 CarbonylContact O-C 3.57Å; Y38-A63 WeakPolarHBondContact O-CA 3.27Å; A63-M77 PolarHBondContact N-O 2.85Å; A63-M77 PolarHBondContact O-N 2.89Å; A63-M77 VanDerWaalsContact O-O 3.04Å; A63-A79 HydrophobicContact CB-CB 4.29Å
64	S	97.4	Very high	96.2	Very high	16 Å²	16	52.5 Å²	52.5	11%	0.112	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.1	166.5	59	0	0	0	0	110.9	Y38 K66	Y38-S64 PolarHBondContact N-O 2.95Å; Y38-S64 PolarHBondContact O-N 2.65Å; S64-K66 PolarHBondContact O-N 3.23Å
65	V	97.6	Very high	96.1	Very high	4 Å²	4	57 Å²	57	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.7	176.6	-178	0	0	0	0	109.6	A34 N36 L37 K67 L72 R73 M77 I105	A34-V65 HydrophobicContact CB-CB 4.45Å; A34-V65 HydrophobicContact CB-CG1 3.79Å; A34-V65 HydrophobicContact CB-CG2 3.76Å; N36-V65 WeakPolarHBondContact O-CA 3.38Å; L37-V65 HydrophobicContact CD2-CG2 4.02Å; V65-K67 WeakPolarHBondContact CG1-O 3.48Å; V65-L72 HydrophobicContact CB-CB 4.46Å; V65-L72 HydrophobicContact CG2-CB 4.15Å; V65-R73 HydrophobicContact CG1-CG 4.19Å; V65-M77 HydrophobicContact CG2-CE 4Å; V65-M77 HydrophobicContact CG2-SD 3.58Å; V65-M77 VanDerWaalsContact CG2-SD 3.58Å; V65-I105 HydrophobicContact CG2-CD1 4.38Å
66	K	95.8	Very high	96	Very high	100 Å²	100	62.1 Å²	62.1	44%	0.435	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-45.2	176.6	-68	-67.3	-177.7	177.3	0	111.9	N36 Y38 S64 R73	N36-K66 HydrophobicContact CB-CB 4.43Å; N36-K66 PolarHBondContact O-N 2.92Å; Y38-K66 VanDerWaalsContact CB-CE 3.45Å; Y38-K66 HydrophobicContact CG-CG 4.38Å; S64-K66 PolarHBondContact O-N 3.23Å; K66-R73 PolarHBondContact O-NE 3.38Å; K66-R73 VanDerWaalsContact O-NE 3.08Å; K66-R73 PolarHBondContact O-NH2 2.94Å
67	K	96.7	Very high	95.9	Very high	136 Å²	136	63.4 Å²	63.4	59%	0.591	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.6	177.1	-63.9	-176.9	179.2	179.8	0	109.1	K35 N36 V65	K35-K67 WeakPolarHBondContact CA-O 3.45Å; K35-K67 HydrophobicContact CB-CB 4.16Å; K35-K67 WeakPolarHBondContact CB-O 3.43Å; K35-K67 PolarHBondContact N-O 2.81Å; N36-K67 HydrophobicContact CB-CB 4.25Å; N36-K67 PolarHBondContact N-O 3.1Å; V65-K67 WeakPolarHBondContact CG1-O 3.48Å
68	G	95.8	Very high	95.9	Very high	25 Å²	25	64.7 Å²	64.7	26%	0.258	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151	-169.4	-176.4	0	0	0	0	0	112.3	G33 R73	G33-G68 CarbonylContact O-C 3.49Å; G33-G68 WeakPolarHBondContact O-CA 3.18Å; G68-R73 WeakPolarHBondContact O-CD 3.48Å
69	K	96.2	Very high	96	Very high	115 Å²	115	64.5 Å²	64.5	50%	0.5	32%	0.315	S	S	.	.			trans	-51.6	135.8	174.6	-72.3	-178.4	178.6	174.9	0	111.2	G33 E71 L72 R73	G33-K69 PolarHBondContact O-N 2.95Å; K69-E71 PolarHBondContact O-N 3.26Å; K69-E71 VanDerWaalsContact O-N 3.16Å; K69-L72 HydrophobicContact CB-CD1 4.37Å; K69-L72 HydrophobicContact CB-CG 4.47Å; K69-L72 PolarHBondContact O-N 2.91Å; K69-R73 PolarHBondContact O-N 2.89Å
70	P	96	Very high	96	Very high	113 Å²	113	63 Å²	63	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-52.9	-38.3	-178.5	-28.1	35.2	0	0	0	113.8	L72 R73	P70-L72 PolarHBondContact O-N 2.95Å; P70-R73 PolarHBondContact O-N 2.87Å
71	E	95.7	Very high	96.1	Very high	148 Å²	148	61.8 Å²	61.8	69%	0.692	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-62.8	-24.9	-179.3	-63.5	171.8	-163.7	0	0	114.8	K69 K75	K69-E71 PolarHBondContact O-N 3.26Å; K69-E71 VanDerWaalsContact O-N 3.16Å; E71-K75 WeakPolarHBondContact O-CD 3.28Å; E71-K75 WeakPolarHBondContact O-CE 3.38Å; E71-K75 PolarHBondContact O-NZ 3.13Å
72	L	94.7	Very high	96.2	Very high	12 Å²	12	61.8 Å²	61.8	6%	0.063	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-94.5	-22	-179.6	-63.4	175.6	0	0	0	112.3	T32 A34 V65 K69 P70 M77	T32-L72 WeakPolarHBondContact O-CD1 3.35Å; A34-L72 HydrophobicContact CB-CD1 4.4Å; V65-L72 HydrophobicContact CB-CB 4.46Å; V65-L72 HydrophobicContact CG2-CB 4.15Å; K69-L72 HydrophobicContact CB-CD1 4.37Å; K69-L72 HydrophobicContact CB-CG 4.47Å; K69-L72 PolarHBondContact O-N 2.91Å; P70-L72 PolarHBondContact O-N 2.95Å; L72-M77 HydrophobicContact CB-CE 4.45Å; L72-M77 HydrophobicContact CD2-CE 4.21Å
73	R	94.6	Very high	96.2	Very high	122 Å²	122	62 Å²	62	46%	0.46	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-68.9	153.2	-179	-67.3	178.2	71.5	-165.4	-2.1	110.5	V65 K66 G68 K69 P70 K75	V65-R73 HydrophobicContact CG1-CG 4.19Å; K66-R73 PolarHBondContact O-NE 3.38Å; K66-R73 VanDerWaalsContact O-NE 3.08Å; K66-R73 PolarHBondContact O-NH2 2.94Å; G68-R73 WeakPolarHBondContact O-CD 3.48Å; K69-R73 PolarHBondContact O-N 2.89Å; P70-R73 PolarHBondContact O-N 2.87Å; R73-K75 PolarHBondContact O-N 3.02Å
74	K	92.8	Very high	96.2	Very high	199 Å²	199	62 Å²	62	87%	0.865	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	7.2	179.4	-52.4	179.5	179	-179.6	0	115.2
75	K	95	Very high	96.2	Very high	121 Å²	121	68.8 Å²	68.8	53%	0.526	32%	0.322	S	S	.	.			trans	-97.9	143.3	171.4	-66.8	179.1	-179.1	166	0	110.2	E71 R73 M77	E71-K75 WeakPolarHBondContact O-CD 3.28Å; E71-K75 WeakPolarHBondContact O-CE 3.38Å; E71-K75 PolarHBondContact O-NZ 3.13Å; R73-K75 PolarHBondContact O-N 3.02Å; K75-M77 HydrophobicContact CB-CE 4.38Å
76	V	96.1	Very high	96.2	Very high	109 Å²	109	74.3 Å²	74.3	66%	0.661	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	131	170.4	-178.8	0	0	0	0	108.1	I40 V62	I40-V76 HydrophobicContact CD1-CG2 4.39Å; V62-V76 HydrophobicContact CG1-CG1 3.33Å
77	M	95.5	Very high	96.3	Very high	27 Å²	27	72.3 Å²	72.3	13%	0.133	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	170.2	-179.7	56.3	-174.3	55.9	0	0	110.7	A63 V65 L72 K75 I105	A63-M77 PolarHBondContact N-O 2.85Å; A63-M77 PolarHBondContact O-N 2.89Å; A63-M77 VanDerWaalsContact O-O 3.04Å; V65-M77 HydrophobicContact CG2-CE 4Å; V65-M77 HydrophobicContact CG2-SD 3.58Å; V65-M77 VanDerWaalsContact CG2-SD 3.58Å; L72-M77 HydrophobicContact CB-CE 4.45Å; L72-M77 HydrophobicContact CD2-CE 4.21Å; K75-M77 HydrophobicContact CB-CE 4.38Å; M77-I105 HydrophobicContact CG-CG2 4.44Å; M77-I105 HydrophobicContact SD-CB 4.44Å; M77-I105 HydrophobicContact SD-CD1 3.46Å; M77-I105 WeakPolarHBondContact SD-CD1 3.48Å; M77-I105 HydrophobicContact SD-CG1 3.73Å; M77-I105 HydrophobicContact SD-CG2 3.8Å
78	Q	96.2	Very high	96.3	Very high	26 Å²	26	65.9 Å²	65.9	12%	0.121	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	148.1	176.7	-68.3	167.3	28.4	0	0	110.1	Y43 V61 I105 V106 N107 N108	Y43-Q78 HydrophobicContact CE2-CG 3.92Å; Y43-Q78 VanDerWaalsContact OH-CD 3.22Å; Y43-Q78 WeakPolarHBondContact OH-CG 3.09Å; Y43-Q78 PolarHBondContact OH-NE2 3.43Å; V61-Q78 WeakPolarHBondContact O-CA 3.43Å; Q78-I105 WeakPolarHBondContact O-CA 3.48Å; Q78-V106 HydrophobicContact CB-CG2 4Å; Q78-V106 PolarHBondContact O-N 3.06Å; Q78-N107 PolarHBondContact OE1-O 3.03Å; Q78-N108 PolarHBondContact NE2-OD1 2.89Å; Q78-N108 VanDerWaalsContact OE1-CA 3.28Å
79	A	97.2	Very high	96.4	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.1	174.5	0	0	0	0	0	110.3	L37 M60 V61 A63 V104	L37-A79 HydrophobicContact CD1-CB 3.95Å; M60-A79 CarbonylContact C-O 3.52Å; M60-A79 WeakPolarHBondContact CA-O 3.47Å; V61-A79 HydrophobicContact CG2-CB 3.98Å; V61-A79 WeakPolarHBondContact CG2-O 3.46Å; V61-A79 PolarHBondContact N-O 3.01Å; V61-A79 PolarHBondContact O-N 2.84Å; A63-A79 HydrophobicContact CB-CB 4.29Å; A79-V104 CarbonylContact C-O 3.49Å; A79-V104 WeakPolarHBondContact CA-O 3.43Å; A79-V104 VanDerWaalsContact CB-O 3.32Å; A79-V104 WeakPolarHBondContact CB-O 3.37Å
80	V	96.6	Very high	96.3	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135.8	170.2	172.9	0	0	0	0	108.5	D59 M60 G103 V104 V106 C125 W129	D59-V80 WeakPolarHBondContact O-CA 3.32Å; M60-V80 HydrophobicContact CB-CG2 4.49Å; M60-V80 HydrophobicContact CE-CG2 4.46Å; V80-G103 CarbonylContact O-C 3.56Å; V80-G103 WeakPolarHBondContact O-CA 3.3Å; V80-V104 HydrophobicContact CB-CG2 4.4Å; V80-V104 PolarHBondContact N-O 3.03Å; V80-V104 PolarHBondContact O-N 3.45Å; V80-V106 HydrophobicContact CB-CG1 4.4Å; V80-V106 HydrophobicContact CG2-CG1 3.92Å; V80-V106 HydrophobicContact CG2-CG2 3.89Å; V80-C125 VanDerWaalsContact CG1-SG 3.58Å; V80-W129 HydrophobicContact CG1-CG 4.28Å; V80-W129 HydrophobicContact CG2-CD2 4.21Å; V80-W129 HydrophobicContact CG2-CZ2 4.17Å
81	V	97.5	Very high	96.2	Very high	0 Å²	0	71 Å²	71	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.6	174.3	-178.9	0	0	0	0	109.4	L20 A55 G58 D59 V61	L20-V81 HydrophobicContact CD1-CB 4.37Å; L20-V81 HydrophobicContact CD1-CG1 3.51Å; L20-V81 HydrophobicContact CD1-CG2 3.88Å; A55-V81 HydrophobicContact CB-CG2 4.27Å; G58-V81 PolarHBondContact N-O 2.86Å; D59-V81 PolarHBondContact O-N 3.36Å; V61-V81 HydrophobicContact CG1-CG2 4.15Å; V61-V81 HydrophobicContact CG2-CG2 4.49Å
82	I	97.3	Very high	96.1	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-25.7	-177.4	58.1	158.2	0	0	0	113.7	A29 A102 V104 I117 V121 A122 V132	A29-I82 HydrophobicContact CB-CD1 3.48Å; A29-I82 VanDerWaalsContact CB-CD1 3.48Å; I82-A102 HydrophobicContact CD1-CB 4.22Å; I82-A102 HydrophobicContact CG1-CB 4.03Å; I82-A102 VanDerWaalsContact CG1-O 3.28Å; I82-A102 WeakPolarHBondContact CG1-O 3.27Å; I82-A102 PolarHBondContact N-O 2.79Å; I82-V104 HydrophobicContact CD1-CG1 4.34Å; I82-V104 HydrophobicContact CG2-CG1 4.49Å; I82-V104 HydrophobicContact CG2-CG2 3.63Å; I82-I117 HydrophobicContact CD1-CG2 3.8Å; I82-V121 HydrophobicContact CB-CG1 4.16Å; I82-V121 HydrophobicContact CB-CG2 4.29Å; I82-V121 HydrophobicContact CD1-CG2 4.12Å; I82-V121 HydrophobicContact CG2-CG1 4.25Å; I82-V121 HydrophobicContact CG2-CG2 4.42Å; I82-A122 WeakPolarHBondContact O-CB 3.17Å; I82-A122 PolarHBondContact O-N 3.19Å; I82-A122 VanDerWaalsContact O-N 3.1Å; I82-V132 HydrophobicContact CG2-CG1 3.94Å
83	R	97.7	Very high	96.1	Very high	30 Å²	30	70.1 Å²	70.1	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	141.5	-177.4	-70.1	-175.9	-93.1	161.9	-9.1	109.6	F98 D100 A102 T118 P120	R83-F98 HydrophobicContact CB-CB 3.94Å; R83-F98 HydrophobicContact CB-CD1 4.22Å; R83-F98 HydrophobicContact CB-CD2 4.25Å; R83-F98 HydrophobicContact CB-CG 3.86Å; R83-F98 HydrophobicContact CG-CB 4.26Å; R83-F98 HydrophobicContact CG-CD1 3.63Å; R83-F98 HydrophobicContact CG-CD2 4.37Å; R83-F98 HydrophobicContact CG-CE1 4.05Å; R83-F98 HydrophobicContact CG-CG 3.81Å; R83-D100 IonicContact CZ-OD1 3.46Å; R83-D100 IonicContact NE-OD1 3.85Å; R83-D100 IonicContact NH1-OD1 3.61Å; R83-D100 PolarHBondContact NH1-OD1 3.32Å; R83-D100 IonicContact NH1-OD2 3.67Å; R83-D100 PolarHBondContact NH1-OD2 3.45Å; R83-A102 HydrophobicContact CB-CB 4.13Å; R83-A102 PolarHBondContact N-O 2.84Å; R83-A102 PolarHBondContact O-N 3.41Å; R83-A102 VanDerWaalsContact O-N 3.13Å; R83-T118 PolarHBondContact NH2-O 2.92Å; R83-P120 WeakPolarHBondContact CD-O 3.39Å; R83-P120 WeakPolarHBondContact CG-O 3.22Å; R83-P120 PolarHBondContact NE-O 2.91Å
84	Q	97.4	Very high	96.2	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.32	C	S	.	.			trans	-136.2	142.6	170.5	92.9	179.5	26.5	0	0	111.8	S17 A56 V57 K86 Y88 F98 N101	S17-Q84 PolarHBondContact O-NE2 2.68Å; S17-Q84 PolarHBondContact O-OE1 3.21Å; A56-Q84 VanDerWaalsContact CA-OE1 3.29Å; V57-Q84 HydrophobicContact CG2-CB 3.67Å; V57-Q84 HydrophobicContact CG2-CG 3.73Å; Q84-K86 HydrophobicContact CG-CB 4.38Å; Q84-K86 VanDerWaalsContact CG-O 3.22Å; Q84-K86 WeakPolarHBondContact CG-O 3.45Å; Q84-K86 PolarHBondContact NE2-O 3Å; Q84-Y88 HydrophobicContact CG-CD1 3.97Å; Q84-Y88 HydrophobicContact CG-CE1 4.12Å; Q84-F98 PolarHBondContact O-N 3.03Å; Q84-N101 WeakPolarHBondContact CA-OD1 3.09Å
85	R	97.9	Very high	96.4	Very high	158 Å²	158	64.7 Å²	64.7	60%	0.596	31%	0.307	S	S	*	.	S	Bend	trans	-72.5	-32.1	174.8	-114.8	-174.6	177.3	-169.6	0.6	113.7	P87 F98 E99 N101	R85-P87 WeakPolarHBondContact O-CD 3.32Å; R85-F98 WeakPolarHBondContact CA-O 3.34Å; R85-F98 WeakPolarHBondContact CG-O 3.45Å; R85-E99 WeakPolarHBondContact CG-O 3.07Å; R85-E99 PolarHBondContact NE-O 2.89Å; R85-E99 PolarHBondContact NH2-O 3.04Å; R85-N101 PolarHBondContact N-OD1 2.84Å
86	K	98	Very high	96.5	Very high	120 Å²	120	60.4 Å²	60.4	52%	0.522	29%	0.289	S	S	.	.	S	Bend	trans	-68.1	122.9	-178.9	-178.9	68.2	178.6	-179.8	0	109.2	Q84 Y88	Q84-K86 HydrophobicContact CG-CB 4.38Å; Q84-K86 VanDerWaalsContact CG-O 3.22Å; Q84-K86 WeakPolarHBondContact CG-O 3.45Å; Q84-K86 PolarHBondContact NE2-O 3Å; K86-Y88 PolarHBondContact O-N 2.77Å
87	P	97.8	Very high	96.5	Very high	58 Å²	58	63 Å²	63	38%	0.377	29%	0.288	S	S	.	.			trans	-59.9	140.8	177.7	-24	33.5	0	0	0	112.4	R85 F95 I96 Y97	R85-P87 WeakPolarHBondContact O-CD 3.32Å; P87-F95 HydrophobicContact CB-CD1 4.48Å; P87-I96 WeakPolarHBondContact CA-O 3.35Å; P87-Y97 HydrophobicContact CG-CD1 4.42Å; P87-Y97 HydrophobicContact CG-CG 4.37Å
88	Y	97.2	Very high	96.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.8	172.9	63.4	-88.5	0	0	0	111	I16 V57 Q84 K86 F95 I96 A122 E124	I16-Y88 HydrophobicContact CB-CD2 4.11Å; I16-Y88 HydrophobicContact CB-CG 4.26Å; I16-Y88 HydrophobicContact CD1-CD2 4.23Å; I16-Y88 HydrophobicContact CD1-CE2 4.4Å; I16-Y88 HydrophobicContact CD1-CG 4.39Å; I16-Y88 HydrophobicContact CG2-CD2 3.83Å; I16-Y88 HydrophobicContact CG2-CG 4.47Å; V57-Y88 HydrophobicContact CG2-CE1 3.94Å; Q84-Y88 HydrophobicContact CG-CD1 3.97Å; Q84-Y88 HydrophobicContact CG-CE1 4.12Å; K86-Y88 PolarHBondContact O-N 2.77Å; Y88-F95 WeakPolarHBondContact O-CA 3.44Å; Y88-I96 HydrophobicContact CD1-CG2 4.31Å; Y88-I96 HydrophobicContact CD2-CG2 4.05Å; Y88-I96 HydrophobicContact CE1-CG2 3.77Å; Y88-I96 HydrophobicContact CE2-CG2 3.48Å; Y88-I96 VanDerWaalsContact CE2-CG2 3.48Å; Y88-I96 HydrophobicContact CG-CG2 4.44Å; Y88-I96 PolarHBondContact N-O 3Å; Y88-I96 PolarHBondContact O-N 3.45Å; Y88-A122 WeakPolarHBondContact OH-CB 3.18Å; Y88-E124 HydrophobicContact CE2-CG 4.15Å; Y88-E124 WeakPolarHBondContact CE2-OE2 3.49Å; Y88-E124 PolarHBondContact OH-OE2 2.83Å
89	R	96.3	Very high	96.7	Very high	152 Å²	152	69.1 Å²	69.1	57%	0.574	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.6	-176.8	-177.6	175.9	170.8	-178.3	3	110.5	F95	R89-F95 HydrophobicContact CB-CD1 4.19Å; R89-F95 HydrophobicContact CB-CE1 3.83Å; R89-F95 HydrophobicContact CB-CE2 4.17Å; R89-F95 HydrophobicContact CB-CZ 3.83Å; R89-F95 HydrophobicContact CG-CD2 4.49Å; R89-F95 HydrophobicContact CG-CE2 4.07Å; R89-F95 HydrophobicContact CG-CZ 4.14Å
90	R	95.6	Very high	96.7	Very high	41 Å²	41	70.6 Å²	70.6	16%	0.155	32%	0.324	C	S	.	.			trans	-84	166.1	169.9	-75.5	-175.5	166.2	169.2	3.5	111.5	D92 G93 T94 I96 E124 A140	R90-D92 WeakPolarHBondContact CB-OD1 3.29Å; R90-D92 PolarHBondContact O-N 2.89Å; R90-G93 PolarHBondContact O-N 3.06Å; R90-T94 PolarHBondContact N-O 3.08Å; R90-I96 HydrophobicContact CG-CG2 4.42Å; R90-E124 WeakPolarHBondContact CG-OE1 3.4Å; R90-E124 IonicContact CZ-OE1 2.87Å; R90-E124 IonicContact NE-OE1 3.97Å; R90-E124 PolarHBondContact NE-OE1 3.32Å; R90-E124 IonicContact NE-OE2 2.65Å; R90-E124 IonicContact NH2-OE1 3.45Å; R90-E124 IonicContact NH2-OE2 3.48Å; R90-E124 PolarHBondContact NH2-OE2 3.04Å; R90-A140 VanDerWaalsContact CZ-OXT 3.24Å; R90-A140 PolarHBondContact NH1-OXT 3.06Å; R90-A140 PolarHBondContact NH2-O 2.94Å; R90-A140 PolarHBondContact NH2-OXT 3.29Å
91	K	92.1	Very high	96.8	Very high	167 Å²	167	72.6 Å²	72.6	73%	0.726	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.3	-179.3	-67.6	-175.4	179.3	177	0	113.1	F14 G93	F14-K91 HydrophobicContact CD1-CG 4.36Å; F14-K91 VanDerWaalsContact CD2-CE 3.49Å; F14-K91 HydrophobicContact CD2-CG 4.45Å; F14-K91 HydrophobicContact CE1-CG 4.34Å; F14-K91 HydrophobicContact CE2-CG 4.42Å; F14-K91 HydrophobicContact CG-CG 4.41Å; F14-K91 HydrophobicContact CZ-CG 4.37Å; K91-G93 PolarHBondContact O-N 3.21Å
92	D	94.6	Very high	96.8	Very high	115 Å²	115	72.6 Å²	72.6	62%	0.615	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-7.8	175.3	64.8	-10.5	0	0	0	113.4	R90 T94	R90-D92 WeakPolarHBondContact CB-OD1 3.29Å; R90-D92 PolarHBondContact O-N 2.89Å; D92-T94 VanDerWaalsContact CG-OG1 3.31Å; D92-T94 WeakPolarHBondContact OD1-CB 3.43Å; D92-T94 PolarHBondContact OD1-N 3.32Å; D92-T94 PolarHBondContact OD1-OG1 3.28Å; D92-T94 PolarHBondContact OD2-OG1 3.48Å
93	G	95.2	Very high	96.8	Very high	27 Å²	27	72.6 Å²	72.6	28%	0.278	34%	0.335	S	S	.	.	S	Bend	trans	97.8	-12.6	-178.6	0	0	0	0	0	114.5	R90 K91	R90-G93 PolarHBondContact O-N 3.06Å; K91-G93 PolarHBondContact O-N 3.21Å
94	T	96.3	Very high	96.8	Very high	74 Å²	74	71.1 Å²	71.1	45%	0.454	33%	0.329	S	S	.	.			trans	-67.5	138.7	179.8	-50.8	0	0	0	0	110.5	R90 D92	R90-T94 PolarHBondContact N-O 3.08Å; D92-T94 VanDerWaalsContact CG-OG1 3.31Å; D92-T94 WeakPolarHBondContact OD1-CB 3.43Å; D92-T94 PolarHBondContact OD1-N 3.32Å; D92-T94 PolarHBondContact OD1-OG1 3.28Å; D92-T94 PolarHBondContact OD2-OG1 3.48Å
95	F	96.8	Very high	96.8	Very high	134 Å²	134	71.3 Å²	71.3	59%	0.588	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.2	168.8	-77.6	-101.9	0	0	0	109.6	P87 Y88 R89	P87-F95 HydrophobicContact CB-CD1 4.48Å; Y88-F95 WeakPolarHBondContact O-CA 3.44Å; R89-F95 HydrophobicContact CB-CD1 4.19Å; R89-F95 HydrophobicContact CB-CE1 3.83Å; R89-F95 HydrophobicContact CB-CE2 4.17Å; R89-F95 HydrophobicContact CB-CZ 3.83Å; R89-F95 HydrophobicContact CG-CD2 4.49Å; R89-F95 HydrophobicContact CG-CE2 4.07Å; R89-F95 HydrophobicContact CG-CZ 4.14Å
96	I	96.9	Very high	96.7	Very high	30 Å²	30	64.1 Å²	64.1	15%	0.154	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	147.7	176.1	-166.3	170.2	0	0	0	110.2	P87 Y88 R90 F98	P87-I96 WeakPolarHBondContact CA-O 3.35Å; Y88-I96 HydrophobicContact CD1-CG2 4.31Å; Y88-I96 HydrophobicContact CD2-CG2 4.05Å; Y88-I96 HydrophobicContact CE1-CG2 3.77Å; Y88-I96 HydrophobicContact CE2-CG2 3.48Å; Y88-I96 VanDerWaalsContact CE2-CG2 3.48Å; Y88-I96 HydrophobicContact CG-CG2 4.44Å; Y88-I96 PolarHBondContact N-O 3Å; Y88-I96 PolarHBondContact O-N 3.45Å; R90-I96 HydrophobicContact CG-CG2 4.42Å; I96-F98 HydrophobicContact CD1-CE2 4.47Å; I96-F98 HydrophobicContact CD1-CZ 4.31Å
97	Y	96.8	Very high	96.5	Very high	164 Å²	164	61.2 Å²	61.2	64%	0.643	29%	0.294	S	S	*	.			trans	-147.4	155.8	170.5	66.5	-83.3	0	0	0	109.5	P87	P87-Y97 HydrophobicContact CG-CD1 4.42Å; P87-Y97 HydrophobicContact CG-CG 4.37Å
98	F	97.5	Very high	95.9	Very high	17 Å²	17	64.9 Å²	64.9	8%	0.075	31%	0.31	C	S	.	.			trans	-106.8	161.8	176.6	-66.9	-93.2	0	0	0	111	R83 Q84 R85 I96 D100 P120 A122 A140	R83-F98 HydrophobicContact CB-CB 3.94Å; R83-F98 HydrophobicContact CB-CD1 4.22Å; R83-F98 HydrophobicContact CB-CD2 4.25Å; R83-F98 HydrophobicContact CB-CG 3.86Å; R83-F98 HydrophobicContact CG-CB 4.26Å; R83-F98 HydrophobicContact CG-CD1 3.63Å; R83-F98 HydrophobicContact CG-CD2 4.37Å; R83-F98 HydrophobicContact CG-CE1 4.05Å; R83-F98 HydrophobicContact CG-CG 3.81Å; Q84-F98 PolarHBondContact O-N 3.03Å; R85-F98 WeakPolarHBondContact CA-O 3.34Å; R85-F98 WeakPolarHBondContact CG-O 3.45Å; I96-F98 HydrophobicContact CD1-CE2 4.47Å; I96-F98 HydrophobicContact CD1-CZ 4.31Å; F98-D100 VanDerWaalsContact C-N 3.26Å; F98-D100 PolarHBondContact O-N 3.02Å; F98-P120 HydrophobicContact CD1-CG 4.37Å; F98-P120 HydrophobicContact CE1-CB 4.39Å; F98-P120 HydrophobicContact CE1-CG 4.31Å; F98-A122 HydrophobicContact CE2-CB 3.67Å; F98-A122 HydrophobicContact CZ-CB 3.6Å; F98-A140 HydrophobicContact CE1-CB 4.21Å; F98-A140 HydrophobicContact CZ-CB 4.27Å
99	E	97.6	Very high	95.3	Very high	165 Å²	165	70.8 Å²	70.8	77%	0.771	34%	0.336	S	S	*	.	S	Bend	trans	-62.2	-34.3	177.6	-173	-175.4	174	0	0	112.5	R85	R85-E99 WeakPolarHBondContact CG-O 3.07Å; R85-E99 PolarHBondContact NE-O 2.89Å; R85-E99 PolarHBondContact NH2-O 3.04Å
100	D	97.8	Very high	94.6	Very high	30 Å²	30	63.8 Å²	63.8	16%	0.16	31%	0.311	C	S	.	.	S	Bend	trans	-138.1	172.3	-176	72.8	-34.5	0	0	0	112.9	N27 R83 F98	N27-D100 PolarHBondContact ND2-OD2 2.87Å; R83-D100 IonicContact CZ-OD1 3.46Å; R83-D100 IonicContact NE-OD1 3.85Å; R83-D100 IonicContact NH1-OD1 3.61Å; R83-D100 PolarHBondContact NH1-OD1 3.32Å; R83-D100 IonicContact NH1-OD2 3.67Å; R83-D100 PolarHBondContact NH1-OD2 3.45Å; F98-D100 VanDerWaalsContact C-N 3.26Å; F98-D100 PolarHBondContact O-N 3.02Å
101	N	98.2	Very high	94.4	Very high	42 Å²	42	65.5 Å²	65.5	23%	0.225	32%	0.32	C	S	.	.			trans	-98.8	123	169.3	-60	-54.4	0	0	0	108.2	L20 I26 N27 Q84 R85	L20-N101 HydrophobicContact CD2-CB 3.96Å; I26-N101 HydrophobicContact CB-CB 4.07Å; I26-N101 HydrophobicContact CG2-CB 3.62Å; N27-N101 PolarHBondContact N-O 2.68Å; Q84-N101 WeakPolarHBondContact CA-OD1 3.09Å; R85-N101 PolarHBondContact N-OD1 2.84Å
102	A	98.1	Very high	94.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.8	-177.7	0	0	0	0	0	112.6	N27 A29 I82 R83	N27-A102 HydrophobicContact CB-CB 4.34Å; N27-A102 CarbonylContact O-C 3.58Å; N27-A102 VanDerWaalsContact O-CA 3.29Å; N27-A102 WeakPolarHBondContact O-CA 3.36Å; A29-A102 HydrophobicContact CB-CB 4.2Å; I82-A102 HydrophobicContact CD1-CB 4.22Å; I82-A102 HydrophobicContact CG1-CB 4.03Å; I82-A102 VanDerWaalsContact CG1-O 3.28Å; I82-A102 WeakPolarHBondContact CG1-O 3.27Å; I82-A102 PolarHBondContact N-O 2.79Å; R83-A102 HydrophobicContact CB-CB 4.13Å; R83-A102 PolarHBondContact N-O 2.84Å; R83-A102 PolarHBondContact O-N 3.41Å; R83-A102 VanDerWaalsContact O-N 3.13Å
103	G	97.7	Very high	94.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	165.8	174.5	0	0	0	0	0	112.6	N27 C28 A29 V80	N27-G103 PolarHBondContact O-N 2.7Å; C28-G103 WeakPolarHBondContact CA-O 3.33Å; A29-G103 PolarHBondContact N-O 3.19Å; V80-G103 CarbonylContact O-C 3.56Å; V80-G103 WeakPolarHBondContact O-CA 3.3Å
104	V	97.4	Very high	94.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.9	178	-75.6	0	0	0	0	110.2	A29 D30 A79 V80 I82 I117 V132	A29-V104 HydrophobicContact CB-CG1 4.18Å; D30-V104 HydrophobicContact CB-CB 4.37Å; D30-V104 HydrophobicContact CB-CG1 3.94Å; A79-V104 CarbonylContact C-O 3.49Å; A79-V104 WeakPolarHBondContact CA-O 3.43Å; A79-V104 VanDerWaalsContact CB-O 3.32Å; A79-V104 WeakPolarHBondContact CB-O 3.37Å; V80-V104 HydrophobicContact CB-CG2 4.4Å; V80-V104 PolarHBondContact N-O 3.03Å; V80-V104 PolarHBondContact O-N 3.45Å; I82-V104 HydrophobicContact CD1-CG1 4.34Å; I82-V104 HydrophobicContact CG2-CG1 4.49Å; I82-V104 HydrophobicContact CG2-CG2 3.63Å; V104-I117 HydrophobicContact CG1-CD1 4.22Å; V104-I117 HydrophobicContact CG1-CG1 4.1Å; V104-I117 HydrophobicContact CG1-CG2 4.22Å; V104-V132 HydrophobicContact CG2-CG1 4.25Å; V104-V132 HydrophobicContact CG2-CG2 4.28Å
105	I	97	Very high	94.2	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	131.5	-179.3	-64.9	161.2	0	0	0	109	D30 T32 A34 L37 V65 M77 Q78 K113	D30-I105 WeakPolarHBondContact OD2-CB 3.44Å; D30-I105 PolarHBondContact OD2-N 2.92Å; T32-I105 WeakPolarHBondContact OG1-CD1 3.49Å; A34-I105 HydrophobicContact CB-CD1 3.67Å; L37-I105 HydrophobicContact CD1-CG1 4.41Å; L37-I105 HydrophobicContact CD2-CD1 4.01Å; L37-I105 HydrophobicContact CD2-CG1 3.92Å; V65-I105 HydrophobicContact CG2-CD1 4.38Å; M77-I105 HydrophobicContact CG-CG2 4.44Å; M77-I105 HydrophobicContact SD-CB 4.44Å; M77-I105 HydrophobicContact SD-CD1 3.46Å; M77-I105 WeakPolarHBondContact SD-CD1 3.48Å; M77-I105 HydrophobicContact SD-CG1 3.73Å; M77-I105 HydrophobicContact SD-CG2 3.8Å; Q78-I105 WeakPolarHBondContact O-CA 3.48Å; I105-K113 HydrophobicContact CB-CB 4.49Å; I105-K113 HydrophobicContact CG2-CB 4Å; I105-K113 HydrophobicContact CG2-CD 4.12Å; I105-K113 PolarHBondContact O-N 2.79Å
106	V	95.8	Very high	94.1	Very high	7 Å²	7	55 Å²	55	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	163.2	-179	-60.7	0	0	0	0	111.2	M60 Q78 V80 E111	M60-V106 HydrophobicContact CE-CG2 3.89Å; Q78-V106 HydrophobicContact CB-CG2 4Å; Q78-V106 PolarHBondContact O-N 3.06Å; V80-V106 HydrophobicContact CB-CG1 4.4Å; V80-V106 HydrophobicContact CG2-CG1 3.92Å; V80-V106 HydrophobicContact CG2-CG2 3.89Å; V106-E111 CarbonylContact C-O 3.59Å; V106-E111 VanDerWaalsContact CA-O 3.23Å; V106-E111 WeakPolarHBondContact CA-O 3.37Å; V106-E111 WeakPolarHBondContact CB-O 3.39Å
107	N	92.8	Very high	94.1	Very high	60 Å²	60	54 Å²	54	32%	0.321	27%	0.274	S	S	.	.			trans	-86.3	178.4	167.7	73	11	0	0	0	111.6	Q78 K109 G110 E111	Q78-N107 PolarHBondContact OE1-O 3.03Å; N107-K109 PolarHBondContact O-N 2.79Å; N107-K109 WeakPolarHBondContact OD1-CA 3.33Å; N107-K109 WeakPolarHBondContact OD1-CB 3.42Å; N107-K109 PolarHBondContact OD1-N 3.07Å; N107-G110 PolarHBondContact O-N 2.9Å; N107-G110 PolarHBondContact OD1-N 2.78Å; N107-G110 VanDerWaalsContact OD1-N 3.09Å; N107-E111 PolarHBondContact N-O 3.48Å; N107-E111 PolarHBondContact ND2-OE2 3.31Å; N107-E111 PolarHBondContact OD1-N 2.78Å; N107-E111 PolarHBondContact OD1-O 2.83Å
108	N	85.5	Confident	94	Very high	134 Å²	134	51 Å²	51	72%	0.717	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.9	178	-63.3	4.5	0	0	0	114.5	Q78	Q78-N108 PolarHBondContact NE2-OD1 2.89Å; Q78-N108 VanDerWaalsContact OE1-CA 3.28Å
109	K	84.4	Confident	93.9	Very high	125 Å²	125	51.4 Å²	51.4	54%	0.543	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.4	177.5	-62.4	179.7	-179.8	174.8	0	112.2	G8 N107 E111	G8-K109 WeakPolarHBondContact CA-O 3.48Å; G8-K109 PolarHBondContact N-O 2.82Å; N107-K109 PolarHBondContact O-N 2.79Å; N107-K109 WeakPolarHBondContact OD1-CA 3.33Å; N107-K109 WeakPolarHBondContact OD1-CB 3.42Å; N107-K109 PolarHBondContact OD1-N 3.07Å; K109-E111 HydrophobicContact CB-CG 4.2Å
110	G	83.3	Confident	93.9	Very high	4 Å²	4	45.6 Å²	45.6	4%	0.041	26%	0.258	C	S	.	.	S	Bend	trans	83	13.6	-173.1	0	0	0	0	0	114.1	N107	N107-G110 PolarHBondContact O-N 2.9Å; N107-G110 PolarHBondContact OD1-N 2.78Å; N107-G110 VanDerWaalsContact OD1-N 3.09Å
111	E	90.6	Very high	93.8	Very high	77 Å²	77	44.2 Å²	44.2	36%	0.36	25%	0.25	S	C	.	.			trans	-83.2	138	172.8	-52.6	169.5	142.8	0	0	109	V106 N107 K109 R131	V106-E111 CarbonylContact C-O 3.59Å; V106-E111 VanDerWaalsContact CA-O 3.23Å; V106-E111 WeakPolarHBondContact CA-O 3.37Å; V106-E111 WeakPolarHBondContact CB-O 3.39Å; N107-E111 PolarHBondContact N-O 3.48Å; N107-E111 PolarHBondContact ND2-OE2 3.31Å; N107-E111 PolarHBondContact OD1-N 2.78Å; N107-E111 PolarHBondContact OD1-O 2.83Å; K109-E111 HydrophobicContact CB-CG 4.2Å; E111-R131 HydrophobicContact CG-CG 4.35Å
112	M	93.1	Very high	93.8	Very high	26 Å²	26	42.2 Å²	42.2	13%	0.128	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-66.3	140.1	-179.4	-69.5	176.1	54.4	0	0	111.5	G114 I117 V132 N135	M112-G114 WeakPolarHBondContact CB-O 3.37Å; M112-I117 HydrophobicContact CE-CD1 3.91Å; M112-I117 HydrophobicContact CE-CG1 3.37Å; M112-I117 HydrophobicContact SD-CD1 3.74Å; M112-I117 HydrophobicContact SD-CG1 3.89Å; M112-V132 HydrophobicContact CG-CG2 3.94Å; M112-V132 HydrophobicContact SD-CB 4.42Å; M112-V132 HydrophobicContact SD-CG2 4.24Å; M112-N135 HydrophobicContact CE-CB 4.25Å; M112-N135 HydrophobicContact SD-CB 3.89Å
113	K	94	Very high	93.7	Very high	126 Å²	126	47.2 Å²	47.2	55%	0.548	26%	0.261	S	S	.	.	S	Bend	trans	-78.4	-35.2	169.8	-173.5	177.1	-179.5	179	0	111.8	T32 I105	T32-K113 HydrophobicContact CG2-CB 3.98Å; T32-K113 HydrophobicContact CG2-CD 4.36Å; T32-K113 HydrophobicContact CG2-CG 4.02Å; I105-K113 HydrophobicContact CB-CB 4.49Å; I105-K113 HydrophobicContact CG2-CB 4Å; I105-K113 HydrophobicContact CG2-CD 4.12Å; I105-K113 PolarHBondContact O-N 2.79Å
114	G	93	Very high	93.5	Very high	9 Å²	9	48.9 Å²	48.9	9%	0.093	27%	0.269	C	S	.	.	S	Bend	trans	-79.3	169.3	171.9	0	0	0	0	0	112	N31 T32 M112	N31-G114 WeakPolarHBondContact OD1-CA 3.43Å; T32-G114 VanDerWaalsContact CG2-N 3.35Å; M112-G114 WeakPolarHBondContact CB-O 3.37Å
115	S	94.3	Very high	93.4	Very high	90 Å²	90	48.9 Å²	48.9	63%	0.629	27%	0.269	S	S	*	.	S	Bend	trans	-98.8	-24.5	-179.8	-49.2	0	0	0	0	113.3	N31 N135	N31-S115 PolarHBondContact OD1-N 2.94Å; S115-N135 PolarHBondContact O-OD1 3.39Å
116	A	94.5	Very high	93.3	Very high	47 Å²	47	49.2 Å²	49.2	39%	0.388	27%	0.272	S	S	.	.			trans	-144.4	151.2	-175.4	0	0	0	0	0	111.5	D30 N31	D30-A116 WeakPolarHBondContact CA-O 3.45Å; N31-A116 PolarHBondContact N-O 2.94Å; N31-A116 PolarHBondContact OD1-N 3.49Å
117	I	96.3	Very high	93.2	Very high	9 Å²	9	53.6 Å²	53.6	5%	0.046	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.1	175.9	-51.4	-179.4	0	0	0	109.7	A29 I82 V104 M112 V121 V132 N135 A136	A29-I117 HydrophobicContact CB-CG2 4.02Å; A29-I117 WeakPolarHBondContact O-CA 3.35Å; I82-I117 HydrophobicContact CD1-CG2 3.8Å; V104-I117 HydrophobicContact CG1-CD1 4.22Å; V104-I117 HydrophobicContact CG1-CG1 4.1Å; V104-I117 HydrophobicContact CG1-CG2 4.22Å; M112-I117 HydrophobicContact CE-CD1 3.91Å; M112-I117 HydrophobicContact CE-CG1 3.37Å; M112-I117 HydrophobicContact SD-CD1 3.74Å; M112-I117 HydrophobicContact SD-CG1 3.89Å; I117-V121 HydrophobicContact CD1-CG2 3.87Å; I117-V121 HydrophobicContact CG2-CG2 3.94Å; I117-V132 HydrophobicContact CD1-CB 4.48Å; I117-V132 HydrophobicContact CD1-CG1 3.55Å; I117-V132 WeakPolarHBondContact CD1-O 3.37Å; I117-N135 PolarHBondContact N-O 2.89Å; I117-A136 HydrophobicContact CD1-CB 4.44Å
118	T	95.6	Very high	93.2	Very high	101 Å²	101	51.3 Å²	51.3	62%	0.62	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	124.9	172	-50.9	0	0	0	0	110.4	A29 R83	A29-T118 PolarHBondContact O-N 3.1Å; R83-T118 PolarHBondContact NH2-O 2.92Å
119	G	95.1	Very high	93.5	Very high	24 Å²	24	45.8 Å²	45.8	25%	0.247	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.1	-173	176.3	0	0	0	0	0	114.3	S137	G119-S137 PolarHBondContact O-OG 3.23Å
120	P	96.5	Very high	93.9	Very high	44 Å²	44	43 Å²	43	29%	0.286	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	154.1	-174.3	29.6	-33.9	0	0	0	112.6	R83 F98 S138	R83-P120 WeakPolarHBondContact CD-O 3.39Å; R83-P120 WeakPolarHBondContact CG-O 3.22Å; R83-P120 PolarHBondContact NE-O 2.91Å; F98-P120 HydrophobicContact CD1-CG 4.37Å; F98-P120 HydrophobicContact CE1-CB 4.39Å; F98-P120 HydrophobicContact CE1-CG 4.31Å; P120-S138 WeakPolarHBondContact CA-O 3.25Å; P120-S138 WeakPolarHBondContact CA-OG 3.49Å; P120-S138 WeakPolarHBondContact CB-OG 3.45Å
121	V	97.2	Very high	94.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.6	171.4	174.7	0	0	0	0	108.5	I82 I117 C125 V132 A136 S138 V139 A140	I82-V121 HydrophobicContact CB-CG1 4.16Å; I82-V121 HydrophobicContact CB-CG2 4.29Å; I82-V121 HydrophobicContact CD1-CG2 4.12Å; I82-V121 HydrophobicContact CG2-CG1 4.25Å; I82-V121 HydrophobicContact CG2-CG2 4.42Å; I117-V121 HydrophobicContact CD1-CG2 3.87Å; I117-V121 HydrophobicContact CG2-CG2 3.94Å; V121-C125 HydrophobicContact CG1-CB 3.93Å; V121-V132 HydrophobicContact CG1-CG1 4.25Å; V121-A136 HydrophobicContact CB-CB 3.97Å; V121-A136 HydrophobicContact CG2-CB 3.62Å; V121-S138 PolarHBondContact N-O 3.19Å; V121-V139 CarbonylContact O-C 3.56Å; V121-V139 VanDerWaalsContact O-CA 3.28Å; V121-V139 WeakPolarHBondContact O-CA 3.49Å; V121-A140 PolarHBondContact O-N 3.38Å
122	A	97.1	Very high	94.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.256	C	S	.	.			trans	-68.7	144.2	175.6	0	0	0	0	0	112.2	V57 I82 Y88 F98 E124 C125 A126 A140	V57-A122 HydrophobicContact CG1-CB 3.44Å; V57-A122 VanDerWaalsContact CG1-CB 3.44Å; I82-A122 WeakPolarHBondContact O-CB 3.17Å; I82-A122 PolarHBondContact O-N 3.19Å; I82-A122 VanDerWaalsContact O-N 3.1Å; Y88-A122 WeakPolarHBondContact OH-CB 3.18Å; F98-A122 HydrophobicContact CE2-CB 3.67Å; F98-A122 HydrophobicContact CZ-CB 3.6Å; A122-E124 PolarHBondContact O-N 3.19Å; A122-C125 WeakPolarHBondContact O-CA 3.31Å; A122-C125 WeakPolarHBondContact O-CB 3.47Å; A122-C125 PolarHBondContact O-N 2.83Å; A122-A126 PolarHBondContact O-N 3.48Å; A122-A140 CarbonylContact C-O 3.51Å; A122-A140 WeakPolarHBondContact CA-O 3.43Å
123	K	95.5	Very high	94.4	Very high	106 Å²	106	46.7 Å²	46.7	46%	0.461	26%	0.262	S	S	.	.	H	α-helix	trans	-51.5	-42.8	174.7	-176.3	176.4	179.8	177.4	0	112.4	C125 A126 D127 V139 A140	K123-C125 PolarHBondContact O-N 3.34Å; K123-A126 PolarHBondContact O-N 3.02Å; K123-D127 VanDerWaalsContact O-CG 3.28Å; K123-D127 PolarHBondContact O-N 3.03Å; K123-V139 HydrophobicContact CB-CG1 4.17Å; K123-A140 WeakPolarHBondContact CB-O 2.99Å; K123-A140 PolarHBondContact N-O 3.09Å
124	E	95.1	Very high	94.3	Very high	34 Å²	34	44.2 Å²	44.2	16%	0.159	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-29.9	179.7	-64	74.2	-163.1	0	0	112.5	Y88 R90 A122 L128	Y88-E124 HydrophobicContact CE2-CG 4.15Å; Y88-E124 WeakPolarHBondContact CE2-OE2 3.49Å; Y88-E124 PolarHBondContact OH-OE2 2.83Å; R90-E124 WeakPolarHBondContact CG-OE1 3.4Å; R90-E124 IonicContact CZ-OE1 2.87Å; R90-E124 IonicContact NE-OE1 3.97Å; R90-E124 PolarHBondContact NE-OE1 3.32Å; R90-E124 IonicContact NE-OE2 2.65Å; R90-E124 IonicContact NH2-OE1 3.45Å; R90-E124 IonicContact NH2-OE2 3.48Å; R90-E124 PolarHBondContact NH2-OE2 3.04Å; A122-E124 PolarHBondContact O-N 3.19Å; E124-L128 VanDerWaalsContact O-CD1 3.27Å; E124-L128 WeakPolarHBondContact O-CD1 3.25Å; E124-L128 VanDerWaalsContact O-CG 3.3Å; E124-L128 WeakPolarHBondContact O-CG 3.07Å
125	C	95	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-79.8	-41.6	172.9	-176.2	0	0	0	0	111.5	V57 V80 V121 A122 K123 D127 L128 W129	V57-C125 HydrophobicContact CG1-CB 3.88Å; V80-C125 VanDerWaalsContact CG1-SG 3.58Å; V121-C125 HydrophobicContact CG1-CB 3.93Å; A122-C125 WeakPolarHBondContact O-CA 3.31Å; A122-C125 WeakPolarHBondContact O-CB 3.47Å; A122-C125 PolarHBondContact O-N 2.83Å; K123-C125 PolarHBondContact O-N 3.34Å; C125-D127 VanDerWaalsContact C-N 3.35Å; C125-D127 PolarHBondContact O-N 3.06Å; C125-L128 PolarHBondContact O-N 2.79Å; C125-W129 PolarHBondContact O-N 2.72Å
126	A	94.2	Very high	94.3	Very high	11 Å²	11	43.7 Å²	43.7	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-41.3	-179.1	0	0	0	0	0	112.2	A122 K123 L128 W129 A133 V139	A122-A126 PolarHBondContact O-N 3.48Å; K123-A126 PolarHBondContact O-N 3.02Å; A126-L128 VanDerWaalsContact C-N 3.25Å; A126-L128 PolarHBondContact O-N 3.39Å; A126-W129 PolarHBondContact O-N 2.74Å; A126-A133 HydrophobicContact CB-CB 3.78Å; A126-V139 HydrophobicContact CB-CG1 3.68Å; A126-V139 HydrophobicContact CB-CG2 4.04Å
127	D	93.2	Very high	94.2	Very high	99 Å²	99	45.6 Å²	45.6	53%	0.529	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.5	178.7	-68.7	-13.4	0	0	0	112.5	S10 K123 C125	S10-D127 PolarHBondContact OG-O 2.77Å; K123-D127 VanDerWaalsContact O-CG 3.28Å; K123-D127 PolarHBondContact O-N 3.03Å; C125-D127 VanDerWaalsContact C-N 3.35Å; C125-D127 PolarHBondContact O-N 3.06Å
128	L	92.8	Very high	94.1	Very high	12 Å²	12	48 Å²	48	6%	0.063	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-25.9	-177.7	-67.6	173.4	0	0	0	113.9	T9 S10 K13 E124 C125 A126	T9-L128 CarbonylContact C-O 3.54Å; T9-L128 WeakPolarHBondContact CA-O 3.36Å; S10-L128 PolarHBondContact N-O 3.27Å; S10-L128 WeakPolarHBondContact O-CD2 3.35Å; S10-L128 PolarHBondContact OG-O 2.92Å; S10-L128 VanDerWaalsContact OG-O 3.08Å; K13-L128 HydrophobicContact CB-CD1 3.7Å; K13-L128 HydrophobicContact CB-CD2 4.37Å; K13-L128 HydrophobicContact CD-CD1 4.08Å; K13-L128 HydrophobicContact CG-CD1 3.92Å; E124-L128 VanDerWaalsContact O-CD1 3.27Å; E124-L128 WeakPolarHBondContact O-CD1 3.25Å; E124-L128 VanDerWaalsContact O-CG 3.3Å; E124-L128 WeakPolarHBondContact O-CG 3.07Å; C125-L128 PolarHBondContact O-N 2.79Å; A126-L128 VanDerWaalsContact C-N 3.25Å; A126-L128 PolarHBondContact O-N 3.39Å
129	W	93.4	Very high	94.1	Very high	17 Å²	17	46.8 Å²	46.8	6%	0.064	28%	0.276	C	S	.	.			trans	-131	88.3	-170.5	-60.5	105.8	0	0	0	110.4	G58 M60 V80 C125 A126 R131 V132 A133	G58-W129 PolarHBondContact O-NE1 2.82Å; M60-W129 HydrophobicContact CB-CZ2 4.2Å; M60-W129 HydrophobicContact CE-CH2 3.41Å; M60-W129 VanDerWaalsContact CE-CH2 3.41Å; M60-W129 HydrophobicContact CE-CZ2 4.1Å; M60-W129 HydrophobicContact CE-CZ3 3.89Å; V80-W129 HydrophobicContact CG1-CG 4.28Å; V80-W129 HydrophobicContact CG2-CD2 4.21Å; V80-W129 HydrophobicContact CG2-CZ2 4.17Å; C125-W129 PolarHBondContact O-N 2.72Å; A126-W129 PolarHBondContact O-N 2.74Å; W129-R131 VanDerWaalsContact C-N 3.26Å; W129-R131 PolarHBondContact O-N 3.5Å; W129-R131 VanDerWaalsContact O-N 3.16Å; W129-V132 HydrophobicContact CB-CB 3.82Å; W129-V132 HydrophobicContact CB-CG2 3.73Å; W129-V132 HydrophobicContact CG-CG2 4.46Å; W129-V132 WeakPolarHBondContact O-CB 3.39Å; W129-V132 PolarHBondContact O-N 3.43Å; W129-A133 PolarHBondContact O-N 3.02Å
130	P	91.1	Very high	93.8	Very high	68 Å²	68	48.1 Å²	48.1	44%	0.442	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-34.5	-172.6	-26	34.9	0	0	0	113.5	S10 A133 A134	S10-P130 WeakPolarHBondContact OG-CD 3.48Å; P130-A133 PolarHBondContact O-N 3.03Å; P130-A134 WeakPolarHBondContact O-CB 3.44Å; P130-A134 PolarHBondContact O-N 2.95Å
131	R	91.2	Very high	93.7	Very high	152 Å²	152	48.4 Å²	48.4	57%	0.574	29%	0.285	S	S	*	.	H	α-helix	trans	-72.7	-28.3	177.6	-64.3	-60	-170.4	-175.4	0.6	113.1	E111 W129 N135	E111-R131 HydrophobicContact CG-CG 4.35Å; W129-R131 VanDerWaalsContact C-N 3.26Å; W129-R131 PolarHBondContact O-N 3.5Å; W129-R131 VanDerWaalsContact O-N 3.16Å; R131-N135 PolarHBondContact O-ND2 3.38Å
132	V	93.7	Very high	93.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-74.5	-44.8	173.1	177.9	0	0	0	0	109.2	I82 V104 M112 I117 V121 W129 A134 N135 A136	I82-V132 HydrophobicContact CG2-CG1 3.94Å; V104-V132 HydrophobicContact CG2-CG1 4.25Å; V104-V132 HydrophobicContact CG2-CG2 4.28Å; M112-V132 HydrophobicContact CG-CG2 3.94Å; M112-V132 HydrophobicContact SD-CB 4.42Å; M112-V132 HydrophobicContact SD-CG2 4.24Å; I117-V132 HydrophobicContact CD1-CB 4.48Å; I117-V132 HydrophobicContact CD1-CG1 3.55Å; I117-V132 WeakPolarHBondContact CD1-O 3.37Å; V121-V132 HydrophobicContact CG1-CG1 4.25Å; W129-V132 HydrophobicContact CB-CB 3.82Å; W129-V132 HydrophobicContact CB-CG2 3.73Å; W129-V132 HydrophobicContact CG-CG2 4.46Å; W129-V132 WeakPolarHBondContact O-CB 3.39Å; W129-V132 PolarHBondContact O-N 3.43Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.79Å; V132-N135 PolarHBondContact O-N 3.49Å; V132-A136 PolarHBondContact O-N 3.2Å
133	A	92.9	Very high	93.3	Very high	31 Å²	31	53.7 Å²	53.7	26%	0.256	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-45	176	0	0	0	0	0	112.4	A126 W129 P130 N135 A136	A126-A133 HydrophobicContact CB-CB 3.78Å; W129-A133 PolarHBondContact O-N 3.02Å; P130-A133 PolarHBondContact O-N 3.03Å; A133-N135 PolarHBondContact O-N 3.11Å; A133-A136 WeakPolarHBondContact O-CB 3.33Å; A133-A136 PolarHBondContact O-N 3.31Å
134	A	92.1	Very high	93.2	Very high	75 Å²	75	50.6 Å²	50.6	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-64.5	-25	-177.6	0	0	0	0	0	114.4	P130 V132	P130-A134 WeakPolarHBondContact O-CB 3.44Å; P130-A134 PolarHBondContact O-N 2.95Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.79Å
135	N	93.8	Very high	93.1	Very high	68 Å²	68	51.7 Å²	51.7	36%	0.364	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	8.3	-179.9	-62.3	-66.4	0	0	0	112.7	M112 S115 I117 R131 V132 A133	M112-N135 HydrophobicContact CE-CB 4.25Å; M112-N135 HydrophobicContact SD-CB 3.89Å; S115-N135 PolarHBondContact O-OD1 3.39Å; I117-N135 PolarHBondContact N-O 2.89Å; R131-N135 PolarHBondContact O-ND2 3.38Å; V132-N135 PolarHBondContact O-N 3.49Å; A133-N135 PolarHBondContact O-N 3.11Å
136	A	94.1	Very high	93	Very high	20 Å²	20	55.1 Å²	55.1	17%	0.165	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	135.6	176.1	0	0	0	0	0	110.3	I117 V121 V132 A133 V139	I117-A136 HydrophobicContact CD1-CB 4.44Å; V121-A136 HydrophobicContact CB-CB 3.97Å; V121-A136 HydrophobicContact CG2-CB 3.62Å; V132-A136 PolarHBondContact O-N 3.2Å; A133-A136 WeakPolarHBondContact O-CB 3.33Å; A133-A136 PolarHBondContact O-N 3.31Å; A136-V139 HydrophobicContact CB-CG2 4.2Å
137	S	91.7	Very high	92.9	Very high	87 Å²	87	58.3 Å²	58.3	61%	0.608	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	-37.6	174.8	60.1	0	0	0	0	112.6	G119	G119-S137 PolarHBondContact O-OG 3.23Å
138	S	94.6	Very high	92.8	Very high	59 Å²	59	55.2 Å²	55.2	41%	0.413	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	146.5	176.9	61.9	0	0	0	0	110	P120 V121	P120-S138 WeakPolarHBondContact CA-O 3.25Å; P120-S138 WeakPolarHBondContact CA-OG 3.49Å; P120-S138 WeakPolarHBondContact CB-OG 3.45Å; V121-S138 PolarHBondContact N-O 3.19Å
139	V	95.1	Very high	92.8	Very high	76 Å²	76	58.8 Å²	58.8	46%	0.461	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.3	175	-178.9	0	0	0	0	109.2	V121 K123 A126 A136	V121-V139 CarbonylContact O-C 3.56Å; V121-V139 VanDerWaalsContact O-CA 3.28Å; V121-V139 WeakPolarHBondContact O-CA 3.49Å; K123-V139 HydrophobicContact CB-CG1 4.17Å; A126-V139 HydrophobicContact CB-CG1 3.68Å; A126-V139 HydrophobicContact CB-CG2 4.04Å; A136-V139 HydrophobicContact CB-CG2 4.2Å
140	A	90.5	Very high	92.8	Very high	52 Å²	52	62.5 Å²	62.5	43%	0.43	39%	0.394	S	S	.	.			trans	-115.2	0	-177.8	0	0	0	0	0	111.9	R90 F98 V121 A122 K123	R90-A140 VanDerWaalsContact CZ-OXT 3.24Å; R90-A140 PolarHBondContact NH1-OXT 3.06Å; R90-A140 PolarHBondContact NH2-O 2.94Å; R90-A140 PolarHBondContact NH2-OXT 3.29Å; F98-A140 HydrophobicContact CE1-CB 4.21Å; F98-A140 HydrophobicContact CZ-CB 4.27Å; V121-A140 PolarHBondContact O-N 3.38Å; A122-A140 CarbonylContact C-O 3.51Å; A122-A140 WeakPolarHBondContact CA-O 3.43Å; K123-A140 WeakPolarHBondContact CB-O 2.99Å; K123-A140 PolarHBondContact N-O 3.09Å

Retrieved 140 of 140 residues in 73.8 ms (Link to these results)

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