A0AA82N7V4_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7V4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 130 aa.

						>A0AA82N7V4_SCHMA|A0AA82N7V4
MNGFVNKSLDHQYVSLKFSNQYYHSYVNNFMIDSKDEISMSRERYLGFIITRLSGTSCSELEVLDDNVMAKTTCLLDPNRKISSYYVDISKEIEESGWQSKIDRAFVCGTNITASVILVPERWVETAMLM
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	31.4	Very low	47.9	Very low	207 Å²	207	119.3 Å²	119.3	100%	1.02	65%	0.645	S	S	*	*				0	99.7	0	-160.7	177.6	117.6	0	0	106.1	G3	M1-G3 PolarHBondContact O-N 3.08Å
2	N	33.8	Very low	49.9	Very low	135 Å²	135	113.8 Å²	113.8	72%	0.722	61%	0.612	S	S	*	*			trans	-74.2	108.9	-178.8	-69.1	-2.9	0	0	0	108.2	F4	N2-F4 HydrophobicContact CB-CE2 4.41Å
3	G	40.9	Very low	52.2	Low	65 Å²	65	118.5 Å²	118.5	67%	0.67	62%	0.618	S	S	*	*			trans	-92.6	107.1	165.7	0	0	0	0	0	107.5	M1	M1-G3 PolarHBondContact O-N 3.08Å
4	F	45.4	Very low	53.8	Low	179 Å²	179	112.2 Å²	112.2	79%	0.785	59%	0.587	S	S	*	*			trans	-71.3	128.5	164.3	-69.6	-84	0	0	0	107.5	N2	N2-F4 HydrophobicContact CB-CE2 4.41Å
5	V	45.5	Very low	55.1	Low	66 Å²	66	111.9 Å²	111.9	40%	0.4	60%	0.598	S	S	.	*			trans	-102.7	103.4	-178.4	175.5	0	0	0	0	106.9	Q12 V14	V5-Q12 HydrophobicContact CG1-CG 4.06Å; V5-V14 HydrophobicContact CG1-CG2 4.4Å; V5-V14 HydrophobicContact CG2-CG2 4.23Å
6	N	45.9	Very low	56.1	Low	120 Å²	120	107.2 Å²	107.2	64%	0.642	57%	0.573	S	S	*	*			trans	-77.2	123.1	171.4	-90.5	-4.9	0	0	0	109.1	Q12	N6-Q12 PolarHBondContact O-NE2 3.27Å; N6-Q12 PolarHBondContact O-OE1 3.3Å
7	K	50	Low	57.2	Low	78 Å²	78	111.6 Å²	111.6	34%	0.339	59%	0.585	S	S	.	*			trans	-66.4	146.2	-176	-86	-170.1	173.7	-168.8	0	112.6	D33 D36 C58	K7-D33 PolarHBondContact NZ-O 2.94Å; K7-D36 WeakPolarHBondContact CE-OD1 3.41Å; K7-D36 IonicContact NZ-OD1 2.63Å; K7-D36 PolarHBondContact NZ-OD1 3.38Å; K7-D36 IonicContact NZ-OD2 2.85Å; K7-D36 PolarHBondContact NZ-OD2 2.94Å; K7-C58 PolarHBondContact NZ-O 2.85Å
8	S	45.4	Very low	58	Low	86 Å²	86	109.1 Å²	109.1	60%	0.601	57%	0.569	S	S	*	*			trans	-120.4	154.1	161	177.9	0	0	0	0	108.9	D10	S8-D10 VanDerWaalsContact C-N 3.29Å; S8-D10 PolarHBondContact O-N 2.81Å; S8-D10 VanDerWaalsContact O-N 3.12Å
9	L	54.2	Low	58.7	Low	150 Å²	150	107.3 Å²	107.3	79%	0.785	57%	0.567	S	S	*	*	S	Bend	trans	-59.5	-20.1	-164.3	-91.2	152.6	0	0	0	117.1	S34	L9-S34 VanDerWaalsContact O-CB 3.31Å; L9-S34 WeakPolarHBondContact O-CB 3.29Å; L9-S34 PolarHBondContact O-OG 2.84Å
10	D	63.2	Low	59.3	Low	123 Å²	123	102 Å²	102	66%	0.658	54%	0.539	S	S	*	.	S	Bend	trans	-102.2	-79.2	-174.5	-78	-35	0	0	0	112.2	S8	S8-D10 VanDerWaalsContact C-N 3.29Å; S8-D10 PolarHBondContact O-N 2.81Å; S8-D10 VanDerWaalsContact O-N 3.12Å
11	H	71.3	Confident	60.3	Low	103 Å²	103	98.8 Å²	98.8	48%	0.477	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	139.1	-177.4	-60	86.7	0	0	0	109	M31	H11-M31 HydrophobicContact CB-CG 4.11Å; H11-M31 HydrophobicContact CB-SD 3.99Å; H11-M31 VanDerWaalsContact CD2-SD 3.58Å
12	Q	71.9	Confident	62.5	Low	53 Å²	53	89.5 Å²	89.5	25%	0.248	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.9	177.9	-164.1	164.7	25.4	0	0	110.8	V5 N6 M31 I32	V5-Q12 HydrophobicContact CG1-CG 4.06Å; N6-Q12 PolarHBondContact O-NE2 3.27Å; N6-Q12 PolarHBondContact O-OE1 3.3Å; Q12-M31 CarbonylContact O-C 3.5Å; Q12-M31 WeakPolarHBondContact O-CA 3.38Å; Q12-I32 PolarHBondContact N-O 2.8Å; Q12-I32 PolarHBondContact O-N 2.82Å
13	Y	79.3	Confident	64.8	Low	176 Å²	176	86.4 Å²	86.4	69%	0.69	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.3	176.5	-64.8	-81.5	0	0	0	110.2	F30 M31	Y13-F30 CarbonylContact C-O 3.55Å; Y13-F30 WeakPolarHBondContact CA-O 3.22Å; Y13-M31 HydrophobicContact CD1-CB 4.26Å; Y13-M31 HydrophobicContact CD1-CG 4.37Å; Y13-M31 HydrophobicContact CE1-CB 4.23Å; Y13-M31 HydrophobicContact CE1-CG 4.12Å; Y13-M31 HydrophobicContact CE1-SD 4.05Å
14	V	74.8	Confident	66.7	Low	30 Å²	30	91.3 Å²	91.3	18%	0.182	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.4	177.3	-179.9	0	0	0	0	108.5	V5 L16 F30 I32	V5-V14 HydrophobicContact CG1-CG2 4.4Å; V5-V14 HydrophobicContact CG2-CG2 4.23Å; V14-L16 HydrophobicContact CG1-CD2 4.22Å; V14-F30 HydrophobicContact CB-CB 4.05Å; V14-F30 PolarHBondContact N-O 2.91Å; V14-F30 PolarHBondContact O-N 2.92Å; V14-I32 HydrophobicContact CG2-CD1 3.96Å; V14-I32 HydrophobicContact CG2-CG1 4.31Å
15	S	73.8	Confident	68.6	Low	107 Å²	107	84.2 Å²	84.2	75%	0.748	43%	0.431	S	S	*	.			trans	-94.7	113.9	173.4	-168.8	0	0	0	0	109.6
16	L	70.9	Confident	70.5	Confident	37 Å²	37	87 Å²	87	19%	0.194	44%	0.435	C	S	.	.			trans	-77.6	142.4	174.5	-61.6	-177.6	0	0	0	110.6	V14 F18 N20 F30 L76	V14-L16 HydrophobicContact CG1-CD2 4.22Å; L16-F18 HydrophobicContact CB-CE1 4.43Å; L16-F18 HydrophobicContact CB-CZ 4.42Å; L16-F18 WeakPolarHBondContact CB-O 3.46Å; L16-F18 HydrophobicContact CD1-CD2 4.39Å; L16-F18 HydrophobicContact CD1-CE2 3.78Å; L16-F18 HydrophobicContact CD1-CZ 3.97Å; L16-F18 HydrophobicContact CD2-CE1 4.27Å; L16-F18 HydrophobicContact CD2-CZ 3.99Å; L16-F18 HydrophobicContact CG-CZ 4.37Å; L16-F18 PolarHBondContact O-N 3.01Å; L16-N20 HydrophobicContact CD1-CB 4.04Å; L16-F30 HydrophobicContact CD1-CD2 3.83Å; L16-F30 HydrophobicContact CD1-CE2 3.24Å; L16-F30 HydrophobicContact CD1-CZ 3.66Å; L16-F30 HydrophobicContact CG-CD2 3.91Å; L16-F30 HydrophobicContact CG-CE2 3.81Å; L16-L76 HydrophobicContact CD1-CB 4.5Å; L16-L76 HydrophobicContact CD1-CD1 4.24Å; L16-L76 HydrophobicContact CD2-CB 4.45Å; L16-L76 HydrophobicContact CD2-CD1 3.99Å
17	K	74.3	Confident	72.2	Confident	182 Å²	182	81.5 Å²	81.5	79%	0.791	41%	0.406	S	S	*	.	S	Bend	trans	-79.9	-0.6	173.6	-65.3	-174.5	179.4	-177.5	0	113.3
18	F	72.7	Confident	73.8	Confident	66 Å²	66	81.7 Å²	81.7	29%	0.289	41%	0.411	S	S	.	.	S	Bend	trans	-133.9	151.3	-178.2	53.6	-91	0	0	0	109.1	L16 L76 P78	L16-F18 HydrophobicContact CB-CE1 4.43Å; L16-F18 HydrophobicContact CB-CZ 4.42Å; L16-F18 WeakPolarHBondContact CB-O 3.46Å; L16-F18 HydrophobicContact CD1-CD2 4.39Å; L16-F18 HydrophobicContact CD1-CE2 3.78Å; L16-F18 HydrophobicContact CD1-CZ 3.97Å; L16-F18 HydrophobicContact CD2-CE1 4.27Å; L16-F18 HydrophobicContact CD2-CZ 3.99Å; L16-F18 HydrophobicContact CG-CZ 4.37Å; L16-F18 PolarHBondContact O-N 3.01Å; F18-L76 WeakPolarHBondContact CZ-O 3.33Å; F18-P78 HydrophobicContact CD1-CG 4.25Å; F18-P78 HydrophobicContact CD2-CB 4.35Å; F18-P78 HydrophobicContact CE1-CG 4.2Å; F18-P78 HydrophobicContact CE2-CG 4.48Å; F18-P78 HydrophobicContact CG-CB 4.4Å; F18-P78 HydrophobicContact CG-CG 4.44Å; F18-P78 HydrophobicContact CZ-CG 4.31Å
19	S	70.7	Confident	75.7	Confident	75 Å²	75	81 Å²	81	52%	0.524	40%	0.4	S	S	.	.			trans	-73.4	131	174.6	61.6	0	0	0	0	110.1
20	N	70.1	Confident	77.1	Confident	1 Å²	1	74 Å²	74	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	159.3	172.7	-149.3	-27.5	0	0	0	110.6	L16 V27 F30 R80	L16-N20 HydrophobicContact CD1-CB 4.04Å; N20-V27 PolarHBondContact O-N 3.3Å; N20-F30 HydrophobicContact CB-CZ 4.14Å; N20-R80 VanDerWaalsContact OD1-CA 3.27Å; N20-R80 WeakPolarHBondContact OD1-CA 3.41Å
21	Q	80.7	Confident	78	Confident	36 Å²	36	70 Å²	70	17%	0.168	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.2	172.6	-67.9	-176.8	-9.8	0	0	110.1	S25 Y26 R80	Q21-S25 CarbonylContact C-O 3.55Å; Q21-S25 VanDerWaalsContact CA-O 3.24Å; Q21-S25 WeakPolarHBondContact CA-O 3.48Å; Q21-Y26 HydrophobicContact CG-CD1 3.84Å; Q21-Y26 HydrophobicContact CG-CE1 3.99Å; Q21-Y26 HydrophobicContact CG-CG 4.38Å; Q21-Y26 VanDerWaalsContact NE2-CE1 3.32Å; Q21-Y26 VanDerWaalsContact NE2-CZ 3.26Å; Q21-Y26 PolarHBondContact NE2-OH 3.45Å; Q21-R80 VanDerWaalsContact CD-NH1 3.26Å
22	Y	78.5	Confident	78.3	Confident	12 Å²	12	66.9 Å²	66.9	5%	0.047	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.5	171.1	-174.3	-117.2	0	0	0	108.5	H24 S25 V27 M40 I49 I82 I102 D103 R104	Y22-H24 VanDerWaalsContact C-N 3.33Å; Y22-H24 PolarHBondContact O-N 2.91Å; Y22-S25 PolarHBondContact N-O 2.93Å; Y22-S25 WeakPolarHBondContact O-CB 3.28Å; Y22-S25 PolarHBondContact O-N 3.49Å; Y22-V27 VanDerWaalsContact CB-CG2 3.44Å; Y22-M40 HydrophobicContact CD1-CE 4.03Å; Y22-M40 HydrophobicContact CD1-SD 4.08Å; Y22-M40 HydrophobicContact CD2-CE 3.66Å; Y22-M40 HydrophobicContact CD2-SD 3.51Å; Y22-M40 VanDerWaalsContact CD2-SD 3.51Å; Y22-M40 HydrophobicContact CE1-CE 3.78Å; Y22-M40 HydrophobicContact CE1-SD 4.44Å; Y22-M40 HydrophobicContact CE2-CE 3.42Å; Y22-M40 VanDerWaalsContact CE2-CE 3.42Å; Y22-M40 HydrophobicContact CE2-SD 3.95Å; Y22-M40 HydrophobicContact CG-CE 3.96Å; Y22-M40 HydrophobicContact CG-SD 3.58Å; Y22-M40 VanDerWaalsContact CG-SD 3.58Å; Y22-M40 VanDerWaalsContact CZ-CE 3.46Å; Y22-I49 HydrophobicContact CE2-CD1 4.22Å; Y22-I49 HydrophobicContact CE2-CG1 4.4Å; Y22-I82 HydrophobicContact CD2-CD1 4.2Å; Y22-I102 HydrophobicContact CE2-CG2 4.29Å; Y22-I102 WeakPolarHBondContact OH-CG2 3.23Å; Y22-D103 VanDerWaalsContact CE1-O 3.3Å; Y22-D103 WeakPolarHBondContact CE1-O 3.16Å; Y22-D103 VanDerWaalsContact OH-C 3.3Å; Y22-D103 PolarHBondContact OH-O 3.32Å; Y22-R104 HydrophobicContact CE1-CB 4.11Å; Y22-R104 HydrophobicContact CE1-CG 4.27Å
23	Y	81.4	Confident	78.4	Confident	70 Å²	70	65.2 Å²	65.2	28%	0.275	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	53.4	-171.8	-70.5	-107.2	0	0	0	113.3	S25 I102 R104 I117	Y23-S25 PolarHBondContact O-N 2.87Å; Y23-S25 VanDerWaalsContact O-N 3.1Å; Y23-I102 HydrophobicContact CE2-CG2 4.16Å; Y23-R104 VanDerWaalsContact CB-CD 3.46Å; Y23-R104 HydrophobicContact CD2-CB 4.17Å; Y23-R104 HydrophobicContact CD2-CG 4.35Å; Y23-R104 HydrophobicContact CE2-CB 4.21Å; Y23-R104 HydrophobicContact CG-CB 4.47Å; Y23-R104 HydrophobicContact CG-CG 4.38Å; Y23-R104 VanDerWaalsContact O-CZ 3.25Å; Y23-R104 PolarHBondContact O-NH1 3.06Å; Y23-R104 PolarHBondContact O-NH2 3.5Å; Y23-I117 WeakPolarHBondContact OH-CD1 3.38Å
24	H	81.3	Confident	77.8	Confident	167 Å²	167	59.1 Å²	59.1	77%	0.773	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	7.4	-178.3	-46.4	95.5	0	0	0	115.3	Y22	Y22-H24 VanDerWaalsContact C-N 3.33Å; Y22-H24 PolarHBondContact O-N 2.91Å
25	S	83.7	Confident	77.4	Confident	31 Å²	31	63.7 Å²	63.7	22%	0.217	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	130	174.6	-52.9	0	0	0	0	109.6	Q21 Y22 Y23 V27 R104	Q21-S25 CarbonylContact C-O 3.55Å; Q21-S25 VanDerWaalsContact CA-O 3.24Å; Q21-S25 WeakPolarHBondContact CA-O 3.48Å; Y22-S25 PolarHBondContact N-O 2.93Å; Y22-S25 WeakPolarHBondContact O-CB 3.28Å; Y22-S25 PolarHBondContact O-N 3.49Å; Y23-S25 PolarHBondContact O-N 2.87Å; Y23-S25 VanDerWaalsContact O-N 3.1Å; S25-V27 PolarHBondContact O-N 3.1Å; S25-R104 PolarHBondContact OG-NH2 2.91Å
26	Y	85.7	Confident	77.3	Confident	123 Å²	123	59.7 Å²	59.7	48%	0.482	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	135	177.4	-70.6	-78.3	0	0	0	111.5	Q21	Q21-Y26 HydrophobicContact CG-CD1 3.84Å; Q21-Y26 HydrophobicContact CG-CE1 3.99Å; Q21-Y26 HydrophobicContact CG-CG 4.38Å; Q21-Y26 VanDerWaalsContact NE2-CE1 3.32Å; Q21-Y26 VanDerWaalsContact NE2-CZ 3.26Å; Q21-Y26 PolarHBondContact NE2-OH 3.45Å
27	V	82.4	Confident	77.6	Confident	6 Å²	6	59.9 Å²	59.9	4%	0.036	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.1	175.7	-169.6	0	0	0	0	108.4	N20 Y22 S25 F30 M40 S41 L46	N20-V27 PolarHBondContact O-N 3.3Å; Y22-V27 VanDerWaalsContact CB-CG2 3.44Å; S25-V27 PolarHBondContact O-N 3.1Å; V27-F30 HydrophobicContact CB-CE2 4.08Å; V27-F30 HydrophobicContact CB-CZ 3.88Å; V27-F30 HydrophobicContact CG1-CD2 4.13Å; V27-F30 HydrophobicContact CG1-CE1 4.05Å; V27-F30 HydrophobicContact CG1-CE2 3.56Å; V27-F30 HydrophobicContact CG1-CZ 3.52Å; V27-M40 HydrophobicContact CG1-CB 3.89Å; V27-M40 HydrophobicContact CG1-CG 4.16Å; V27-M40 HydrophobicContact CG2-CB 4.38Å; V27-S41 WeakPolarHBondContact CG1-O 3.42Å; V27-L46 HydrophobicContact CG2-CD1 3.82Å
28	N	84.1	Confident	78	Confident	82 Å²	82	51.9 Å²	51.9	44%	0.439	26%	0.257	S	S	.	.			trans	-125.7	-17	173.6	62.3	-10.1	0	0	0	112.8	S41 R42	N28-S41 PolarHBondContact N-O 2.88Å; N28-S41 PolarHBondContact OD1-O 3.42Å; N28-R42 WeakPolarHBondContact OD1-CA 3.41Å
29	N	84.4	Confident	78.6	Confident	71 Å²	71	49.2 Å²	49.2	38%	0.38	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.7	-179.8	-64.9	-35.7	0	0	0	109.7	S41 R42	N29-S41 VanDerWaalsContact CB-OG 3.3Å; N29-S41 WeakPolarHBondContact CB-OG 3.41Å; N29-S41 PolarHBondContact N-O 3.35Å; N29-S41 VanDerWaalsContact N-O 3.13Å; N29-S41 PolarHBondContact O-N 2.81Å; N29-R42 PolarHBondContact ND2-O 2.89Å
30	F	83.3	Confident	79.4	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.013	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.5	170.8	-65.7	-99.8	0	0	0	107.8	Y13 V14 L16 N20 V27 I38 S39 M40 L76	Y13-F30 CarbonylContact C-O 3.55Å; Y13-F30 WeakPolarHBondContact CA-O 3.22Å; V14-F30 HydrophobicContact CB-CB 4.05Å; V14-F30 PolarHBondContact N-O 2.91Å; V14-F30 PolarHBondContact O-N 2.92Å; L16-F30 HydrophobicContact CD1-CD2 3.83Å; L16-F30 HydrophobicContact CD1-CE2 3.24Å; L16-F30 HydrophobicContact CD1-CZ 3.66Å; L16-F30 HydrophobicContact CG-CD2 3.91Å; L16-F30 HydrophobicContact CG-CE2 3.81Å; N20-F30 HydrophobicContact CB-CZ 4.14Å; V27-F30 HydrophobicContact CB-CE2 4.08Å; V27-F30 HydrophobicContact CB-CZ 3.88Å; V27-F30 HydrophobicContact CG1-CD2 4.13Å; V27-F30 HydrophobicContact CG1-CE1 4.05Å; V27-F30 HydrophobicContact CG1-CE2 3.56Å; V27-F30 HydrophobicContact CG1-CZ 3.52Å; F30-I38 HydrophobicContact CD1-CG2 4.1Å; F30-S39 WeakPolarHBondContact CA-O 3.47Å; F30-M40 HydrophobicContact CD1-CG 3.67Å; F30-M40 HydrophobicContact CD1-SD 4.47Å; F30-M40 HydrophobicContact CE1-CG 3.57Å; F30-M40 HydrophobicContact CE1-SD 3.89Å; F30-M40 HydrophobicContact CZ-CG 4.48Å; F30-L76 HydrophobicContact CD1-CD1 4.05Å; F30-L76 HydrophobicContact CE1-CD1 4.17Å; F30-L76 HydrophobicContact CE1-CD2 4.2Å; F30-L76 HydrophobicContact CG-CD1 4.42Å
31	M	82.8	Confident	80.2	Confident	40 Å²	40	47.1 Å²	47.1	20%	0.197	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.7	174.3	-176	-177.6	74.1	0	0	107.8	H11 Q12 Y13 E37 I38 S39	H11-M31 HydrophobicContact CB-CG 4.11Å; H11-M31 HydrophobicContact CB-SD 3.99Å; H11-M31 VanDerWaalsContact CD2-SD 3.58Å; Q12-M31 CarbonylContact O-C 3.5Å; Q12-M31 WeakPolarHBondContact O-CA 3.38Å; Y13-M31 HydrophobicContact CD1-CB 4.26Å; Y13-M31 HydrophobicContact CD1-CG 4.37Å; Y13-M31 HydrophobicContact CE1-CB 4.23Å; Y13-M31 HydrophobicContact CE1-CG 4.12Å; Y13-M31 HydrophobicContact CE1-SD 4.05Å; M31-E37 VanDerWaalsContact O-O 3.12Å; M31-I38 CarbonylContact O-C 3.53Å; M31-I38 WeakPolarHBondContact O-CA 3.5Å; M31-S39 PolarHBondContact N-O 2.78Å; M31-S39 PolarHBondContact O-N 3.44Å
32	I	77.8	Confident	80.3	Confident	36 Å²	36	51.6 Å²	51.6	19%	0.185	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.9	172.6	-52.1	178.8	0	0	0	106.4	Q12 V14 E37 I38	Q12-I32 PolarHBondContact N-O 2.8Å; Q12-I32 PolarHBondContact O-N 2.82Å; V14-I32 HydrophobicContact CG2-CD1 3.96Å; V14-I32 HydrophobicContact CG2-CG1 4.31Å; I32-E37 WeakPolarHBondContact CA-O 3.18Å; I32-I38 HydrophobicContact CG1-CG1 4.32Å
33	D	73.6	Confident	80.5	Confident	19 Å²	19	59.4 Å²	59.4	10%	0.102	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	178.4	177.5	78.6	-3.5	0	0	0	112.1	K7 K35 D36 E37	K7-D33 PolarHBondContact NZ-O 2.94Å; D33-K35 PolarHBondContact O-N 2.89Å; D33-K35 VanDerWaalsContact OD1-C 3.25Å; D33-K35 VanDerWaalsContact OD1-CA 3.26Å; D33-K35 WeakPolarHBondContact OD1-CA 2.95Å; D33-K35 WeakPolarHBondContact OD1-CB 3.49Å; D33-K35 PolarHBondContact OD1-N 3.13Å; D33-D36 PolarHBondContact O-N 3.28Å; D33-D36 PolarHBondContact OD1-N 2.85Å; D33-E37 PolarHBondContact N-O 2.96Å; D33-E37 WeakPolarHBondContact OD1-CB 3.33Å; D33-E37 PolarHBondContact OD1-N 3.1Å
34	S	66	Low	80.6	Confident	48 Å²	48	63.7 Å²	63.7	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.1	175.2	50	0	0	0	0	114.1	L9 S57	L9-S34 VanDerWaalsContact O-CB 3.31Å; L9-S34 WeakPolarHBondContact O-CB 3.29Å; L9-S34 PolarHBondContact O-OG 2.84Å; S34-S57 VanDerWaalsContact O-CB 3.25Å; S34-S57 WeakPolarHBondContact O-CB 3.41Å
35	K	68.2	Low	80.9	Confident	126 Å²	126	60.6 Å²	60.6	55%	0.548	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	8.6	179.5	-59.5	177.2	-178.2	168.3	0	113.8	D33 E37	D33-K35 PolarHBondContact O-N 2.89Å; D33-K35 VanDerWaalsContact OD1-C 3.25Å; D33-K35 VanDerWaalsContact OD1-CA 3.26Å; D33-K35 WeakPolarHBondContact OD1-CA 2.95Å; D33-K35 WeakPolarHBondContact OD1-CB 3.49Å; D33-K35 PolarHBondContact OD1-N 3.13Å; K35-E37 PolarHBondContact O-N 3.47Å
36	D	70.1	Confident	81	Confident	23 Å²	23	59.8 Å²	59.8	12%	0.123	28%	0.276	C	S	.	.			trans	66.1	23.7	-178.6	-62.7	-79.1	0	0	0	114.3	K7 D33 I38 C58	K7-D36 WeakPolarHBondContact CE-OD1 3.41Å; K7-D36 IonicContact NZ-OD1 2.63Å; K7-D36 PolarHBondContact NZ-OD1 3.38Å; K7-D36 IonicContact NZ-OD2 2.85Å; K7-D36 PolarHBondContact NZ-OD2 2.94Å; D33-D36 PolarHBondContact O-N 3.28Å; D33-D36 PolarHBondContact OD1-N 2.85Å; D36-I38 PolarHBondContact O-N 2.8Å; D36-C58 HydrophobicContact CB-CB 4.26Å; D36-C58 VanDerWaalsContact OD1-CB 3.24Å; D36-C58 WeakPolarHBondContact OD1-CB 3.4Å; D36-C58 WeakPolarHBondContact OD2-CA 3.34Å; D36-C58 WeakPolarHBondContact OD2-CB 3.44Å; D36-C58 PolarHBondContact OD2-N 2.79Å; D36-C58 VanDerWaalsContact OD2-O 3.07Å; D36-C58 PolarHBondContact OD2-SG 2.84Å
37	E	78.8	Confident	81.1	Confident	41 Å²	41	54 Å²	54	19%	0.192	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	114.3	167.3	-167.4	177.7	117.7	0	0	108.9	M31 I32 D33 K35 S39 F48 I50	M31-E37 VanDerWaalsContact O-O 3.12Å; I32-E37 WeakPolarHBondContact CA-O 3.18Å; D33-E37 PolarHBondContact N-O 2.96Å; D33-E37 WeakPolarHBondContact OD1-CB 3.33Å; D33-E37 PolarHBondContact OD1-N 3.1Å; K35-E37 PolarHBondContact O-N 3.47Å; E37-S39 PolarHBondContact O-N 2.57Å; E37-S39 PolarHBondContact OE1-OG 2.89Å; E37-F48 HydrophobicContact CG-CB 3.49Å; E37-F48 VanDerWaalsContact CG-CB 3.49Å; E37-F48 HydrophobicContact CG-CD2 3.57Å; E37-F48 HydrophobicContact CG-CG 3.78Å; E37-I50 HydrophobicContact CB-CD1 4.38Å
38	I	81.7	Confident	81.3	Confident	13 Å²	13	55.7 Å²	55.7	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	91.8	165.4	-52.8	179.9	0	0	0	107.2	F30 M31 I32 D36 F48 I49 C74	F30-I38 HydrophobicContact CD1-CG2 4.1Å; M31-I38 CarbonylContact O-C 3.53Å; M31-I38 WeakPolarHBondContact O-CA 3.5Å; I32-I38 HydrophobicContact CG1-CG1 4.32Å; D36-I38 PolarHBondContact O-N 2.8Å; I38-F48 CarbonylContact O-C 3.59Å; I38-F48 WeakPolarHBondContact O-CA 3.43Å; I38-I49 HydrophobicContact CB-CB 4.48Å; I38-I49 PolarHBondContact N-O 3.25Å; I38-I49 PolarHBondContact O-N 2.79Å; I38-C74 HydrophobicContact CD1-CB 3.73Å
39	S	86	Confident	81.1	Confident	10 Å²	10	52.3 Å²	52.3	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	131.7	175.6	-107	0	0	0	0	110.6	F30 M31 E37 Y45	F30-S39 WeakPolarHBondContact CA-O 3.47Å; M31-S39 PolarHBondContact N-O 2.78Å; M31-S39 PolarHBondContact O-N 3.44Å; E37-S39 PolarHBondContact O-N 2.57Å; E37-S39 PolarHBondContact OE1-OG 2.89Å; S39-Y45 WeakPolarHBondContact OG-CE2 3.41Å
40	M	86.2	Confident	80.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.2	-177	-72.9	171	-82.4	0	0	110.8	Y22 V27 F30 L46 G47 I49 I82	Y22-M40 HydrophobicContact CD1-CE 4.03Å; Y22-M40 HydrophobicContact CD1-SD 4.08Å; Y22-M40 HydrophobicContact CD2-CE 3.66Å; Y22-M40 HydrophobicContact CD2-SD 3.51Å; Y22-M40 VanDerWaalsContact CD2-SD 3.51Å; Y22-M40 HydrophobicContact CE1-CE 3.78Å; Y22-M40 HydrophobicContact CE1-SD 4.44Å; Y22-M40 HydrophobicContact CE2-CE 3.42Å; Y22-M40 VanDerWaalsContact CE2-CE 3.42Å; Y22-M40 HydrophobicContact CE2-SD 3.95Å; Y22-M40 HydrophobicContact CG-CE 3.96Å; Y22-M40 HydrophobicContact CG-SD 3.58Å; Y22-M40 VanDerWaalsContact CG-SD 3.58Å; Y22-M40 VanDerWaalsContact CZ-CE 3.46Å; V27-M40 HydrophobicContact CG1-CB 3.89Å; V27-M40 HydrophobicContact CG1-CG 4.16Å; V27-M40 HydrophobicContact CG2-CB 4.38Å; F30-M40 HydrophobicContact CD1-CG 3.67Å; F30-M40 HydrophobicContact CD1-SD 4.47Å; F30-M40 HydrophobicContact CE1-CG 3.57Å; F30-M40 HydrophobicContact CE1-SD 3.89Å; F30-M40 HydrophobicContact CZ-CG 4.48Å; M40-L46 WeakPolarHBondContact O-CB 3.3Å; M40-L46 PolarHBondContact O-N 3.21Å; M40-G47 PolarHBondContact N-O 2.85Å; M40-I49 HydrophobicContact CE-CB 4.46Å; M40-I49 HydrophobicContact CE-CD1 3.68Å; M40-I49 HydrophobicContact CE-CG1 3.66Å; M40-I82 HydrophobicContact SD-CD1 3.92Å
41	S	86.6	Confident	80.1	Confident	33 Å²	33	49.7 Å²	49.7	23%	0.231	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	162.5	-180	61	0	0	0	0	113.3	V27 N28 N29 R44	V27-S41 WeakPolarHBondContact CG1-O 3.42Å; N28-S41 PolarHBondContact N-O 2.88Å; N28-S41 PolarHBondContact OD1-O 3.42Å; N29-S41 VanDerWaalsContact CB-OG 3.3Å; N29-S41 WeakPolarHBondContact CB-OG 3.41Å; N29-S41 PolarHBondContact N-O 3.35Å; N29-S41 VanDerWaalsContact N-O 3.13Å; N29-S41 PolarHBondContact O-N 2.81Å; S41-R44 WeakPolarHBondContact CA-O 3.21Å; S41-R44 WeakPolarHBondContact CB-O 3.24Å
42	R	84.1	Confident	79.3	Confident	130 Å²	130	51.9 Å²	51.9	49%	0.491	23%	0.234	S	C	.	.	S	Bend	trans	-119.5	-106.5	165.5	-168.3	-171	-178.4	-161.5	-0.5	109	N28 N29 R44 L46	N28-R42 WeakPolarHBondContact OD1-CA 3.41Å; N29-R42 PolarHBondContact ND2-O 2.89Å; R42-R44 PolarHBondContact N-O 2.8Å; R42-L46 HydrophobicContact CB-CD1 4.36Å
43	E	82.9	Confident	78.2	Confident	176 Å²	176	50.5 Å²	50.5	82%	0.822	23%	0.227	S	C	*	.	S	Bend	trans	-83.4	-21.5	166.3	-67.4	166.5	-160.4	0	0	111.6
44	R	83.9	Confident	77.1	Confident	159 Å²	159	53 Å²	53	60%	0.6	25%	0.246	S	C	*	.	S	Bend	trans	-132.8	161.7	176.1	64.9	-177.9	-178.6	-170.8	-0.2	110	S41 R42 L46	S41-R44 WeakPolarHBondContact CA-O 3.21Å; S41-R44 WeakPolarHBondContact CB-O 3.24Å; R42-R44 PolarHBondContact N-O 2.8Å; R44-L46 HydrophobicContact CG-CD2 4.49Å
45	Y	86.2	Confident	75.9	Confident	103 Å²	103	54.2 Å²	54.2	40%	0.404	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	135.9	169.8	-175.6	-107.4	0	0	0	111.2	S39 F48 A105	S39-Y45 WeakPolarHBondContact OG-CE2 3.41Å; Y45-F48 WeakPolarHBondContact OH-CD1 3.3Å; Y45-A105 HydrophobicContact CD1-CB 3.78Å; Y45-A105 HydrophobicContact CE1-CB 3.93Å
46	L	86.9	Confident	74.4	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.073	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-21	179.7	-63.1	173.7	0	0	0	112.9	V27 M40 R42 R44 A105	V27-L46 HydrophobicContact CG2-CD1 3.82Å; M40-L46 WeakPolarHBondContact O-CB 3.3Å; M40-L46 PolarHBondContact O-N 3.21Å; R42-L46 HydrophobicContact CB-CD1 4.36Å; R44-L46 HydrophobicContact CG-CD2 4.49Å; L46-A105 PolarHBondContact O-N 2.79Å
47	G	86.7	Confident	72.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.5	-168.4	-177.6	0	0	0	0	0	111.3	M40 D103	M40-G47 PolarHBondContact N-O 2.85Å; G47-D103 WeakPolarHBondContact CA-O 3.19Å
48	F	86.1	Confident	71.1	Confident	42 Å²	42	52.1 Å²	52.1	18%	0.184	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	159.3	-174.9	65.9	-79.5	0	0	0	112.4	E37 I38 Y45 I50 D103	E37-F48 HydrophobicContact CG-CB 3.49Å; E37-F48 VanDerWaalsContact CG-CB 3.49Å; E37-F48 HydrophobicContact CG-CD2 3.57Å; E37-F48 HydrophobicContact CG-CG 3.78Å; I38-F48 CarbonylContact O-C 3.59Å; I38-F48 WeakPolarHBondContact O-CA 3.43Å; Y45-F48 WeakPolarHBondContact OH-CD1 3.3Å; F48-I50 HydrophobicContact CD2-CB 4.04Å; F48-I50 HydrophobicContact CD2-CG2 4.19Å; F48-I50 HydrophobicContact CE2-CB 4.12Å; F48-I50 HydrophobicContact CE2-CG2 3.8Å; F48-D103 HydrophobicContact CD1-CB 3.57Å; F48-D103 HydrophobicContact CE1-CB 3.38Å; F48-D103 HydrophobicContact CE2-CB 4.39Å; F48-D103 HydrophobicContact CG-CB 4.24Å; F48-D103 HydrophobicContact CZ-CB 3.84Å; F48-D103 PolarHBondContact N-O 3.01Å; F48-D103 VanDerWaalsContact N-O 3.1Å; F48-D103 PolarHBondContact O-N 3.3Å
49	I	81.5	Confident	69.2	Low	12 Å²	12	53.3 Å²	53.3	6%	0.062	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.5	164.4	-65.9	161.9	0	0	0	106.5	Y22 I38 M40 I82 I102	Y22-I49 HydrophobicContact CE2-CD1 4.22Å; Y22-I49 HydrophobicContact CE2-CG1 4.4Å; I38-I49 HydrophobicContact CB-CB 4.48Å; I38-I49 PolarHBondContact N-O 3.25Å; I38-I49 PolarHBondContact O-N 2.79Å; M40-I49 HydrophobicContact CE-CB 4.46Å; M40-I49 HydrophobicContact CE-CD1 3.68Å; M40-I49 HydrophobicContact CE-CG1 3.66Å; I49-I82 HydrophobicContact CD1-CB 4.27Å; I49-I82 HydrophobicContact CD1-CD1 3.7Å; I49-I82 HydrophobicContact CD1-CG2 3.7Å; I49-I102 HydrophobicContact CG1-CG1 4.36Å; I49-I102 HydrophobicContact CG1-CG2 4.16Å; I49-I102 HydrophobicContact CG2-CG1 4.49Å
50	I	78.4	Confident	66.8	Low	11 Å²	11	59 Å²	59	6%	0.056	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.3	172.5	-162.6	167.9	0	0	0	109.2	E37 F48 R52 S100 K101	E37-I50 HydrophobicContact CB-CD1 4.38Å; F48-I50 HydrophobicContact CD2-CB 4.04Å; F48-I50 HydrophobicContact CD2-CG2 4.19Å; F48-I50 HydrophobicContact CE2-CB 4.12Å; F48-I50 HydrophobicContact CE2-CG2 3.8Å; I50-R52 VanDerWaalsContact CD1-CD 3.48Å; I50-R52 HydrophobicContact CD1-CG 3.89Å; I50-R52 HydrophobicContact CG1-CB 4.15Å; I50-R52 HydrophobicContact CG1-CG 3.86Å; I50-S100 CarbonylContact O-C 3.57Å; I50-S100 WeakPolarHBondContact O-CA 3.04Å; I50-K101 HydrophobicContact CG2-CB 3.87Å; I50-K101 HydrophobicContact CG2-CG 4.26Å; I50-K101 PolarHBondContact N-O 3.4Å; I50-K101 PolarHBondContact O-N 2.99Å
51	T	67.4	Low	64.1	Low	8 Å²	8	64.6 Å²	64.6	5%	0.049	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	82.9	177.4	-0.2	0	0	0	0	106.1	C58 T72 Y86 S100	T51-C58 PolarHBondContact O-SG 3.36Å; T51-T72 HydrophobicContact CG2-CG2 4.4Å; T51-Y86 HydrophobicContact CG2-CE1 3.74Å; T51-Y86 WeakPolarHBondContact CG2-OH 3.17Å; T51-S100 WeakPolarHBondContact CG2-OG 3.11Å
52	R	66.6	Low	61.3	Low	85 Å²	85	71.8 Å²	71.8	32%	0.321	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	161.6	-176.9	73.5	170.3	172.8	149.2	1.6	112.7	I50 Q99	I50-R52 VanDerWaalsContact CD1-CD 3.48Å; I50-R52 HydrophobicContact CD1-CG 3.89Å; I50-R52 HydrophobicContact CG1-CB 4.15Å; I50-R52 HydrophobicContact CG1-CG 3.86Å; R52-Q99 CarbonylContact O-C 3.35Å; R52-Q99 PolarHBondContact O-N 3.05Å
53	L	54.6	Low	58.8	Low	7 Å²	7	72.1 Å²	72.1	4%	0.037	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	147.2	159.5	-79.1	147.5	0	0	0	110.9	G55 T56 A70 I93 S96 W98	L53-G55 PolarHBondContact O-N 3.48Å; L53-T56 VanDerWaalsContact CB-OG1 3.32Å; L53-T56 WeakPolarHBondContact CB-OG1 3.35Å; L53-T56 PolarHBondContact O-N 2.91Å; L53-A70 HydrophobicContact CD1-CB 3.82Å; L53-I93 HydrophobicContact CD1-CB 4.49Å; L53-I93 HydrophobicContact CD1-CD1 3.91Å; L53-I93 HydrophobicContact CD1-CG1 4.36Å; L53-I93 HydrophobicContact CD1-CG2 3.27Å; L53-I93 HydrophobicContact CD2-CB 4.45Å; L53-I93 HydrophobicContact CD2-CG2 3.08Å; L53-I93 HydrophobicContact CG-CG2 3.62Å; L53-S96 WeakPolarHBondContact CD2-OG 3.46Å; L53-W98 HydrophobicContact CD1-CH2 4.12Å; L53-W98 HydrophobicContact CD1-CZ2 3.68Å; L53-W98 HydrophobicContact CD2-CB 4.47Å; L53-W98 HydrophobicContact CD2-CD2 3.71Å; L53-W98 HydrophobicContact CD2-CE3 4.47Å; L53-W98 HydrophobicContact CD2-CG 3.66Å; L53-W98 HydrophobicContact CD2-CZ2 4.34Å; L53-W98 HydrophobicContact CG-CD2 3.73Å; L53-W98 HydrophobicContact CG-CE3 4.08Å; L53-W98 HydrophobicContact CG-CG 4.24Å; L53-W98 HydrophobicContact CG-CH2 4.14Å; L53-W98 HydrophobicContact CG-CZ2 3.8Å; L53-W98 HydrophobicContact CG-CZ3 4.28Å
54	S	50.1	Low	56.5	Low	72 Å²	72	70.6 Å²	70.6	50%	0.503	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	98.8	168.7	-175.3	0	0	0	0	109.1	G97	S54-G97 WeakPolarHBondContact CB-O 3.45Å
55	G	40.2	Very low	54.3	Low	73 Å²	73	69.8 Å²	69.8	75%	0.753	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.9	-3.6	174.5	0	0	0	0	0	116	L53	L53-G55 PolarHBondContact O-N 3.48Å
56	T	37.6	Very low	52.3	Low	63 Å²	63	72.1 Å²	72.1	39%	0.387	41%	0.405	S	S	.	.			trans	-123.8	149.7	173.6	73.8	0	0	0	0	112	L53	L53-T56 VanDerWaalsContact CB-OG1 3.32Å; L53-T56 WeakPolarHBondContact CB-OG1 3.35Å; L53-T56 PolarHBondContact O-N 2.91Å
57	S	39.3	Very low	50.4	Low	68 Å²	68	77.4 Å²	77.4	48%	0.476	43%	0.433	S	S	.	.			trans	-96.4	129.2	167.1	46.8	0	0	0	0	107.9	S34 S59	S34-S57 VanDerWaalsContact O-CB 3.25Å; S34-S57 WeakPolarHBondContact O-CB 3.41Å; S57-S59 PolarHBondContact O-N 2.91Å
58	C	39.6	Very low	48.7	Very low	16 Å²	16	79.8 Å²	79.8	11%	0.108	45%	0.448	C	S	.	.			trans	-67.2	125.9	170.5	-39.2	0	0	0	0	109.2	K7 D36 T51	K7-C58 PolarHBondContact NZ-O 2.85Å; D36-C58 HydrophobicContact CB-CB 4.26Å; D36-C58 VanDerWaalsContact OD1-CB 3.24Å; D36-C58 WeakPolarHBondContact OD1-CB 3.4Å; D36-C58 WeakPolarHBondContact OD2-CA 3.34Å; D36-C58 WeakPolarHBondContact OD2-CB 3.44Å; D36-C58 PolarHBondContact OD2-N 2.79Å; D36-C58 VanDerWaalsContact OD2-O 3.07Å; D36-C58 PolarHBondContact OD2-SG 2.84Å; T51-C58 PolarHBondContact O-SG 3.36Å
59	S	42.2	Very low	47.2	Very low	37 Å²	37	82 Å²	82	26%	0.259	46%	0.46	S	S	.	.			trans	-147.1	134.7	172.7	44	0	0	0	0	106.5	S57 L61	S57-S59 PolarHBondContact O-N 2.91Å; S59-L61 PolarHBondContact O-N 2.89Å; S59-L61 WeakPolarHBondContact OG-CD1 3.41Å
60	E	35.5	Very low	46.2	Very low	131 Å²	131	82 Å²	82	61%	0.612	46%	0.461	S	S	*	.			trans	-62.2	98.6	151	-71.6	-170.3	150.8	0	0	106.2	K71	E60-K71 WeakPolarHBondContact OE1-CE 3.42Å; E60-K71 IonicContact OE1-NZ 2.69Å; E60-K71 PolarHBondContact OE1-NZ 3.07Å
61	L	29.6	Very low	45.6	Very low	117 Å²	117	85.8 Å²	85.8	61%	0.613	48%	0.478	S	S	*	.			trans	-132.5	107.1	169.3	-84.9	172.6	0	0	0	108.5	S59 M69	S59-L61 PolarHBondContact O-N 2.89Å; S59-L61 WeakPolarHBondContact OG-CD1 3.41Å; L61-M69 WeakPolarHBondContact O-CE 3.4Å
62	E	27.9	Very low	45.4	Very low	184 Å²	184	86.8 Å²	86.8	86%	0.86	48%	0.484	S	S	*	.			trans	-48.2	135.4	174.6	-67.8	173.2	134.3	0	0	112.5
63	V	32.5	Very low	45.5	Very low	136 Å²	136	85.7 Å²	85.7	82%	0.824	49%	0.487	S	S	*	.			trans	30.7	99	152.7	-166.8	0	0	0	0	116.8
64	L	32.7	Very low	46	Very low	144 Å²	144	87.7 Å²	87.7	75%	0.754	50%	0.501	S	S	*	.			trans	-140.1	117.3	152.1	-117.3	104.3	0	0	0	110.3	D66 N67	L64-D66 PolarHBondContact O-N 3.4Å; L64-N67 PolarHBondContact O-N 3.4Å
65	D	38.1	Very low	46.9	Very low	143 Å²	143	88.8 Å²	88.8	77%	0.765	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	3.7	108.6	159.7	-128.8	11.4	0	0	0	114.9	N67	D65-N67 VanDerWaalsContact C-N 3.26Å; D65-N67 PolarHBondContact O-N 2.93Å
66	D	45.7	Very low	48.4	Very low	151 Å²	151	87.1 Å²	87.1	81%	0.807	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	6.8	171.4	-65.1	-17	0	0	0	119.5	L64 V68	L64-D66 PolarHBondContact O-N 3.4Å; D66-V68 PolarHBondContact O-N 3.16Å
67	N	46.3	Very low	50	Low	125 Å²	125	86.4 Å²	86.4	67%	0.668	47%	0.467	S	S	*	.			trans	-92	94.8	173.4	-75.9	-53.9	0	0	0	112.6	L64 D65 M69	L64-N67 PolarHBondContact O-N 3.4Å; D65-N67 VanDerWaalsContact C-N 3.26Å; D65-N67 PolarHBondContact O-N 2.93Å; N67-M69 VanDerWaalsContact O-CG 3.27Å; N67-M69 WeakPolarHBondContact O-CG 3.26Å; N67-M69 PolarHBondContact O-N 3.47Å
68	V	50.3	Low	51.5	Low	51 Å²	51	86.9 Å²	86.9	31%	0.309	47%	0.469	S	S	.	.			trans	-17.8	113.7	153.7	-178.1	0	0	0	0	114.4	D66 S90 E92 I93	D66-V68 PolarHBondContact O-N 3.16Å; V68-S90 WeakPolarHBondContact CG1-OG 3.4Å; V68-E92 HydrophobicContact CG1-CB 4.3Å; V68-E92 HydrophobicContact CG2-CB 3.81Å; V68-E92 HydrophobicContact CG2-CG 4.41Å; V68-E92 WeakPolarHBondContact CG2-OE2 3.39Å; V68-I93 HydrophobicContact CB-CG1 4.42Å; V68-I93 HydrophobicContact CG1-CB 4.25Å; V68-I93 HydrophobicContact CG1-CD1 3.58Å; V68-I93 HydrophobicContact CG1-CG1 2.96Å
69	M	55.7	Low	53.2	Low	89 Å²	89	92.1 Å²	92.1	44%	0.438	50%	0.496	S	S	.	.			trans	-130.4	144.7	-177.9	-74.3	-119.7	-59.4	0	0	112.4	L61 N67 S90 I93	L61-M69 WeakPolarHBondContact O-CE 3.4Å; N67-M69 VanDerWaalsContact O-CG 3.27Å; N67-M69 WeakPolarHBondContact O-CG 3.26Å; N67-M69 PolarHBondContact O-N 3.47Å; M69-S90 PolarHBondContact N-OG 2.93Å; M69-I93 VanDerWaalsContact C-CD1 3.47Å; M69-I93 WeakPolarHBondContact O-CD1 3.45Å
70	A	59.1	Low	54.5	Low	11 Å²	11	96.2 Å²	96.2	9%	0.091	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.5	170.7	0	0	0	0	0	110.7	L53 D88 I89 I93 W98	L53-A70 HydrophobicContact CD1-CB 3.82Å; A70-D88 CarbonylContact C-O 3.53Å; A70-D88 VanDerWaalsContact CA-O 3.26Å; A70-D88 WeakPolarHBondContact CA-O 3.44Å; A70-I89 HydrophobicContact CB-CG1 4.49Å; A70-I93 HydrophobicContact CB-CD1 3.81Å; A70-W98 HydrophobicContact CB-CH2 3.84Å; A70-W98 HydrophobicContact CB-CZ2 3.63Å
71	K	66.3	Low	56.4	Low	91 Å²	91	96.7 Å²	96.7	40%	0.396	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.1	173.9	-175.6	172.4	-173.9	163.2	0	109.7	E60 V87 D88	E60-K71 WeakPolarHBondContact OE1-CE 3.42Å; E60-K71 IonicContact OE1-NZ 2.69Å; E60-K71 PolarHBondContact OE1-NZ 3.07Å; K71-V87 HydrophobicContact CB-CB 4.11Å; K71-V87 HydrophobicContact CD-CB 4.24Å; K71-V87 HydrophobicContact CD-CG1 4.18Å; K71-V87 HydrophobicContact CG-CB 4.01Å; K71-V87 HydrophobicContact CG-CG1 4.49Å; K71-V87 HydrophobicContact CG-CG2 4.23Å; K71-V87 WeakPolarHBondContact O-CB 3.5Å; K71-V87 PolarHBondContact O-N 3.19Å; K71-D88 PolarHBondContact N-O 2.9Å; K71-D88 PolarHBondContact O-N 3.12Å
72	T	63.4	Low	58.5	Low	29 Å²	29	93 Å²	93	18%	0.178	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141.3	176.6	-53.7	0	0	0	0	110.2	T51 Y85 Y86	T51-T72 HydrophobicContact CG2-CG2 4.4Å; T72-Y85 CarbonylContact C-O 3.55Å; T72-Y85 WeakPolarHBondContact CA-O 3.15Å; T72-Y85 WeakPolarHBondContact CG2-O 3.24Å; T72-Y86 HydrophobicContact CG2-CD1 3.97Å; T72-Y86 HydrophobicContact CG2-CE1 4.07Å; T72-Y86 WeakPolarHBondContact OG1-CD1 3.35Å
73	T	68.1	Low	60.6	Low	62 Å²	62	85.3 Å²	85.3	38%	0.38	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.5	172.8	-59.6	0	0	0	0	109.2	S84 Y85	T73-S84 WeakPolarHBondContact O-CA 3.06Å; T73-Y85 PolarHBondContact N-O 2.86Å; T73-Y85 PolarHBondContact O-N 2.79Å
74	C	65.7	Low	62.4	Low	49 Å²	49	79.4 Å²	79.4	33%	0.331	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.7	173.3	-65.9	0	0	0	0	110.2	I38 S83 S84	I38-C74 HydrophobicContact CD1-CB 3.73Å; C74-S83 CarbonylContact C-O 3.54Å; C74-S83 WeakPolarHBondContact CA-O 3.38Å; C74-S84 PolarHBondContact SG-OG 3.49Å; C74-S84 VanDerWaalsContact SG-OG 3.4Å
75	L	68.5	Low	64.1	Low	95 Å²	95	76.6 Å²	76.6	50%	0.497	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.5	178.1	-172.9	72.4	0	0	0	109.8	I82 S83	L75-I82 WeakPolarHBondContact O-CA 3.25Å; L75-S83 PolarHBondContact N-O 3.31Å; L75-S83 PolarHBondContact O-N 2.8Å
76	L	72.2	Confident	65.7	Low	38 Å²	38	69.8 Å²	69.8	20%	0.199	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	107.9	172.8	-61.1	171.9	0	0	0	108.3	L16 F18 F30 I82	L16-L76 HydrophobicContact CD1-CB 4.5Å; L16-L76 HydrophobicContact CD1-CD1 4.24Å; L16-L76 HydrophobicContact CD2-CB 4.45Å; L16-L76 HydrophobicContact CD2-CD1 3.99Å; F18-L76 WeakPolarHBondContact CZ-O 3.33Å; F30-L76 HydrophobicContact CD1-CD1 4.05Å; F30-L76 HydrophobicContact CE1-CD1 4.17Å; F30-L76 HydrophobicContact CE1-CD2 4.2Å; F30-L76 HydrophobicContact CG-CD1 4.42Å; L76-I82 HydrophobicContact CD2-CB 4.21Å; L76-I82 HydrophobicContact CD2-CD1 4.02Å; L76-I82 HydrophobicContact CD2-CG1 3.69Å; L76-I82 HydrophobicContact CD2-CG2 3.81Å
77	D	71	Confident	66.7	Low	47 Å²	47	65.3 Å²	65.3	25%	0.251	34%	0.339	S	S	.	.			trans	-92.7	141.6	-174.4	-165.1	-79	0	0	0	111.8	N79 R80 K81	D77-N79 PolarHBondContact O-N 2.63Å; D77-N79 VanDerWaalsContact O-N 3.14Å; D77-N79 WeakPolarHBondContact OD1-CA 3.49Å; D77-N79 WeakPolarHBondContact OD1-CB 3.27Å; D77-N79 VanDerWaalsContact OD1-CG 3.27Å; D77-N79 PolarHBondContact OD1-N 2.85Å; D77-N79 PolarHBondContact OD1-ND2 3.18Å; D77-R80 PolarHBondContact O-N 3.45Å; D77-K81 HydrophobicContact CB-CB 4.11Å; D77-K81 WeakPolarHBondContact CB-O 3.31Å; D77-K81 PolarHBondContact N-O 3.24Å
78	P	71	Confident	67.6	Low	79 Å²	79	64.1 Å²	64.1	51%	0.513	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-26.3	172.5	-26.5	35.4	0	0	0	114.7	F18 R80	F18-P78 HydrophobicContact CD1-CG 4.25Å; F18-P78 HydrophobicContact CD2-CB 4.35Å; F18-P78 HydrophobicContact CE1-CG 4.2Å; F18-P78 HydrophobicContact CE2-CG 4.48Å; F18-P78 HydrophobicContact CG-CB 4.4Å; F18-P78 HydrophobicContact CG-CG 4.44Å; F18-P78 HydrophobicContact CZ-CG 4.31Å; P78-R80 PolarHBondContact O-N 2.63Å; P78-R80 VanDerWaalsContact O-N 3.16Å
79	N	74.7	Confident	68.3	Low	126 Å²	126	62.1 Å²	62.1	67%	0.674	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	14.4	174	-57.4	-56.9	0	0	0	113.2	D77 K81	D77-N79 PolarHBondContact O-N 2.63Å; D77-N79 VanDerWaalsContact O-N 3.14Å; D77-N79 WeakPolarHBondContact OD1-CA 3.49Å; D77-N79 WeakPolarHBondContact OD1-CB 3.27Å; D77-N79 VanDerWaalsContact OD1-CG 3.27Å; D77-N79 PolarHBondContact OD1-N 2.85Å; D77-N79 PolarHBondContact OD1-ND2 3.18Å; N79-K81 VanDerWaalsContact C-N 3.28Å; N79-K81 PolarHBondContact O-N 3.33Å
80	R	70.5	Confident	68.6	Low	122 Å²	122	59.7 Å²	59.7	46%	0.46	31%	0.312	S	S	.	.	S	Bend	trans	68.2	23.1	176.2	-47.3	173.2	-176.5	172.2	5.8	114.6	N20 Q21 D77 P78	N20-R80 VanDerWaalsContact OD1-CA 3.27Å; N20-R80 WeakPolarHBondContact OD1-CA 3.41Å; Q21-R80 VanDerWaalsContact CD-NH1 3.26Å; D77-R80 PolarHBondContact O-N 3.45Å; P78-R80 PolarHBondContact O-N 2.63Å; P78-R80 VanDerWaalsContact O-N 3.16Å
81	K	75.8	Confident	68.8	Low	141 Å²	141	67.4 Å²	67.4	61%	0.613	34%	0.344	S	S	*	.			trans	-92.6	136.5	171.7	-63.4	-176.2	-179.7	-178.5	0	108.9	D77 N79	D77-K81 HydrophobicContact CB-CB 4.11Å; D77-K81 WeakPolarHBondContact CB-O 3.31Å; D77-K81 PolarHBondContact N-O 3.24Å; N79-K81 VanDerWaalsContact C-N 3.28Å; N79-K81 PolarHBondContact O-N 3.33Å
82	I	73	Confident	68.3	Low	39 Å²	39	69.8 Å²	69.8	20%	0.2	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.6	167.1	-54.2	-179.8	0	0	0	104.9	Y22 M40 I49 L75 L76	Y22-I82 HydrophobicContact CD2-CD1 4.2Å; M40-I82 HydrophobicContact SD-CD1 3.92Å; I49-I82 HydrophobicContact CD1-CB 4.27Å; I49-I82 HydrophobicContact CD1-CD1 3.7Å; I49-I82 HydrophobicContact CD1-CG2 3.7Å; L75-I82 WeakPolarHBondContact O-CA 3.25Å; L76-I82 HydrophobicContact CD2-CB 4.21Å; L76-I82 HydrophobicContact CD2-CD1 4.02Å; L76-I82 HydrophobicContact CD2-CG1 3.69Å; L76-I82 HydrophobicContact CD2-CG2 3.81Å
83	S	73	Confident	67.9	Low	23 Å²	23	68.5 Å²	68.5	16%	0.161	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.1	179.7	-68.2	0	0	0	0	111.3	C74 L75 M130	C74-S83 CarbonylContact C-O 3.54Å; C74-S83 WeakPolarHBondContact CA-O 3.38Å; L75-S83 PolarHBondContact N-O 3.31Å; L75-S83 PolarHBondContact O-N 2.8Å; S83-M130 CarbonylContact C-O 3.38Å; S83-M130 WeakPolarHBondContact CA-O 3.1Å; S83-M130 WeakPolarHBondContact CB-O 3.41Å; S83-M130 PolarHBondContact OG-O 3.34Å
84	S	69.4	Low	67.3	Low	12 Å²	12	70.7 Å²	70.7	8%	0.084	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.7	176.6	-65.3	0	0	0	0	108.9	T73 C74 M130	T73-S84 WeakPolarHBondContact O-CA 3.06Å; C74-S84 PolarHBondContact SG-OG 3.49Å; C74-S84 VanDerWaalsContact SG-OG 3.4Å; S84-M130 PolarHBondContact N-O 3.4Å; S84-M130 PolarHBondContact O-N 3.46Å
85	Y	68.6	Low	66.8	Low	85 Å²	85	77 Å²	77	33%	0.333	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.6	-179.9	-177.2	-103.6	0	0	0	109.9	T72 T73 V87 A127 M128 L129	T72-Y85 CarbonylContact C-O 3.55Å; T72-Y85 WeakPolarHBondContact CA-O 3.15Å; T72-Y85 WeakPolarHBondContact CG2-O 3.24Å; T73-Y85 PolarHBondContact N-O 2.86Å; T73-Y85 PolarHBondContact O-N 2.79Å; Y85-V87 HydrophobicContact CD1-CG2 3.66Å; Y85-V87 HydrophobicContact CE1-CB 4.38Å; Y85-V87 HydrophobicContact CE1-CG2 3.89Å; Y85-A127 HydrophobicContact CE2-CB 4.42Å; Y85-A127 WeakPolarHBondContact CE2-O 3.32Å; Y85-A127 WeakPolarHBondContact OH-CA 3Å; Y85-A127 WeakPolarHBondContact OH-CB 3.48Å; Y85-M128 WeakPolarHBondContact CD2-O 3.36Å; Y85-L129 HydrophobicContact CD2-CB 4.32Å; Y85-L129 HydrophobicContact CD2-CD1 4.34Å
86	Y	71.6	Confident	66.2	Low	1 Å²	1	75.3 Å²	75.3	0%	0.004	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109	177.7	-53.2	-86.7	0	0	0	108.7	T51 T72 I89 W98 S100 V124 A127 M128 M130	T51-Y86 HydrophobicContact CG2-CE1 3.74Å; T51-Y86 WeakPolarHBondContact CG2-OH 3.17Å; T72-Y86 HydrophobicContact CG2-CD1 3.97Å; T72-Y86 HydrophobicContact CG2-CE1 4.07Å; T72-Y86 WeakPolarHBondContact OG1-CD1 3.35Å; Y86-I89 HydrophobicContact CD1-CD1 4.09Å; Y86-I89 HydrophobicContact CG-CD1 4.03Å; Y86-W98 HydrophobicContact CD1-CH2 4.04Å; Y86-W98 HydrophobicContact CD1-CZ3 4.36Å; Y86-W98 HydrophobicContact CE1-CH2 4.03Å; Y86-W98 AromaticContact CE1-CZ3 3.87Å; Y86-W98 HydrophobicContact CE1-CZ3 3.87Å; Y86-S100 PolarHBondContact OH-OG 2.88Å; Y86-V124 HydrophobicContact CD1-CG1 3.82Å; Y86-V124 HydrophobicContact CD2-CG1 4.24Å; Y86-V124 HydrophobicContact CE1-CG1 3.56Å; Y86-V124 HydrophobicContact CE2-CB 4.42Å; Y86-V124 HydrophobicContact CE2-CG1 4Å; Y86-V124 HydrophobicContact CE2-CG2 4.31Å; Y86-V124 HydrophobicContact CG-CG1 4.15Å; Y86-A127 WeakPolarHBondContact O-CA 3.38Å; Y86-A127 PolarHBondContact O-N 3.2Å; Y86-M128 PolarHBondContact N-O 2.79Å; Y86-M130 HydrophobicContact CE2-CE 3.45Å; Y86-M130 VanDerWaalsContact CE2-CE 3.45Å; Y86-M130 WeakPolarHBondContact OH-CE 3.42Å
87	V	66.5	Low	65.6	Low	57 Å²	57	74.6 Å²	74.6	35%	0.345	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-44.9	-172.9	179.3	0	0	0	0	110.7	K71 Y85	K71-V87 HydrophobicContact CB-CB 4.11Å; K71-V87 HydrophobicContact CD-CB 4.24Å; K71-V87 HydrophobicContact CD-CG1 4.18Å; K71-V87 HydrophobicContact CG-CB 4.01Å; K71-V87 HydrophobicContact CG-CG1 4.49Å; K71-V87 HydrophobicContact CG-CG2 4.23Å; K71-V87 WeakPolarHBondContact O-CB 3.5Å; K71-V87 PolarHBondContact O-N 3.19Å; Y85-V87 HydrophobicContact CD1-CG2 3.66Å; Y85-V87 HydrophobicContact CE1-CB 4.38Å; Y85-V87 HydrophobicContact CE1-CG2 3.89Å
88	D	65.8	Low	65.4	Low	100 Å²	100	72.9 Å²	72.9	54%	0.535	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	129.7	178.8	-161.3	-6.2	0	0	0	109.1	A70 K71	A70-D88 CarbonylContact C-O 3.53Å; A70-D88 VanDerWaalsContact CA-O 3.26Å; A70-D88 WeakPolarHBondContact CA-O 3.44Å; K71-D88 PolarHBondContact N-O 2.9Å; K71-D88 PolarHBondContact O-N 3.12Å
89	I	64.7	Low	65.3	Low	8 Å²	8	72.9 Å²	72.9	4%	0.041	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.7	177.2	-54.7	177.9	0	0	0	106.1	A70 Y86 I93 W98 V124 T126	A70-I89 HydrophobicContact CB-CG1 4.49Å; Y86-I89 HydrophobicContact CD1-CD1 4.09Å; Y86-I89 HydrophobicContact CG-CD1 4.03Å; I89-I93 HydrophobicContact CG2-CB 3.73Å; I89-I93 HydrophobicContact CG2-CD1 4.02Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 HydrophobicContact CG2-CG2 3.82Å; I89-W98 HydrophobicContact CD1-CZ2 3.87Å; I89-W98 HydrophobicContact CG1-CZ2 4.03Å; I89-W98 HydrophobicContact CG2-CZ2 3.94Å; I89-V124 HydrophobicContact CD1-CG1 3.71Å; I89-T126 PolarHBondContact N-OG1 2.94Å
90	S	61.8	Low	65.4	Low	38 Å²	38	67 Å²	67	27%	0.266	33%	0.329	S	S	.	.			trans	-67.1	143.9	176.4	48.5	0	0	0	0	111.8	V68 M69 E92 I93	V68-S90 WeakPolarHBondContact CG1-OG 3.4Å; M69-S90 PolarHBondContact N-OG 2.93Å; S90-E92 VanDerWaalsContact C-N 3.32Å; S90-E92 PolarHBondContact O-N 2.87Å; S90-I93 WeakPolarHBondContact O-CA 3.34Å; S90-I93 WeakPolarHBondContact O-CB 3.48Å; S90-I93 WeakPolarHBondContact O-CG1 3.13Å; S90-I93 PolarHBondContact O-N 2.75Å; S90-I93 WeakPolarHBondContact OG-CD1 3.49Å; S90-I93 VanDerWaalsContact OG-CG1 3.23Å; S90-I93 WeakPolarHBondContact OG-CG1 2.98Å
91	K	62.4	Low	65.9	Low	173 Å²	173	63.9 Å²	63.9	75%	0.752	32%	0.319	S	S	*	.	H	α-helix	trans	-55.9	-36.5	-174	-83.1	-173.6	174.9	-175.9	0	115.6	I93 E94	K91-I93 PolarHBondContact O-N 3.14Å; K91-E94 PolarHBondContact O-N 3.28Å
92	E	57.2	Low	66.3	Low	142 Å²	142	59.6 Å²	59.6	66%	0.664	30%	0.302	S	S	*	.	H	α-helix	trans	-59.4	-21.5	176.7	-65.9	-173.3	176.2	0	0	112.2	V68 S90	V68-E92 HydrophobicContact CG1-CB 4.3Å; V68-E92 HydrophobicContact CG2-CB 3.81Å; V68-E92 HydrophobicContact CG2-CG 4.41Å; V68-E92 WeakPolarHBondContact CG2-OE2 3.39Å; S90-E92 VanDerWaalsContact C-N 3.32Å; S90-E92 PolarHBondContact O-N 2.87Å
93	I	55.2	Low	66.9	Low	1 Å²	1	58 Å²	58	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-72.4	-39.1	176.1	-57.2	-174.9	0	0	0	112.1	L53 V68 M69 A70 I89 S90 K91 E95 S96 W98	L53-I93 HydrophobicContact CD1-CB 4.49Å; L53-I93 HydrophobicContact CD1-CD1 3.91Å; L53-I93 HydrophobicContact CD1-CG1 4.36Å; L53-I93 HydrophobicContact CD1-CG2 3.27Å; L53-I93 HydrophobicContact CD2-CB 4.45Å; L53-I93 HydrophobicContact CD2-CG2 3.08Å; L53-I93 HydrophobicContact CG-CG2 3.62Å; V68-I93 HydrophobicContact CB-CG1 4.42Å; V68-I93 HydrophobicContact CG1-CB 4.25Å; V68-I93 HydrophobicContact CG1-CD1 3.58Å; V68-I93 HydrophobicContact CG1-CG1 2.96Å; M69-I93 VanDerWaalsContact C-CD1 3.47Å; M69-I93 WeakPolarHBondContact O-CD1 3.45Å; A70-I93 HydrophobicContact CB-CD1 3.81Å; I89-I93 HydrophobicContact CG2-CB 3.73Å; I89-I93 HydrophobicContact CG2-CD1 4.02Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 HydrophobicContact CG2-CG2 3.82Å; S90-I93 WeakPolarHBondContact O-CA 3.34Å; S90-I93 WeakPolarHBondContact O-CB 3.48Å; S90-I93 WeakPolarHBondContact O-CG1 3.13Å; S90-I93 PolarHBondContact O-N 2.75Å; S90-I93 WeakPolarHBondContact OG-CD1 3.49Å; S90-I93 VanDerWaalsContact OG-CG1 3.23Å; S90-I93 WeakPolarHBondContact OG-CG1 2.98Å; K91-I93 PolarHBondContact O-N 3.14Å; I93-E95 PolarHBondContact O-N 2.82Å; I93-S96 WeakPolarHBondContact CA-OG 3.14Å; I93-S96 PolarHBondContact O-N 3.01Å; I93-S96 PolarHBondContact O-OG 3.34Å; I93-W98 HydrophobicContact CG2-CZ2 4.03Å
94	E	55.6	Low	67.4	Low	108 Å²	108	60 Å²	60	51%	0.505	30%	0.298	S	S	.	.	H	α-helix	trans	-55.9	-27.1	-176.3	-72.8	-175.4	164.2	0	0	111.3	K91	K91-E94 PolarHBondContact O-N 3.28Å
95	E	53.6	Low	68.2	Low	182 Å²	182	59.9 Å²	59.9	85%	0.85	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-17.3	177.1	-58.7	-174.2	175.6	0	0	114.2	I93 G97	I93-E95 PolarHBondContact O-N 2.82Å; E95-G97 VanDerWaalsContact C-N 3.35Å; E95-G97 PolarHBondContact O-N 2.85Å
96	S	56.6	Low	68.8	Low	59 Å²	59	59.7 Å²	59.7	41%	0.413	30%	0.299	S	S	.	.	S	Bend	trans	-85	10.4	-166.4	69.2	0	0	0	0	116.4	L53 I93	L53-S96 WeakPolarHBondContact CD2-OG 3.46Å; I93-S96 WeakPolarHBondContact CA-OG 3.14Å; I93-S96 PolarHBondContact O-N 3.01Å; I93-S96 PolarHBondContact O-OG 3.34Å
97	G	60.4	Low	69.2	Low	24 Å²	24	63.2 Å²	63.2	25%	0.247	32%	0.32	C	S	.	.			trans	76.8	64.1	174	0	0	0	0	0	113.6	S54 E95 E121	S54-G97 WeakPolarHBondContact CB-O 3.45Å; E95-G97 VanDerWaalsContact C-N 3.35Å; E95-G97 PolarHBondContact O-N 2.85Å; G97-E121 WeakPolarHBondContact CA-OE1 2.86Å
98	W	65	Low	69.7	Low	11 Å²	11	64.1 Å²	64.1	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	135	172.6	-94.8	97.9	0	0	0	111.6	L53 A70 Y86 I89 I93 E121 V124	L53-W98 HydrophobicContact CD1-CH2 4.12Å; L53-W98 HydrophobicContact CD1-CZ2 3.68Å; L53-W98 HydrophobicContact CD2-CB 4.47Å; L53-W98 HydrophobicContact CD2-CD2 3.71Å; L53-W98 HydrophobicContact CD2-CE3 4.47Å; L53-W98 HydrophobicContact CD2-CG 3.66Å; L53-W98 HydrophobicContact CD2-CZ2 4.34Å; L53-W98 HydrophobicContact CG-CD2 3.73Å; L53-W98 HydrophobicContact CG-CE3 4.08Å; L53-W98 HydrophobicContact CG-CG 4.24Å; L53-W98 HydrophobicContact CG-CH2 4.14Å; L53-W98 HydrophobicContact CG-CZ2 3.8Å; L53-W98 HydrophobicContact CG-CZ3 4.28Å; A70-W98 HydrophobicContact CB-CH2 3.84Å; A70-W98 HydrophobicContact CB-CZ2 3.63Å; Y86-W98 HydrophobicContact CD1-CH2 4.04Å; Y86-W98 HydrophobicContact CD1-CZ3 4.36Å; Y86-W98 HydrophobicContact CE1-CH2 4.03Å; Y86-W98 AromaticContact CE1-CZ3 3.87Å; Y86-W98 HydrophobicContact CE1-CZ3 3.87Å; I89-W98 HydrophobicContact CD1-CZ2 3.87Å; I89-W98 HydrophobicContact CG1-CZ2 4.03Å; I89-W98 HydrophobicContact CG2-CZ2 3.94Å; I93-W98 HydrophobicContact CG2-CZ2 4.03Å; W98-E121 HydrophobicContact CB-CG 4.17Å; W98-E121 PolarHBondContact N-OE1 3.42Å; W98-V124 HydrophobicContact CD2-CG1 3.81Å; W98-V124 HydrophobicContact CE3-CG1 3.9Å; W98-V124 HydrophobicContact CG-CG1 4.33Å; W98-V124 HydrophobicContact CH2-CG1 4.3Å; W98-V124 HydrophobicContact CZ2-CG1 4.2Å; W98-V124 HydrophobicContact CZ3-CG1 4.14Å
99	Q	69.9	Low	70.6	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.364	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	86	175.9	-70.6	-168.8	23.6	0	0	111.3	R52 K101	R52-Q99 CarbonylContact O-C 3.35Å; R52-Q99 PolarHBondContact O-N 3.05Å; Q99-K101 VanDerWaalsContact OE1-CE 3.3Å
100	S	76.9	Confident	71.5	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.7	169	-70.1	0	0	0	0	110.2	I50 T51 Y86 V119	I50-S100 CarbonylContact O-C 3.57Å; I50-S100 WeakPolarHBondContact O-CA 3.04Å; T51-S100 WeakPolarHBondContact CG2-OG 3.11Å; Y86-S100 PolarHBondContact OH-OG 2.88Å; S100-V119 PolarHBondContact O-N 3.02Å
101	K	80.9	Confident	72.6	Confident	56 Å²	56	72.5 Å²	72.5	24%	0.243	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.1	-176.2	-47.6	-174.9	-175.4	173	0	110.9	I50 Q99 V116 I117 L118	I50-K101 HydrophobicContact CG2-CB 3.87Å; I50-K101 HydrophobicContact CG2-CG 4.26Å; I50-K101 PolarHBondContact N-O 3.4Å; I50-K101 PolarHBondContact O-N 2.99Å; Q99-K101 VanDerWaalsContact OE1-CE 3.3Å; K101-V116 HydrophobicContact CB-CG1 4.1Å; K101-V116 HydrophobicContact CD-CG1 4.28Å; K101-I117 WeakPolarHBondContact CA-O 3.45Å; K101-L118 HydrophobicContact CB-CD2 4.44Å; K101-L118 HydrophobicContact CD-CD2 3.66Å; K101-L118 HydrophobicContact CG-CD2 3.66Å
102	I	83.5	Confident	73.5	Confident	52 Å²	52	70.6 Å²	70.6	27%	0.267	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	112.5	171.3	-57.9	172.6	0	0	0	105.9	Y22 Y23 I49 V116 I117	Y22-I102 HydrophobicContact CE2-CG2 4.29Å; Y22-I102 WeakPolarHBondContact OH-CG2 3.23Å; Y23-I102 HydrophobicContact CE2-CG2 4.16Å; I49-I102 HydrophobicContact CG1-CG1 4.36Å; I49-I102 HydrophobicContact CG1-CG2 4.16Å; I49-I102 HydrophobicContact CG2-CG1 4.49Å; I102-V116 WeakPolarHBondContact O-CA 3.47Å; I102-I117 HydrophobicContact CB-CB 4.32Å; I102-I117 PolarHBondContact N-O 3.01Å; I102-I117 PolarHBondContact O-N 3.28Å
103	D	85.9	Confident	74.8	Confident	6 Å²	6	66.5 Å²	66.5	3%	0.032	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.8	-178.7	177	69.5	0	0	0	111.9	Y22 G47 F48 A105 A114 S115 V116	Y22-D103 VanDerWaalsContact CE1-O 3.3Å; Y22-D103 WeakPolarHBondContact CE1-O 3.16Å; Y22-D103 VanDerWaalsContact OH-C 3.3Å; Y22-D103 PolarHBondContact OH-O 3.32Å; G47-D103 WeakPolarHBondContact CA-O 3.19Å; F48-D103 HydrophobicContact CD1-CB 3.57Å; F48-D103 HydrophobicContact CE1-CB 3.38Å; F48-D103 HydrophobicContact CE2-CB 4.39Å; F48-D103 HydrophobicContact CG-CB 4.24Å; F48-D103 HydrophobicContact CZ-CB 3.84Å; F48-D103 PolarHBondContact N-O 3.01Å; F48-D103 VanDerWaalsContact N-O 3.1Å; F48-D103 PolarHBondContact O-N 3.3Å; D103-A105 PolarHBondContact OD2-N 2.89Å; D103-A114 VanDerWaalsContact OD1-CB 3.22Å; D103-A114 WeakPolarHBondContact OD1-CB 3.26Å; D103-S115 WeakPolarHBondContact CA-O 3.44Å; D103-V116 HydrophobicContact CB-CG2 4.25Å; D103-V116 WeakPolarHBondContact OD1-CG2 3.47Å
104	R	84.9	Confident	76.2	Confident	63 Å²	63	69.3 Å²	69.3	24%	0.238	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.1	166.1	-174.6	-169.7	-171.4	-171.6	3.1	110.9	Y22 Y23 S25 A114 S115	Y22-R104 HydrophobicContact CE1-CB 4.11Å; Y22-R104 HydrophobicContact CE1-CG 4.27Å; Y23-R104 VanDerWaalsContact CB-CD 3.46Å; Y23-R104 HydrophobicContact CD2-CB 4.17Å; Y23-R104 HydrophobicContact CD2-CG 4.35Å; Y23-R104 HydrophobicContact CE2-CB 4.21Å; Y23-R104 HydrophobicContact CG-CB 4.47Å; Y23-R104 HydrophobicContact CG-CG 4.38Å; Y23-R104 VanDerWaalsContact O-CZ 3.25Å; Y23-R104 PolarHBondContact O-NH1 3.06Å; Y23-R104 PolarHBondContact O-NH2 3.5Å; S25-R104 PolarHBondContact OG-NH2 2.91Å; R104-A114 CarbonylContact O-C 3.59Å; R104-A114 WeakPolarHBondContact O-CA 3.11Å; R104-S115 PolarHBondContact N-O 3.36Å; R104-S115 PolarHBondContact O-N 3.01Å
105	A	85.7	Confident	77.7	Confident	11 Å²	11	66.6 Å²	66.6	9%	0.091	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.7	165.7	0	0	0	0	0	110.9	Y45 L46 D103 I112 T113	Y45-A105 HydrophobicContact CD1-CB 3.78Å; Y45-A105 HydrophobicContact CE1-CB 3.93Å; L46-A105 PolarHBondContact O-N 2.79Å; D103-A105 PolarHBondContact OD2-N 2.89Å; A105-I112 HydrophobicContact CB-CG2 4.11Å; A105-T113 WeakPolarHBondContact CA-O 3.22Å
106	F	81.2	Confident	79.3	Confident	80 Å²	80	61.4 Å²	61.4	35%	0.351	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	146.5	172.6	57.1	-84.1	0	0	0	110.7	T113	F106-T113 VanDerWaalsContact CD1-O 3.28Å; F106-T113 WeakPolarHBondContact CD1-O 3.38Å; F106-T113 HydrophobicContact CE1-CG2 4.05Å; F106-T113 HydrophobicContact CE2-CG2 3.82Å; F106-T113 HydrophobicContact CZ-CG2 3.4Å; F106-T113 PolarHBondContact N-O 3.37Å; F106-T113 PolarHBondContact O-N 3.02Å; F106-T113 VanDerWaalsContact O-O 3.13Å
107	V	79.3	Confident	80.6	Confident	75 Å²	75	62.6 Å²	62.6	46%	0.455	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	124.2	176.8	179.6	0	0	0	0	108.7	G109 N111	V107-G109 VanDerWaalsContact CG1-O 3.29Å; V107-G109 WeakPolarHBondContact CG1-O 3Å; V107-N111 WeakPolarHBondContact CA-O 3.45Å
108	C	77.8	Confident	81.7	Confident	77 Å²	77	66.8 Å²	66.8	52%	0.52	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	100.2	173.4	-169.4	0	0	0	0	108.7	T110 N111	C108-T110 PolarHBondContact O-N 3.45Å; C108-N111 PolarHBondContact N-O 2.81Å; C108-N111 PolarHBondContact O-N 2.8Å; C108-N111 VanDerWaalsContact O-N 3.08Å
109	G	85.2	Confident	82.4	Confident	72 Å²	72	67.1 Å²	67.1	74%	0.742	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	-119.3	-170.7	0	0	0	0	0	111.2	V107	V107-G109 VanDerWaalsContact CG1-O 3.29Å; V107-G109 WeakPolarHBondContact CG1-O 3Å
110	T	83.1	Confident	82.8	Confident	141 Å²	141	65.6 Å²	65.6	87%	0.865	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-7.7	174.7	55.2	0	0	0	0	113.5	C108	C108-T110 PolarHBondContact O-N 3.45Å
111	N	83.8	Confident	82.6	Confident	108 Å²	108	70.6 Å²	70.6	58%	0.578	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	149.9	-173.9	-66	-22.5	0	0	0	111.3	V107 C108	V107-N111 WeakPolarHBondContact CA-O 3.45Å; C108-N111 PolarHBondContact N-O 2.81Å; C108-N111 PolarHBondContact O-N 2.8Å; C108-N111 VanDerWaalsContact O-N 3.08Å
112	I	81.4	Confident	82.4	Confident	134 Å²	134	76.8 Å²	76.8	69%	0.687	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.8	167.3	-59.3	174.7	0	0	0	107.1	A105	A105-I112 HydrophobicContact CB-CG2 4.11Å
113	T	85.4	Confident	81.9	Confident	56 Å²	56	80.2 Å²	80.2	34%	0.344	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.6	175.1	-52.2	0	0	0	0	108.5	A105 F106	A105-T113 WeakPolarHBondContact CA-O 3.22Å; F106-T113 VanDerWaalsContact CD1-O 3.28Å; F106-T113 WeakPolarHBondContact CD1-O 3.38Å; F106-T113 HydrophobicContact CE1-CG2 4.05Å; F106-T113 HydrophobicContact CE2-CG2 3.82Å; F106-T113 HydrophobicContact CZ-CG2 3.4Å; F106-T113 PolarHBondContact N-O 3.37Å; F106-T113 PolarHBondContact O-N 3.02Å; F106-T113 VanDerWaalsContact O-O 3.13Å
114	A	85.2	Confident	81.3	Confident	59 Å²	59	80.3 Å²	80.3	49%	0.488	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.1	177.9	0	0	0	0	0	109.5	D103 R104	D103-A114 VanDerWaalsContact OD1-CB 3.22Å; D103-A114 WeakPolarHBondContact OD1-CB 3.26Å; R104-A114 CarbonylContact O-C 3.59Å; R104-A114 WeakPolarHBondContact O-CA 3.11Å
115	S	85.7	Confident	80.7	Confident	52 Å²	52	82.4 Å²	82.4	36%	0.364	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	109.9	169.6	170.7	0	0	0	0	107.7	D103 R104	D103-S115 WeakPolarHBondContact CA-O 3.44Å; R104-S115 PolarHBondContact N-O 3.36Å; R104-S115 PolarHBondContact O-N 3.01Å
116	V	86.8	Confident	79.9	Confident	73 Å²	73	84.9 Å²	84.9	44%	0.442	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.4	-178.5	-176.2	0	0	0	0	109.7	K101 I102 D103 L118	K101-V116 HydrophobicContact CB-CG1 4.1Å; K101-V116 HydrophobicContact CD-CG1 4.28Å; I102-V116 WeakPolarHBondContact O-CA 3.47Å; D103-V116 HydrophobicContact CB-CG2 4.25Å; D103-V116 WeakPolarHBondContact OD1-CG2 3.47Å; V116-L118 HydrophobicContact CG1-CD2 3.83Å; V116-L118 HydrophobicContact CG1-CG 4.46Å
117	I	85.3	Confident	79.4	Confident	83 Å²	83	83.9 Å²	83.9	43%	0.426	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.9	163	-58	-178.8	0	0	0	107	Y23 K101 I102	Y23-I117 WeakPolarHBondContact OH-CD1 3.38Å; K101-I117 WeakPolarHBondContact CA-O 3.45Å; I102-I117 HydrophobicContact CB-CB 4.32Å; I102-I117 PolarHBondContact N-O 3.01Å; I102-I117 PolarHBondContact O-N 3.28Å
118	L	83.5	Confident	79.1	Confident	112 Å²	112	83.3 Å²	83.3	59%	0.586	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.6	169.9	-58.8	178.7	0	0	0	108.4	K101 V116 P120	K101-L118 HydrophobicContact CB-CD2 4.44Å; K101-L118 HydrophobicContact CD-CD2 3.66Å; K101-L118 HydrophobicContact CG-CD2 3.66Å; V116-L118 HydrophobicContact CG1-CD2 3.83Å; V116-L118 HydrophobicContact CG1-CG 4.46Å; L118-P120 WeakPolarHBondContact O-CD 3.17Å
119	V	78.5	Confident	78.8	Confident	19 Å²	19	85.1 Å²	85.1	12%	0.115	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.1	170.4	176.1	0	0	0	0	107.4	S100 W123 V124 M130	S100-V119 PolarHBondContact O-N 3.02Å; V119-W123 HydrophobicContact CG1-CB 4.23Å; V119-W123 HydrophobicContact CG1-CE3 4.5Å; V119-V124 HydrophobicContact CG1-CG2 3.86Å; V119-M130 HydrophobicContact CG1-CE 3.45Å; V119-M130 VanDerWaalsContact CG1-CE 3.45Å; V119-M130 HydrophobicContact CG1-SD 3.57Å; V119-M130 VanDerWaalsContact CG1-SD 3.57Å; V119-M130 HydrophobicContact CG2-CE 4.42Å
120	P	78.4	Confident	78.1	Confident	45 Å²	45	85.4 Å²	85.4	29%	0.292	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-60.1	138.7	175.3	-21.8	33.5	0	0	0	111.4	L118 R122 W123	L118-P120 WeakPolarHBondContact O-CD 3.17Å; P120-R122 HydrophobicContact CB-CG 3.93Å; P120-R122 PolarHBondContact O-N 2.95Å; P120-W123 HydrophobicContact CB-CD2 4.42Å; P120-W123 HydrophobicContact CB-CG 4.34Å; P120-W123 HydrophobicContact CG-CD2 3.97Å; P120-W123 HydrophobicContact CG-CE3 4.21Å; P120-W123 HydrophobicContact CG-CG 4.41Å; P120-W123 HydrophobicContact CG-CZ2 4.38Å; P120-W123 WeakPolarHBondContact O-CB 3.39Å; P120-W123 PolarHBondContact O-N 2.69Å
121	E	73.8	Confident	77.8	Confident	108 Å²	108	82.7 Å²	82.7	51%	0.505	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-55.6	-38	-179.6	-65.4	177	163.2	0	0	112.4	G97 W98 W123 V124	G97-E121 WeakPolarHBondContact CA-OE1 2.86Å; W98-E121 HydrophobicContact CB-CG 4.17Å; W98-E121 PolarHBondContact N-OE1 3.42Å; E121-W123 PolarHBondContact O-N 3.29Å; E121-V124 WeakPolarHBondContact O-CB 3.19Å; E121-V124 PolarHBondContact O-N 3.38Å
122	R	75.4	Confident	77.5	Confident	187 Å²	187	81.3 Å²	81.3	71%	0.706	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-61.7	-6.8	174.5	66.3	170.9	-176.8	-173.7	-0.5	115.7	P120	P120-R122 HydrophobicContact CB-CG 3.93Å; P120-R122 PolarHBondContact O-N 2.95Å
123	W	74.5	Confident	77.3	Confident	124 Å²	124	78.4 Å²	78.4	47%	0.47	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-100.8	1	173.3	-64.8	-4.2	0	0	0	112	V119 P120 E121 M128 M130	V119-W123 HydrophobicContact CG1-CB 4.23Å; V119-W123 HydrophobicContact CG1-CE3 4.5Å; P120-W123 HydrophobicContact CB-CD2 4.42Å; P120-W123 HydrophobicContact CB-CG 4.34Å; P120-W123 HydrophobicContact CG-CD2 3.97Å; P120-W123 HydrophobicContact CG-CE3 4.21Å; P120-W123 HydrophobicContact CG-CG 4.41Å; P120-W123 HydrophobicContact CG-CZ2 4.38Å; P120-W123 WeakPolarHBondContact O-CB 3.39Å; P120-W123 PolarHBondContact O-N 2.69Å; E121-W123 PolarHBondContact O-N 3.29Å; W123-M128 VanDerWaalsContact C-SD 3.59Å; W123-M128 HydrophobicContact CB-CE 4.05Å; W123-M128 HydrophobicContact CG-CE 4.43Å; W123-M130 HydrophobicContact CB-SD 3.85Å; W123-M130 HydrophobicContact CE3-SD 4.14Å
124	V	73.5	Confident	76.8	Confident	7 Å²	7	79.7 Å²	79.7	4%	0.042	42%	0.418	C	S	.	.			trans	-110.8	80.9	-178.6	-176.3	0	0	0	0	107.6	Y86 I89 W98 V119 E121 M130	Y86-V124 HydrophobicContact CD1-CG1 3.82Å; Y86-V124 HydrophobicContact CD2-CG1 4.24Å; Y86-V124 HydrophobicContact CE1-CG1 3.56Å; Y86-V124 HydrophobicContact CE2-CB 4.42Å; Y86-V124 HydrophobicContact CE2-CG1 4Å; Y86-V124 HydrophobicContact CE2-CG2 4.31Å; Y86-V124 HydrophobicContact CG-CG1 4.15Å; I89-V124 HydrophobicContact CD1-CG1 3.71Å; W98-V124 HydrophobicContact CD2-CG1 3.81Å; W98-V124 HydrophobicContact CE3-CG1 3.9Å; W98-V124 HydrophobicContact CG-CG1 4.33Å; W98-V124 HydrophobicContact CH2-CG1 4.3Å; W98-V124 HydrophobicContact CZ2-CG1 4.2Å; W98-V124 HydrophobicContact CZ3-CG1 4.14Å; V119-V124 HydrophobicContact CG1-CG2 3.86Å; E121-V124 WeakPolarHBondContact O-CB 3.19Å; E121-V124 PolarHBondContact O-N 3.38Å; V124-M130 HydrophobicContact CG2-CE 4.27Å
125	E	70.9	Confident	76.3	Confident	108 Å²	108	81 Å²	81	51%	0.505	41%	0.414	S	S	.	.			trans	-118.9	150.9	176.4	-65.7	-178.5	-177.2	0	0	109.9	A127 M128	E125-A127 PolarHBondContact O-N 2.87Å; E125-M128 HydrophobicContact CB-CB 4.34Å; E125-M128 WeakPolarHBondContact O-CB 3.27Å; E125-M128 PolarHBondContact O-N 3.2Å
126	T	69.9	Low	75.7	Confident	62 Å²	62	82.9 Å²	82.9	38%	0.38	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	134.9	174.2	-64.7	0	0	0	0	110.2	I89 M128	I89-T126 PolarHBondContact N-OG1 2.94Å; T126-M128 PolarHBondContact O-N 2.82Å
127	A	70.1	Confident	74.9	Confident	60 Å²	60	83.6 Å²	83.6	50%	0.496	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	15.2	-175.5	0	0	0	0	0	116.1	Y85 Y86 E125	Y85-A127 HydrophobicContact CE2-CB 4.42Å; Y85-A127 WeakPolarHBondContact CE2-O 3.32Å; Y85-A127 WeakPolarHBondContact OH-CA 3Å; Y85-A127 WeakPolarHBondContact OH-CB 3.48Å; Y86-A127 WeakPolarHBondContact O-CA 3.38Å; Y86-A127 PolarHBondContact O-N 3.2Å; E125-A127 PolarHBondContact O-N 2.87Å
128	M	73.1	Confident	74.1	Confident	62 Å²	62	83.7 Å²	83.7	31%	0.305	42%	0.415	S	S	.	.			trans	-86.3	137.8	171.5	-166.7	162.2	171	0	0	111.7	Y85 Y86 W123 E125 T126	Y85-M128 WeakPolarHBondContact CD2-O 3.36Å; Y86-M128 PolarHBondContact N-O 2.79Å; W123-M128 VanDerWaalsContact C-SD 3.59Å; W123-M128 HydrophobicContact CB-CE 4.05Å; W123-M128 HydrophobicContact CG-CE 4.43Å; E125-M128 HydrophobicContact CB-CB 4.34Å; E125-M128 WeakPolarHBondContact O-CB 3.27Å; E125-M128 PolarHBondContact O-N 3.2Å; T126-M128 PolarHBondContact O-N 2.82Å
129	L	71.2	Confident	73.3	Confident	115 Å²	115	81.3 Å²	81.3	60%	0.602	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-105.2	127.2	172.6	-176.8	70.6	0	0	0	109.2	Y85	Y85-L129 HydrophobicContact CD2-CB 4.32Å; Y85-L129 HydrophobicContact CD2-CD1 4.34Å
130	M	70.2	Confident	72.8	Confident	79 Å²	79	87 Å²	87	39%	0.389	43%	0.427	S	S	.	.			trans	-113.9	0	166.1	-70.4	-168	-69.3	0	0	111	S83 S84 Y86 V119 W123 V124	S83-M130 CarbonylContact C-O 3.38Å; S83-M130 WeakPolarHBondContact CA-O 3.1Å; S83-M130 WeakPolarHBondContact CB-O 3.41Å; S83-M130 PolarHBondContact OG-O 3.34Å; S84-M130 PolarHBondContact N-O 3.4Å; S84-M130 PolarHBondContact O-N 3.46Å; Y86-M130 HydrophobicContact CE2-CE 3.45Å; Y86-M130 VanDerWaalsContact CE2-CE 3.45Å; Y86-M130 WeakPolarHBondContact OH-CE 3.42Å; V119-M130 HydrophobicContact CG1-CE 3.45Å; V119-M130 VanDerWaalsContact CG1-CE 3.45Å; V119-M130 HydrophobicContact CG1-SD 3.57Å; V119-M130 VanDerWaalsContact CG1-SD 3.57Å; V119-M130 HydrophobicContact CG2-CE 4.42Å; W123-M130 HydrophobicContact CB-SD 3.85Å; W123-M130 HydrophobicContact CE3-SD 4.14Å; V124-M130 HydrophobicContact CG2-CE 4.27Å

Retrieved 130 of 130 residues in 79.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).