X5J4N3_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4N3, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 108 aa.

						>X5J4N3_MOUSE|X5J4N3
AELVKPGASVKLSCKASGYTFTSYWMHWVKQRPGQGLEWIGMIHPNSGSTNYNEKFKSKATLTVDKSSSTAYMQLSSLTSEDSAVYYCAKLTGTFAYWGQGTLVTVSA
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	A	83.1	Confident	94.6	Very high	102 Å²	102	76.8 Å²	76.8	84%	0.843	46%	0.459	S	S	*	.				0	139.4	0	0	0	0	0	0	107	L103	A1-L103 CarbonylContact C-O 3.58Å; A1-L103 WeakPolarHBondContact CA-O 3.39Å; A1-L103 HydrophobicContact CB-CB 4.01Å
2	E	90.7	Very high	94.8	Very high	91 Å²	91	70.9 Å²	70.9	43%	0.425	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.4	-173.8	-62.2	-62.9	150.1	0	0	109.4	V10 L12 T102 L103 V104 T105	E2-V10 HydrophobicContact CB-CG2 4.07Å; E2-V10 HydrophobicContact CG-CG2 3.91Å; E2-L12 HydrophobicContact CG-CD2 4.35Å; E2-T102 HydrophobicContact CG-CG2 4.3Å; E2-L103 PolarHBondContact N-O 3.23Å; E2-V104 HydrophobicContact CB-CG2 4.31Å; E2-V104 CarbonylContact O-C 3.5Å; E2-V104 WeakPolarHBondContact O-CA 3.39Å; E2-T105 PolarHBondContact O-N 3.34Å
3	L	94.8	Very high	95	Very high	126 Å²	126	71.2 Å²	71.2	66%	0.66	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.6	172.3	-177.6	65.6	0	0	0	108.5	T105 S107	L3-T105 WeakPolarHBondContact CA-O 3.36Å; L3-T105 HydrophobicContact CD1-CG2 3.82Å; L3-S107 WeakPolarHBondContact CD1-OG 3.46Å
4	V	95.6	Very high	95.2	Very high	23 Å²	23	67.1 Å²	67.1	14%	0.139	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.1	-173	-62.3	0	0	0	0	111.5	A8 L78 V104 T105 V106 S107	V4-A8 HydrophobicContact CB-CB 4.36Å; V4-L78 HydrophobicContact CG2-CD1 3.56Å; V4-V104 HydrophobicContact CG2-CG1 4.19Å; V4-T105 PolarHBondContact N-O 3.16Å; V4-V106 HydrophobicContact CG2-CB 4.41Å; V4-V106 HydrophobicContact CG2-CG1 4.49Å; V4-V106 HydrophobicContact CG2-CG2 3.84Å; V4-V106 VanDerWaalsContact O-CA 3.31Å; V4-V106 WeakPolarHBondContact O-CA 3.34Å; V4-S107 PolarHBondContact O-N 2.77Å; V4-S107 VanDerWaalsContact O-N 3.07Å
5	K	95.8	Very high	95.3	Very high	145 Å²	145	72.9 Å²	72.9	63%	0.63	43%	0.425	S	S	*	.			trans	-80.8	152.8	176.5	-66.7	-176.6	177.9	-176.3	0	111.2	G7 A8	K5-G7 PolarHBondContact O-N 3.04Å; K5-A8 WeakPolarHBondContact O-CB 3.31Å; K5-A8 PolarHBondContact O-N 3.28Å; K5-A8 VanDerWaalsContact O-N 3.13Å
6	P	96.9	Very high	95.2	Very high	76 Å²	76	69.1 Å²	69.1	49%	0.494	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	140.2	169.5	-25.2	34.1	0	0	0	111.9	A8 L78 V106 S107	P6-A8 PolarHBondContact O-N 3.33Å; P6-L78 CarbonylContact C-O 3.39Å; P6-L78 WeakPolarHBondContact CA-O 3.3Å; P6-V106 HydrophobicContact CB-CG1 4.46Å; P6-V106 HydrophobicContact CG-CG1 4.21Å; P6-S107 WeakPolarHBondContact CD-O 2.93Å
7	G	95.3	Very high	95	Very high	53 Å²	53	70.9 Å²	70.9	55%	0.546	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-13.7	-176.4	0	0	0	0	0	114.9	K5 L78	K5-G7 PolarHBondContact O-N 3.04Å; G7-L78 PolarHBondContact N-O 2.92Å
8	A	96.2	Very high	94.8	Very high	34 Å²	34	72 Å²	72	28%	0.281	45%	0.45	S	S	.	.			trans	-69.7	167.8	177.4	0	0	0	0	0	112.1	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.36Å; K5-A8 WeakPolarHBondContact O-CB 3.31Å; K5-A8 PolarHBondContact O-N 3.28Å; K5-A8 VanDerWaalsContact O-N 3.13Å; P6-A8 PolarHBondContact O-N 3.33Å; A8-S77 PolarHBondContact O-N 2.93Å; A8-L78 WeakPolarHBondContact O-CB 3.37Å; A8-L78 WeakPolarHBondContact O-CG 3.47Å; A8-L78 PolarHBondContact O-N 2.95Å
9	S	96.9	Very high	94.6	Very high	64 Å²	64	71.6 Å²	71.6	45%	0.448	44%	0.44	S	S	.	.			trans	-113.4	148.5	170	-57.2	0	0	0	0	110.3	L75 S76	S9-L75 CarbonylContact C-O 3.58Å; S9-L75 WeakPolarHBondContact CA-O 3.33Å; S9-L75 VanDerWaalsContact CB-O 3.29Å; S9-L75 WeakPolarHBondContact CB-O 3.49Å; S9-S76 WeakPolarHBondContact OG-CA 3.28Å
10	V	97.2	Very high	94.5	Very high	10 Å²	10	72.4 Å²	72.4	6%	0.061	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.9	173.4	74.4	0	0	0	0	109.8	E2 L12 Q74 L75 L78 V104	E2-V10 HydrophobicContact CB-CG2 4.07Å; E2-V10 HydrophobicContact CG-CG2 3.91Å; V10-L12 HydrophobicContact CG1-CD2 4.47Å; V10-L12 HydrophobicContact CG1-CG 4.42Å; V10-L12 HydrophobicContact CG2-CD2 4.12Å; V10-Q74 CarbonylContact O-C 3.56Å; V10-Q74 WeakPolarHBondContact O-CA 3.42Å; V10-L75 HydrophobicContact CG1-CB 4.14Å; V10-L75 HydrophobicContact CG1-CD1 4.18Å; V10-L75 PolarHBondContact N-O 2.94Å; V10-L75 PolarHBondContact O-N 2.82Å; V10-L78 HydrophobicContact CB-CD1 4.05Å; V10-L78 HydrophobicContact CG1-CD1 3.82Å; V10-V104 HydrophobicContact CG1-CG1 4.38Å; V10-V104 HydrophobicContact CG1-CG2 4.44Å
11	K	97.8	Very high	94.5	Very high	121 Å²	121	69.2 Å²	69.2	53%	0.526	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	111.6	174.6	-174.9	177.4	179.1	-180	0	109.3	Y72	K11-Y72 HydrophobicContact CD-CD1 4.38Å; K11-Y72 VanDerWaalsContact CE-CD1 3.43Å; K11-Y72 HydrophobicContact CG-CD1 4.3Å
12	L	97.9	Very high	95.1	Very high	6 Å²	6	66.6 Å²	66.6	3%	0.031	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	145.1	176.2	-56.6	-178	0	0	0	109.8	E2 V10 W28 Y72 M73 Y86 T102 V104	E2-L12 HydrophobicContact CG-CD2 4.35Å; V10-L12 HydrophobicContact CG1-CD2 4.47Å; V10-L12 HydrophobicContact CG1-CG 4.42Å; V10-L12 HydrophobicContact CG2-CD2 4.12Å; L12-W28 HydrophobicContact CB-CH2 4.06Å; L12-W28 HydrophobicContact CB-CZ3 3.92Å; L12-Y72 CarbonylContact O-C 3.57Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; L12-M73 HydrophobicContact CD1-CE 3.7Å; L12-M73 PolarHBondContact N-O 3.07Å; L12-M73 PolarHBondContact O-N 2.82Å; L12-Y86 VanDerWaalsContact CD1-CB 3.46Å; L12-Y86 HydrophobicContact CD1-CD1 4.4Å; L12-Y86 HydrophobicContact CD1-CD2 4.16Å; L12-Y86 HydrophobicContact CD1-CG 3.76Å; L12-T102 HydrophobicContact CD2-CG2 3.89Å; L12-V104 HydrophobicContact CD1-CG2 4.16Å; L12-V104 HydrophobicContact CD2-CG2 3.98Å
13	S	97.4	Very high	95.2	Very high	74 Å²	74	65.7 Å²	65.7	52%	0.517	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149	178.5	65.2	0	0	0	0	111.2	A71 Y72	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.32Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å
14	C	97.1	Very high	95.1	Very high	15 Å²	15	63.8 Å²	63.8	10%	0.101	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	105.8	173.9	-179.5	0	0	0	0	109	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.85Å; C14-W28 HydrophobicContact CB-CZ2 4Å; C14-T70 WeakPolarHBondContact O-CA 3.36Å; C14-A71 PolarHBondContact N-O 3.03Å; C14-A71 PolarHBondContact O-N 3.02Å; C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.31Å; C14-C88 WeakPolarHBondContact SG-CB 3.39Å; C14-C88 CovalentContact SG-SG 2.03Å; C14-C88 PolarHBondContact SG-SG 3.12Å
15	K	96.5	Very high	95.1	Very high	154 Å²	154	66.8 Å²	66.8	67%	0.67	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.8	-179.7	-172.5	175.4	-177	179.3	0	110	T70	K15-T70 HydrophobicContact CB-CG2 4.5Å
16	A	94	Very high	95.2	Very high	11 Å²	11	60.1 Å²	60.1	9%	0.091	37%	0.366	C	S	.	.			trans	-73.8	145.4	174.7	0	0	0	0	0	111.2	Y19 F21 S69	A16-Y19 HydrophobicContact CB-CE1 3.86Å; A16-Y19 HydrophobicContact CB-CE2 4.14Å; A16-Y19 VanDerWaalsContact CB-CZ 3.49Å; A16-Y19 VanDerWaalsContact CB-OH 3.29Å; A16-Y19 WeakPolarHBondContact CB-OH 3.49Å; A16-F21 HydrophobicContact CB-CB 3.9Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4.2Å; A16-F21 HydrophobicContact CB-CG 3.91Å; A16-S69 WeakPolarHBondContact CB-O 3.36Å; A16-S69 PolarHBondContact N-O 2.83Å
17	S	92.3	Very high	95.2	Very high	100 Å²	100	57.6 Å²	57.6	70%	0.699	35%	0.348	S	S	*	.			trans	-147.5	146	174	59	0	0	0	0	110.1	Y19	S17-Y19 WeakPolarHBondContact O-CD1 3.08Å; S17-Y19 PolarHBondContact O-N 3.08Å
18	G	91	Very high	95.3	Very high	91 Å²	91	55.3 Å²	55.3	94%	0.938	32%	0.323	S	S	*	.	S	Bend	trans	75.5	13.3	176.2	0	0	0	0	0	116.1
19	Y	90.3	Very high	95.4	Very high	64 Å²	64	54.1 Å²	54.1	25%	0.251	31%	0.312	S	S	.	.	S	Bend	trans	-158.9	165.3	173.3	66	-84.6	0	0	0	112	A16 S17 F21 Y24 K90	A16-Y19 HydrophobicContact CB-CE1 3.86Å; A16-Y19 HydrophobicContact CB-CE2 4.14Å; A16-Y19 VanDerWaalsContact CB-CZ 3.49Å; A16-Y19 VanDerWaalsContact CB-OH 3.29Å; A16-Y19 WeakPolarHBondContact CB-OH 3.49Å; S17-Y19 WeakPolarHBondContact O-CD1 3.08Å; S17-Y19 PolarHBondContact O-N 3.08Å; Y19-F21 PolarHBondContact O-N 3.21Å; Y19-F21 VanDerWaalsContact O-N 3.08Å; Y19-Y24 AromaticContact CD2-CD2 3.57Å; Y19-Y24 HydrophobicContact CD2-CD2 3.57Å; Y19-Y24 AromaticContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CD2-CE2 3.96Å; Y19-Y24 AromaticContact CE2-CD2 3.95Å; Y19-Y24 HydrophobicContact CE2-CD2 3.95Å; Y19-K90 HydrophobicContact CD1-CD 4.38Å; Y19-K90 VanDerWaalsContact CD1-NZ 3.34Å; Y19-K90 HydrophobicContact CD2-CD 3.94Å; Y19-K90 HydrophobicContact CE1-CD 4.07Å; Y19-K90 HydrophobicContact CE2-CD 3.59Å; Y19-K90 HydrophobicContact CG-CD 4.34Å
20	T	93.9	Very high	95.4	Very high	87 Å²	87	51.1 Å²	51.1	53%	0.534	29%	0.291	S	S	.	.			trans	-69.4	101.4	172.8	-52.7	0	0	0	0	110.4	T22 S23	T20-T22 PolarHBondContact O-N 3.11Å; T20-T22 VanDerWaalsContact O-N 3.14Å; T20-S23 WeakPolarHBondContact CB-OG 3.49Å; T20-S23 WeakPolarHBondContact CG2-OG 3.4Å; T20-S23 WeakPolarHBondContact O-CB 3.29Å; T20-S23 PolarHBondContact O-N 2.81Å
21	F	93.9	Very high	95.4	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.026	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-53.4	-36.7	-174.9	175.4	-125.7	0	0	0	113.7	A16 Y19 S23 M26 P45 V64 S69 A71	A16-F21 HydrophobicContact CB-CB 3.9Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4.2Å; A16-F21 HydrophobicContact CB-CG 3.91Å; Y19-F21 PolarHBondContact O-N 3.21Å; Y19-F21 VanDerWaalsContact O-N 3.08Å; F21-S23 PolarHBondContact O-N 2.92Å; F21-M26 HydrophobicContact CD2-CE 4.48Å; F21-M26 HydrophobicContact CE2-CE 3.93Å; F21-P45 HydrophobicContact CD1-CB 3.81Å; F21-P45 HydrophobicContact CD1-CG 4.33Å; F21-P45 HydrophobicContact CD2-CB 4.39Å; F21-P45 HydrophobicContact CD2-CG 4.02Å; F21-P45 HydrophobicContact CE1-CB 3.48Å; F21-P45 VanDerWaalsContact CE1-CB 3.48Å; F21-P45 HydrophobicContact CE1-CG 3.96Å; F21-P45 HydrophobicContact CE2-CB 4.09Å; F21-P45 HydrophobicContact CE2-CG 3.6Å; F21-P45 HydrophobicContact CG-CB 4.28Å; F21-P45 HydrophobicContact CG-CG 4.38Å; F21-P45 HydrophobicContact CZ-CB 3.63Å; F21-P45 HydrophobicContact CZ-CG 3.57Å; F21-P45 WeakPolarHBondContact O-CG 3.25Å; F21-V64 HydrophobicContact CE1-CB 4.42Å; F21-V64 HydrophobicContact CZ-CB 4.47Å; F21-V64 HydrophobicContact CZ-CG1 4.13Å; F21-S69 VanDerWaalsContact CD1-CA 3.46Å; F21-A71 HydrophobicContact CE2-CB 4.26Å; F21-A71 HydrophobicContact CZ-CB 3.97Å
22	T	95.3	Very high	95.3	Very high	48 Å²	48	50.6 Å²	50.6	29%	0.294	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-74	-9.4	-178	52.7	0	0	0	0	114.5	T20 N46	T20-T22 PolarHBondContact O-N 3.11Å; T20-T22 VanDerWaalsContact O-N 3.14Å; T22-N46 WeakPolarHBondContact O-CB 3.41Å
23	S	93.3	Very high	94.9	Very high	71 Å²	71	56 Å²	56	50%	0.497	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-89.6	-6.1	-177.1	-57.5	0	0	0	0	114.4	T20 F21	T20-S23 WeakPolarHBondContact CB-OG 3.49Å; T20-S23 WeakPolarHBondContact CG2-OG 3.4Å; T20-S23 WeakPolarHBondContact O-CB 3.29Å; T20-S23 PolarHBondContact O-N 2.81Å; F21-S23 PolarHBondContact O-N 2.92Å
24	Y	92.6	Very high	94.6	Very high	87 Å²	87	57 Å²	57	34%	0.341	35%	0.345	S	S	.	.	S	Bend	trans	-136.7	146.5	-172.7	-61.8	-86.6	0	0	0	112.7	Y19 P45 K90 T92	Y19-Y24 AromaticContact CD2-CD2 3.57Å; Y19-Y24 HydrophobicContact CD2-CD2 3.57Å; Y19-Y24 AromaticContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CD2-CE2 3.96Å; Y19-Y24 AromaticContact CE2-CD2 3.95Å; Y19-Y24 HydrophobicContact CE2-CD2 3.95Å; Y24-P45 WeakPolarHBondContact O-CD 3.33Å; Y24-P45 WeakPolarHBondContact O-CG 3.42Å; Y24-K90 HydrophobicContact CD1-CD 3.99Å; Y24-K90 HydrophobicContact CD1-CG 4.14Å; Y24-K90 HydrophobicContact CD2-CD 3.85Å; Y24-K90 HydrophobicContact CE2-CD 4.42Å; Y24-K90 HydrophobicContact CG-CD 3.6Å; Y24-K90 HydrophobicContact CG-CG 3.95Å; Y24-T92 HydrophobicContact CD1-CG2 4.14Å; Y24-T92 HydrophobicContact CE1-CG2 3.73Å
25	W	95.6	Very high	94.4	Very high	86 Å²	86	60.9 Å²	60.9	33%	0.326	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-66.8	135.6	168.7	-69	86.8	0	0	0	110.9	M42 I43 H44 S49	W25-M42 HydrophobicContact CD2-CE 4.37Å; W25-M42 HydrophobicContact CD2-CG 4.38Å; W25-M42 HydrophobicContact CD2-SD 4.13Å; W25-M42 HydrophobicContact CE3-CB 4.08Å; W25-M42 HydrophobicContact CE3-CE 4.07Å; W25-M42 HydrophobicContact CE3-CG 3.53Å; W25-M42 HydrophobicContact CE3-SD 3.84Å; W25-M42 HydrophobicContact CG-SD 4.44Å; W25-M42 HydrophobicContact CH2-CE 4.41Å; W25-M42 HydrophobicContact CZ3-CE 4.09Å; W25-M42 HydrophobicContact CZ3-CG 3.89Å; W25-M42 HydrophobicContact CZ3-SD 4.38Å; W25-I43 VanDerWaalsContact CE3-C 3.43Å; W25-H44 AromaticContact CD1-CD2 3.73Å; W25-H44 HydrophobicContact CD2-CB 3.7Å; W25-H44 AromaticContact CD2-CD2 3.87Å; W25-H44 AromaticContact CE2-CD2 3.64Å; W25-H44 AromaticContact CE2-CG 3.91Å; W25-H44 HydrophobicContact CE3-CB 3.61Å; W25-H44 AromaticContact CG-CD2 3.93Å; W25-H44 HydrophobicContact CH2-CB 3.61Å; W25-H44 HydrophobicContact CZ2-CB 3.68Å; W25-H44 HydrophobicContact CZ3-CB 3.58Å; W25-H44 AromaticContact NE1-CD2 3.51Å; W25-S49 VanDerWaalsContact CZ3-O 3.29Å; W25-S49 WeakPolarHBondContact CZ3-O 3.37Å
26	M	96.9	Very high	94.2	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.02	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.8	169.3	-174.1	63	70	0	0	109.1	F21 M42 I43 A71 C88	F21-M26 HydrophobicContact CD2-CE 4.48Å; F21-M26 HydrophobicContact CE2-CE 3.93Å; M26-M42 CarbonylContact O-C 3.52Å; M26-M42 WeakPolarHBondContact O-CA 3.03Å; M26-M42 WeakPolarHBondContact O-CB 3.43Å; M26-I43 HydrophobicContact CB-CG2 4.13Å; M26-I43 PolarHBondContact N-O 2.8Å; M26-I43 PolarHBondContact O-N 3.36Å; M26-A71 HydrophobicContact CB-CB 4.09Å; M26-A71 HydrophobicContact CG-CB 3.65Å; M26-C88 HydrophobicContact CG-CB 4.48Å; M26-C88 HydrophobicContact SD-CB 3.76Å
27	H	97.4	Very high	94.3	Very high	24 Å²	24	60.2 Å²	60.2	11%	0.111	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.7	178.3	-62.8	-104.6	0	0	0	110.3	W39 M42 C88 A89	H27-W39 AromaticContact ND1-NE1 3.36Å; H27-W39 PolarHBondContact ND1-NE1 3.38Å; H27-M42 PolarHBondContact CE1-SD 2.86Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 WeakPolarHBondContact O-CA 3.29Å; H27-A89 HydrophobicContact CB-CB 4.39Å; H27-A89 PolarHBondContact N-O 3.28Å; H27-A89 PolarHBondContact O-N 3.08Å
28	W	98.1	Very high	94.5	Very high	5 Å²	5	57.3 Å²	57.3	2%	0.019	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.2	172.5	-69.8	92.5	0	0	0	110.1	L12 C14 I40 G41 L62 A71 M73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 4.06Å; L12-W28 HydrophobicContact CB-CZ3 3.92Å; C14-W28 HydrophobicContact CB-CH2 3.85Å; C14-W28 HydrophobicContact CB-CZ2 4Å; W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.35Å; W28-I40 WeakPolarHBondContact O-CB 3.15Å; W28-I40 PolarHBondContact O-N 2.8Å; W28-G41 PolarHBondContact N-O 2.95Å; W28-L62 VanDerWaalsContact CD1-CD2 3.47Å; W28-L62 HydrophobicContact CG-CD2 4.04Å; W28-A71 HydrophobicContact CZ2-CB 4.36Å; W28-M73 HydrophobicContact CB-SD 3.86Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.3Å; W28-M73 HydrophobicContact CD2-CG 4.43Å; W28-M73 HydrophobicContact CD2-SD 4.08Å; W28-M73 HydrophobicContact CE3-CB 3.88Å; W28-M73 HydrophobicContact CE3-CE 3.74Å; W28-M73 HydrophobicContact CE3-SD 4.13Å; W28-M73 HydrophobicContact CG-CB 4.13Å; W28-M73 HydrophobicContact CG-SD 3.99Å; W28-M73 HydrophobicContact CH2-CB 4.09Å; W28-M73 HydrophobicContact CZ2-CB 3.86Å; W28-M73 HydrophobicContact CZ3-CB 4.1Å; W28-M73 HydrophobicContact CZ3-CE 4.26Å; W28-Y87 WeakPolarHBondContact CA-O 3.38Å; W28-C88 HydrophobicContact CD2-CB 4.47Å; W28-C88 HydrophobicContact CE3-CB 4.27Å; W28-C88 HydrophobicContact CH2-CB 4.38Å; W28-C88 HydrophobicContact CZ3-CB 4.23Å
29	V	97.9	Very high	94.8	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.055	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.6	-172	-177.3	0	0	0	0	109.3	L37 E38 Y86 Y87 W98	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.98Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; V29-E38 CarbonylContact C-O 3.49Å; V29-E38 WeakPolarHBondContact CA-O 3.43Å; V29-Y86 CarbonylContact O-C 3.6Å; V29-Y86 WeakPolarHBondContact O-CA 3.49Å; V29-Y87 PolarHBondContact N-O 3.47Å; V29-Y87 PolarHBondContact O-N 2.88Å; V29-W98 HydrophobicContact CB-CH2 4.19Å; V29-W98 HydrophobicContact CB-CZ3 3.82Å; V29-W98 HydrophobicContact CG1-CH2 4.11Å; V29-W98 HydrophobicContact CG1-CZ3 4.02Å; V29-W98 HydrophobicContact CG2-CH2 3.81Å; V29-W98 HydrophobicContact CG2-CZ3 3.8Å
30	K	97.3	Very high	95.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.5	175.1	-177.7	-179.7	-178.6	-179.3	0	109.5	R32 E38 I40 F56 E81 D82 A84 Y86	K30-R32 VanDerWaalsContact NZ-NH2 3.11Å; K30-E38 HydrophobicContact CB-CB 4.35Å; K30-E38 PolarHBondContact N-O 2.9Å; K30-E38 PolarHBondContact O-N 3.38Å; K30-I40 HydrophobicContact CB-CD1 4.01Å; K30-I40 HydrophobicContact CB-CG1 4.16Å; K30-F56 HydrophobicContact CD-CE1 3.96Å; K30-F56 HydrophobicContact CD-CZ 4.12Å; K30-E81 PolarHBondContact NZ-O 3.46Å; K30-D82 IonicContact NZ-OD1 3.87Å; K30-D82 PolarHBondContact NZ-OD1 2.8Å; K30-A84 HydrophobicContact CD-CB 4.2Å; K30-A84 HydrophobicContact CG-CB 3.55Å; K30-Y86 HydrophobicContact CB-CD1 4.13Å; K30-Y86 HydrophobicContact CB-CE1 3.9Å; K30-Y86 HydrophobicContact CD-CE1 3.99Å; K30-Y86 HydrophobicContact CG-CD1 4.3Å; K30-Y86 HydrophobicContact CG-CE1 3.77Å
31	Q	97.3	Very high	95.3	Very high	69 Å²	69	49.7 Å²	49.7	32%	0.322	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	114.6	170.3	-168.7	-179.6	29.7	0	0	110.1	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.85Å; Q31-L37 HydrophobicContact CG-CD2 3.94Å; Q31-A84 WeakPolarHBondContact O-CA 3.49Å; Q31-A84 VanDerWaalsContact O-CB 3.28Å; Q31-A84 WeakPolarHBondContact O-CB 3.44Å; Q31-V85 PolarHBondContact N-O 3.43Å; Q31-V85 PolarHBondContact O-N 2.81Å; Q31-Y87 HydrophobicContact CB-CD2 4.38Å; Q31-Y87 HydrophobicContact CB-CE2 3.83Å; Q31-Y87 PolarHBondContact OE1-OH 3.38Å
32	R	94.6	Very high	95.5	Very high	51 Å²	51	51.1 Å²	51.1	19%	0.192	29%	0.292	C	S	.	.			trans	-85.9	150.4	170.3	-62.6	-165.3	-170.7	93	-3	110.5	K30 G34 Q35 E38 E81 A84	K30-R32 VanDerWaalsContact NZ-NH2 3.11Å; R32-G34 PolarHBondContact O-N 2.84Å; R32-Q35 HydrophobicContact CB-CB 3.99Å; R32-Q35 HydrophobicContact CB-CG 4Å; R32-Q35 PolarHBondContact O-N 2.88Å; R32-E38 IonicContact CZ-OE2 2.8Å; R32-E38 IonicContact NH1-OE1 3.49Å; R32-E38 IonicContact NH1-OE2 3.46Å; R32-E38 PolarHBondContact NH1-OE2 2.83Å; R32-E38 IonicContact NH2-OE2 3.77Å; R32-E81 PolarHBondContact NE-O 2.81Å; R32-E81 PolarHBondContact NH2-O 3.12Å; R32-A84 HydrophobicContact CG-CB 4.24Å
33	P	90.1	Very high	95.6	Very high	119 Å²	119	49 Å²	49	77%	0.773	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	128.2	171.5	-24.8	34.2	0	0	0	111.2	Q35	P33-Q35 PolarHBondContact O-N 3.05Å
34	G	90.9	Very high	95.8	Very high	95 Å²	95	47.3 Å²	47.3	98%	0.979	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	5.1	-179.8	0	0	0	0	0	115.8	R32	R32-G34 PolarHBondContact O-N 2.84Å
35	Q	92.4	Very high	96	Very high	97 Å²	97	43.1 Å²	43.1	45%	0.453	25%	0.246	S	C	.	.	S	Bend	trans	-114.7	160.6	175.9	-57.3	-172.2	-1.3	0	0	111.7	R32 P33	R32-Q35 HydrophobicContact CB-CB 3.99Å; R32-Q35 HydrophobicContact CB-CG 4Å; R32-Q35 PolarHBondContact O-N 2.88Å; P33-Q35 PolarHBondContact O-N 3.05Å
36	G	93	Very high	96	Very high	55 Å²	55	43.4 Å²	43.4	57%	0.567	25%	0.254	S	S	*	.			trans	-67.7	175.9	172.7	0	0	0	0	0	113.2
37	L	95.3	Very high	96	Very high	97 Å²	97	47 Å²	47	51%	0.508	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.6	174.2	-63.9	175.2	0	0	0	110.3	V29 Q31 W98	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.98Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; Q31-L37 HydrophobicContact CB-CD2 3.85Å; Q31-L37 HydrophobicContact CG-CD2 3.94Å; L37-W98 HydrophobicContact CD1-CH2 3.85Å; L37-W98 HydrophobicContact CD1-CZ2 4.28Å; L37-W98 HydrophobicContact CD1-CZ3 4.49Å
38	E	96.8	Very high	95.9	Very high	38 Å²	38	47.6 Å²	47.6	18%	0.178	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.1	174.8	-63.2	-169.7	108.7	0	0	109.7	V29 K30 R32 I40 F56	V29-E38 CarbonylContact C-O 3.49Å; V29-E38 WeakPolarHBondContact CA-O 3.43Å; K30-E38 HydrophobicContact CB-CB 4.35Å; K30-E38 PolarHBondContact N-O 2.9Å; K30-E38 PolarHBondContact O-N 3.38Å; R32-E38 IonicContact CZ-OE2 2.8Å; R32-E38 IonicContact NH1-OE1 3.49Å; R32-E38 IonicContact NH1-OE2 3.46Å; R32-E38 PolarHBondContact NH1-OE2 2.83Å; R32-E38 IonicContact NH2-OE2 3.77Å; E38-I40 PolarHBondContact O-N 2.92Å; E38-F56 HydrophobicContact CB-CE2 4.4Å; E38-F56 HydrophobicContact CB-CZ 4.29Å
39	W	97.2	Very high	95.9	Very high	82 Å²	82	50.3 Å²	50.3	31%	0.311	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.9	175	-178.9	72	0	0	0	110.8	H27 G41 M42 N51 N53	H27-W39 AromaticContact ND1-NE1 3.36Å; H27-W39 PolarHBondContact ND1-NE1 3.38Å; W39-G41 PolarHBondContact NE1-O 2.77Å; W39-G41 VanDerWaalsContact NE1-O 3.09Å; W39-M42 HydrophobicContact CZ2-CB 4.02Å; W39-M42 HydrophobicContact CZ2-CG 3.82Å; W39-M42 HydrophobicContact CZ2-SD 4.15Å; W39-N51 HydrophobicContact CH2-CB 4.33Å; W39-N53 HydrophobicContact CE3-CB 3.85Å; W39-N53 HydrophobicContact CZ3-CB 4.05Å; W39-N53 WeakPolarHBondContact O-CB 3.3Å; W39-N53 PolarHBondContact O-ND2 2.83Å
40	I	98.1	Very high	95.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-48.3	-177.9	-59.7	174.7	0	0	0	110.4	W28 K30 E38 N53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.35Å; W28-I40 WeakPolarHBondContact O-CB 3.15Å; W28-I40 PolarHBondContact O-N 2.8Å; K30-I40 HydrophobicContact CB-CD1 4.01Å; K30-I40 HydrophobicContact CB-CG1 4.16Å; E38-I40 PolarHBondContact O-N 2.92Å; I40-N53 PolarHBondContact O-N 2.85Å; I40-F56 HydrophobicContact CB-CD2 4.34Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.23Å; I40-F56 HydrophobicContact CG1-CD2 4.3Å; I40-F56 HydrophobicContact CG1-CE1 4.26Å; I40-F56 HydrophobicContact CG1-CE2 4.31Å; I40-F56 HydrophobicContact CG1-CG 4.25Å; I40-F56 HydrophobicContact CG1-CZ 4.29Å; I40-F56 HydrophobicContact CG2-CB 3.69Å; I40-F56 HydrophobicContact CG2-CD1 4.24Å; I40-F56 HydrophobicContact CG2-CD2 4.4Å; I40-F56 HydrophobicContact CG2-CG 3.87Å; I40-A60 HydrophobicContact CG2-CB 3.71Å; I40-M73 HydrophobicContact CD1-CE 3.91Å; I40-M73 HydrophobicContact CD1-SD 3.61Å; I40-M73 HydrophobicContact CG2-SD 3.93Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.79Å
41	G	97.9	Very high	95.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-179.8	-172.1	0	0	0	0	0	112.3	W28 W39 N51	W28-G41 PolarHBondContact N-O 2.95Å; W39-G41 PolarHBondContact NE1-O 2.77Å; W39-G41 VanDerWaalsContact NE1-O 3.09Å; G41-N51 CarbonylContact C-O 3.43Å; G41-N51 WeakPolarHBondContact CA-O 3.4Å
42	M	97.6	Very high	96	Very high	37 Å²	37	55.4 Å²	55.4	18%	0.182	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.8	175	66.8	-172.8	-177.7	0	0	111.6	W25 M26 H27 W39 T50 N51	W25-M42 HydrophobicContact CD2-CE 4.37Å; W25-M42 HydrophobicContact CD2-CG 4.38Å; W25-M42 HydrophobicContact CD2-SD 4.13Å; W25-M42 HydrophobicContact CE3-CB 4.08Å; W25-M42 HydrophobicContact CE3-CE 4.07Å; W25-M42 HydrophobicContact CE3-CG 3.53Å; W25-M42 HydrophobicContact CE3-SD 3.84Å; W25-M42 HydrophobicContact CG-SD 4.44Å; W25-M42 HydrophobicContact CH2-CE 4.41Å; W25-M42 HydrophobicContact CZ3-CE 4.09Å; W25-M42 HydrophobicContact CZ3-CG 3.89Å; W25-M42 HydrophobicContact CZ3-SD 4.38Å; M26-M42 CarbonylContact O-C 3.52Å; M26-M42 WeakPolarHBondContact O-CA 3.03Å; M26-M42 WeakPolarHBondContact O-CB 3.43Å; H27-M42 PolarHBondContact CE1-SD 2.86Å; W39-M42 HydrophobicContact CZ2-CB 4.02Å; W39-M42 HydrophobicContact CZ2-CG 3.82Å; W39-M42 HydrophobicContact CZ2-SD 4.15Å; M42-T50 VanDerWaalsContact O-CA 3.3Å; M42-T50 WeakPolarHBondContact O-CA 3.4Å; M42-N51 HydrophobicContact CE-CB 3.88Å; M42-N51 HydrophobicContact CG-CB 4.17Å; M42-N51 PolarHBondContact N-O 3.13Å; M42-N51 PolarHBondContact O-N 3.5Å
43	I	98.1	Very high	96.1	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.1	175.1	-174.2	159.4	0	0	0	110.1	W25 M26 P45 S49 T50 L62 V64	W25-I43 VanDerWaalsContact CE3-C 3.43Å; M26-I43 HydrophobicContact CB-CG2 4.13Å; M26-I43 PolarHBondContact N-O 2.8Å; M26-I43 PolarHBondContact O-N 3.36Å; I43-P45 WeakPolarHBondContact O-CD 3.2Å; I43-S49 CarbonylContact C-O 3.58Å; I43-S49 WeakPolarHBondContact CA-O 3.18Å; I43-T50 HydrophobicContact CB-CG2 3.97Å; I43-T50 HydrophobicContact CD1-CG2 3.67Å; I43-T50 HydrophobicContact CG1-CG2 3.75Å; I43-L62 HydrophobicContact CB-CB 4.06Å; I43-L62 HydrophobicContact CB-CD1 4.29Å; I43-L62 HydrophobicContact CD1-CB 4.09Å; I43-L62 HydrophobicContact CG2-CB 4.31Å; I43-V64 HydrophobicContact CD1-CG1 3.79Å; I43-V64 HydrophobicContact CD1-CG2 4.41Å; I43-V64 HydrophobicContact CG1-CG1 3.93Å; I43-V64 HydrophobicContact CG2-CG1 3.83Å
44	H	97.1	Very high	96.4	Very high	34 Å²	34	55.9 Å²	55.9	16%	0.157	34%	0.336	C	S	.	.			trans	-89.8	112.1	173.2	-168.3	-111.8	0	0	0	109.5	W25 N46 S47 G48 S49	W25-H44 AromaticContact CD1-CD2 3.73Å; W25-H44 HydrophobicContact CD2-CB 3.7Å; W25-H44 AromaticContact CD2-CD2 3.87Å; W25-H44 AromaticContact CE2-CD2 3.64Å; W25-H44 AromaticContact CE2-CG 3.91Å; W25-H44 HydrophobicContact CE3-CB 3.61Å; W25-H44 AromaticContact CG-CD2 3.93Å; W25-H44 HydrophobicContact CH2-CB 3.61Å; W25-H44 HydrophobicContact CZ2-CB 3.68Å; W25-H44 HydrophobicContact CZ3-CB 3.58Å; W25-H44 AromaticContact NE1-CD2 3.51Å; H44-N46 PolarHBondContact O-N 2.76Å; H44-N46 VanDerWaalsContact O-N 3.16Å; H44-S47 WeakPolarHBondContact CB-OG 3.43Å; H44-S47 PolarHBondContact ND1-N 3.45Å; H44-S47 PolarHBondContact ND1-OG 2.54Å; H44-S47 PolarHBondContact O-N 2.88Å; H44-G48 WeakPolarHBondContact O-CA 3.19Å; H44-G48 PolarHBondContact O-N 3.26Å; H44-S49 PolarHBondContact N-O 2.82Å
45	P	96.4	Very high	96.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.3	-169.9	-22.1	34.4	0	0	0	114.3	F21 Y24 I43 V64 K66	F21-P45 HydrophobicContact CD1-CB 3.81Å; F21-P45 HydrophobicContact CD1-CG 4.33Å; F21-P45 HydrophobicContact CD2-CB 4.39Å; F21-P45 HydrophobicContact CD2-CG 4.02Å; F21-P45 HydrophobicContact CE1-CB 3.48Å; F21-P45 VanDerWaalsContact CE1-CB 3.48Å; F21-P45 HydrophobicContact CE1-CG 3.96Å; F21-P45 HydrophobicContact CE2-CB 4.09Å; F21-P45 HydrophobicContact CE2-CG 3.6Å; F21-P45 HydrophobicContact CG-CB 4.28Å; F21-P45 HydrophobicContact CG-CG 4.38Å; F21-P45 HydrophobicContact CZ-CB 3.63Å; F21-P45 HydrophobicContact CZ-CG 3.57Å; F21-P45 WeakPolarHBondContact O-CG 3.25Å; Y24-P45 WeakPolarHBondContact O-CD 3.33Å; Y24-P45 WeakPolarHBondContact O-CG 3.42Å; I43-P45 WeakPolarHBondContact O-CD 3.2Å; P45-V64 HydrophobicContact CB-CB 4.47Å; P45-V64 HydrophobicContact CB-CG1 4.06Å; P45-V64 HydrophobicContact CG-CG1 4.3Å; P45-K66 WeakPolarHBondContact O-CE 3.23Å
46	N	96.2	Very high	96.7	Very high	91 Å²	91	54.3 Å²	54.3	49%	0.487	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-51.7	175.9	-169.5	27.3	0	0	0	112.6	T22 H44 K66	T22-N46 WeakPolarHBondContact O-CB 3.41Å; H44-N46 PolarHBondContact O-N 2.76Å; H44-N46 VanDerWaalsContact O-N 3.16Å; N46-K66 WeakPolarHBondContact O-CE 3.26Å; N46-K66 PolarHBondContact O-NZ 3.24Å
47	S	96.6	Very high	96.7	Very high	79 Å²	79	57.1 Å²	57.1	55%	0.552	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.8	-172.4	54	0	0	0	0	113.6	H44 S49	H44-S47 WeakPolarHBondContact CB-OG 3.43Å; H44-S47 PolarHBondContact ND1-N 3.45Å; H44-S47 PolarHBondContact ND1-OG 2.54Å; H44-S47 PolarHBondContact O-N 2.88Å; S47-S49 PolarHBondContact O-N 2.95Å
48	G	95.9	Very high	96.7	Very high	38 Å²	38	58 Å²	58	39%	0.392	31%	0.312	S	S	.	.			trans	70.5	5.5	-171.3	0	0	0	0	0	113.6	H44 T50	H44-G48 WeakPolarHBondContact O-CA 3.19Å; H44-G48 PolarHBondContact O-N 3.26Å; G48-T50 PolarHBondContact O-N 3.14Å
49	S	97.6	Very high	96.7	Very high	61 Å²	61	58 Å²	58	43%	0.427	31%	0.311	S	S	.	.			trans	-62	135.9	177.4	-177.8	0	0	0	0	110	W25 I43 H44 S47	W25-S49 VanDerWaalsContact CZ3-O 3.29Å; W25-S49 WeakPolarHBondContact CZ3-O 3.37Å; I43-S49 CarbonylContact C-O 3.58Å; I43-S49 WeakPolarHBondContact CA-O 3.18Å; H44-S49 PolarHBondContact N-O 2.82Å; S47-S49 PolarHBondContact O-N 2.95Å
50	T	98	Very high	96.7	Very high	58 Å²	58	54.3 Å²	54.3	36%	0.356	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.4	-179.3	52	0	0	0	0	110.8	M42 I43 G48 Y52 L62	M42-T50 VanDerWaalsContact O-CA 3.3Å; M42-T50 WeakPolarHBondContact O-CA 3.4Å; I43-T50 HydrophobicContact CB-CG2 3.97Å; I43-T50 HydrophobicContact CD1-CG2 3.67Å; I43-T50 HydrophobicContact CG1-CG2 3.75Å; G48-T50 PolarHBondContact O-N 3.14Å; T50-Y52 HydrophobicContact CG2-CE2 4.38Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.29Å; T50-L62 HydrophobicContact CG2-CB 4.09Å
51	N	97.7	Very high	96.7	Very high	84 Å²	84	57.7 Å²	57.7	45%	0.449	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.7	166	-168.1	16	0	0	0	108.8	W39 G41 M42	W39-N51 HydrophobicContact CH2-CB 4.33Å; G41-N51 CarbonylContact C-O 3.43Å; G41-N51 WeakPolarHBondContact CA-O 3.4Å; M42-N51 HydrophobicContact CE-CB 3.88Å; M42-N51 HydrophobicContact CG-CB 4.17Å; M42-N51 PolarHBondContact N-O 3.13Å; M42-N51 PolarHBondContact O-N 3.5Å
52	Y	98.1	Very high	96.7	Very high	43 Å²	43	58.1 Å²	58.1	17%	0.169	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151	-174.1	-66.8	-89.7	0	0	0	110.5	T50 K57 A60 L62	T50-Y52 HydrophobicContact CG2-CE2 4.38Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.29Å; Y52-K57 HydrophobicContact CG-CG 4.43Å; Y52-A60 HydrophobicContact CE1-CB 4.32Å; Y52-A60 WeakPolarHBondContact CE1-O 3.34Å; Y52-L62 HydrophobicContact CE1-CD1 3.96Å; Y52-L62 HydrophobicContact CE1-CG 3.66Å; Y52-L62 PolarHBondContact OH-N 2.9Å
53	N	97.1	Very high	96.7	Very high	48 Å²	48	59.3 Å²	59.3	26%	0.257	33%	0.33	S	S	.	.			trans	-73.5	131.7	155.5	-179.6	-23.2	0	0	0	108.2	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.85Å; W39-N53 HydrophobicContact CZ3-CB 4.05Å; W39-N53 WeakPolarHBondContact O-CB 3.3Å; W39-N53 PolarHBondContact O-ND2 2.83Å; I40-N53 PolarHBondContact O-N 2.85Å; N53-K55 PolarHBondContact O-N 3.07Å; N53-K55 PolarHBondContact OD1-N 2.83Å; N53-K55 VanDerWaalsContact OD1-N 3.14Å; N53-F56 HydrophobicContact CB-CD2 4.03Å; N53-F56 PolarHBondContact O-N 2.83Å; N53-K57 PolarHBondContact O-N 3.29Å
54	E	95.9	Very high	96.7	Very high	132 Å²	132	61 Å²	61	62%	0.617	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.1	-176.9	-68.9	-61.4	148	0	0	112.8	F56 K57	E54-F56 PolarHBondContact O-N 2.95Å; E54-K57 PolarHBondContact O-N 3.36Å; E54-K57 IonicContact OE1-NZ 2.83Å; E54-K57 PolarHBondContact OE1-NZ 2.86Å; E54-K57 VanDerWaalsContact OE2-CD 3.23Å; E54-K57 WeakPolarHBondContact OE2-CD 3.11Å; E54-K57 IonicContact OE2-NZ 3.31Å; E54-K57 PolarHBondContact OE2-NZ 2.88Å
55	K	93.9	Very high	96.7	Very high	150 Å²	150	61.8 Å²	61.8	65%	0.652	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.4	175.3	-67.7	-174.3	-179.5	-177.9	0	114.3	N53	N53-K55 PolarHBondContact O-N 3.07Å; N53-K55 PolarHBondContact OD1-N 2.83Å; N53-K55 VanDerWaalsContact OD1-N 3.14Å
56	F	95.8	Very high	96.6	Very high	10 Å²	10	67 Å²	67	4%	0.044	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-5.8	-172.9	-62	-83.4	0	0	0	113.5	K30 E38 I40 N53 E54 S58 K59 A60	K30-F56 HydrophobicContact CD-CE1 3.96Å; K30-F56 HydrophobicContact CD-CZ 4.12Å; E38-F56 HydrophobicContact CB-CE2 4.4Å; E38-F56 HydrophobicContact CB-CZ 4.29Å; I40-F56 HydrophobicContact CB-CD2 4.34Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.23Å; I40-F56 HydrophobicContact CG1-CD2 4.3Å; I40-F56 HydrophobicContact CG1-CE1 4.26Å; I40-F56 HydrophobicContact CG1-CE2 4.31Å; I40-F56 HydrophobicContact CG1-CG 4.25Å; I40-F56 HydrophobicContact CG1-CZ 4.29Å; I40-F56 HydrophobicContact CG2-CB 3.69Å; I40-F56 HydrophobicContact CG2-CD1 4.24Å; I40-F56 HydrophobicContact CG2-CD2 4.4Å; I40-F56 HydrophobicContact CG2-CG 3.87Å; N53-F56 HydrophobicContact CB-CD2 4.03Å; N53-F56 PolarHBondContact O-N 2.83Å; E54-F56 PolarHBondContact O-N 2.95Å; F56-S58 VanDerWaalsContact C-N 3.27Å; F56-S58 PolarHBondContact O-N 3.37Å; F56-K59 PolarHBondContact O-N 2.99Å; F56-A60 HydrophobicContact CB-CB 4.39Å; F56-A60 PolarHBondContact O-N 3.09Å
57	K	94.1	Very high	96.6	Very high	114 Å²	114	67.9 Å²	67.9	50%	0.496	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.2	-172.6	-169.2	175.6	-173.2	175.6	0	114.1	Y52 N53 E54	Y52-K57 HydrophobicContact CG-CG 4.43Å; N53-K57 PolarHBondContact O-N 3.29Å; E54-K57 PolarHBondContact O-N 3.36Å; E54-K57 IonicContact OE1-NZ 2.83Å; E54-K57 PolarHBondContact OE1-NZ 2.86Å; E54-K57 VanDerWaalsContact OE2-CD 3.23Å; E54-K57 WeakPolarHBondContact OE2-CD 3.11Å; E54-K57 IonicContact OE2-NZ 3.31Å; E54-K57 PolarHBondContact OE2-NZ 2.88Å
58	S	94.8	Very high	96.5	Very high	115 Å²	115	65.9 Å²	65.9	80%	0.804	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10.5	175.4	57.3	0	0	0	0	113.8	F56	F56-S58 VanDerWaalsContact C-N 3.27Å; F56-S58 PolarHBondContact O-N 3.37Å
59	K	95.8	Very high	96.6	Very high	39 Å²	39	66.1 Å²	66.1	17%	0.17	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-31.7	-167.2	-162.8	166.9	-165.8	169.9	0	113.8	F56 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.99Å; K59-L75 WeakPolarHBondContact O-CA 3.46Å; K59-S76 WeakPolarHBondContact CE-O 3.41Å; K59-S76 WeakPolarHBondContact CG-O 3.44Å; K59-S76 PolarHBondContact O-N 2.86Å; K59-S76 PolarHBondContact O-OG 2.86Å; K59-D82 WeakPolarHBondContact CE-OD1 3.43Å; K59-D82 WeakPolarHBondContact CE-OD2 3.39Å; K59-D82 IonicContact NZ-OD1 2.88Å; K59-D82 PolarHBondContact NZ-OD1 2.99Å; K59-D82 IonicContact NZ-OD2 2.54Å; K59-D82 PolarHBondContact NZ-OD2 3.42Å
60	A	97.8	Very high	96.6	Very high	3 Å²	3	63.6 Å²	63.6	3%	0.025	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.3	-177.9	0	0	0	0	0	110.7	I40 Y52 F56 M73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.71Å; Y52-A60 HydrophobicContact CE1-CB 4.32Å; Y52-A60 WeakPolarHBondContact CE1-O 3.34Å; F56-A60 HydrophobicContact CB-CB 4.39Å; F56-A60 PolarHBondContact O-N 3.09Å; A60-M73 HydrophobicContact CB-CG 4.35Å; A60-M73 HydrophobicContact CB-SD 4.36Å; A60-Q74 CarbonylContact C-O 3.56Å; A60-Q74 WeakPolarHBondContact CA-O 3.38Å; A60-L75 HydrophobicContact CB-CD2 3.95Å
61	T	98.3	Very high	96.6	Very high	72 Å²	72	60.8 Å²	60.8	44%	0.442	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.9	169.6	-58.5	0	0	0	0	109	T63 M73 Q74	T61-T63 HydrophobicContact CG2-CG2 4.31Å; T61-M73 WeakPolarHBondContact O-CA 3.19Å; T61-Q74 PolarHBondContact N-O 2.88Å; T61-Q74 PolarHBondContact O-N 2.91Å
62	L	98.5	Very high	96.6	Very high	9 Å²	9	59.2 Å²	59.2	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.3	178.2	-53	-176	0	0	0	110.7	W28 I43 T50 Y52 Y72 M73	W28-L62 VanDerWaalsContact CD1-CD2 3.47Å; W28-L62 HydrophobicContact CG-CD2 4.04Å; I43-L62 HydrophobicContact CB-CB 4.06Å; I43-L62 HydrophobicContact CB-CD1 4.29Å; I43-L62 HydrophobicContact CD1-CB 4.09Å; I43-L62 HydrophobicContact CG2-CB 4.31Å; T50-L62 HydrophobicContact CG2-CB 4.09Å; Y52-L62 HydrophobicContact CE1-CD1 3.96Å; Y52-L62 HydrophobicContact CE1-CG 3.66Å; Y52-L62 PolarHBondContact OH-N 2.9Å; L62-Y72 WeakPolarHBondContact CA-O 3.45Å; L62-M73 HydrophobicContact CD2-CB 3.7Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.22Å
63	T	98.2	Very high	96.6	Very high	61 Å²	61	57.1 Å²	57.1	37%	0.374	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	164.1	175.9	57.4	0	0	0	0	110.8	T61 Y72	T61-T63 HydrophobicContact CG2-CG2 4.31Å; T63-Y72 PolarHBondContact N-O 2.81Å; T63-Y72 PolarHBondContact O-N 2.96Å
64	V	97.8	Very high	96.7	Very high	40 Å²	40	59 Å²	59	24%	0.242	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.8	176.9	-67.2	0	0	0	0	110.9	F21 I43 P45 A71	F21-V64 HydrophobicContact CE1-CB 4.42Å; F21-V64 HydrophobicContact CZ-CB 4.47Å; F21-V64 HydrophobicContact CZ-CG1 4.13Å; I43-V64 HydrophobicContact CD1-CG1 3.79Å; I43-V64 HydrophobicContact CD1-CG2 4.41Å; I43-V64 HydrophobicContact CG1-CG1 3.93Å; I43-V64 HydrophobicContact CG2-CG1 3.83Å; P45-V64 HydrophobicContact CB-CB 4.47Å; P45-V64 HydrophobicContact CB-CG1 4.06Å; P45-V64 HydrophobicContact CG-CG1 4.3Å; V64-A71 HydrophobicContact CG1-CB 4.21Å
65	D	96.9	Very high	96.8	Very high	51 Å²	51	52.8 Å²	52.8	27%	0.273	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.1	164.7	174.9	8.3	0	0	0	108.5	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 PolarHBondContact O-N 2.83Å; D65-S67 WeakPolarHBondContact OD1-CB 3.07Å; D65-S67 PolarHBondContact OD1-N 3.27Å; D65-S67 PolarHBondContact OD1-OG 2.98Å; D65-S67 PolarHBondContact OD2-OG 3.06Å; D65-S68 PolarHBondContact OD1-N 2.89Å; D65-S68 VanDerWaalsContact OD2-CB 3.31Å; D65-S68 WeakPolarHBondContact OD2-CB 3.01Å; D65-S68 PolarHBondContact OD2-OG 2.91Å; D65-S69 PolarHBondContact O-N 3.23Å; D65-S69 VanDerWaalsContact O-N 3.14Å; D65-T70 PolarHBondContact N-O 2.03Å; D65-T70 PolarHBondContact O-N 3.31Å; D65-Y72 HydrophobicContact CB-CE2 3.85Å
66	K	94.8	Very high	96.9	Very high	110 Å²	110	47.2 Å²	47.2	48%	0.478	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.8	-179.2	-65.3	177.2	177.1	179.3	0	111.8	P45 N46 S69	P45-K66 WeakPolarHBondContact O-CE 3.23Å; N46-K66 WeakPolarHBondContact O-CE 3.26Å; N46-K66 PolarHBondContact O-NZ 3.24Å; K66-S69 PolarHBondContact O-N 3.19Å
67	S	94.4	Very high	96.9	Very high	108 Å²	108	50.6 Å²	50.6	76%	0.755	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-40.7	-174.9	72	0	0	0	0	111.6	D65	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 PolarHBondContact O-N 2.83Å; D65-S67 WeakPolarHBondContact OD1-CB 3.07Å; D65-S67 PolarHBondContact OD1-N 3.27Å; D65-S67 PolarHBondContact OD1-OG 2.98Å; D65-S67 PolarHBondContact OD2-OG 3.06Å
68	S	96.3	Very high	97	Very high	37 Å²	37	45.2 Å²	45.2	26%	0.259	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-0.5	177	66.3	0	0	0	0	113.8	D65 T70	D65-S68 PolarHBondContact OD1-N 2.89Å; D65-S68 VanDerWaalsContact OD2-CB 3.31Å; D65-S68 WeakPolarHBondContact OD2-CB 3.01Å; D65-S68 PolarHBondContact OD2-OG 2.91Å; S68-T70 VanDerWaalsContact C-N 3.27Å; S68-T70 PolarHBondContact O-N 2.89Å; S68-T70 PolarHBondContact O-OG1 3.48Å; S68-T70 VanDerWaalsContact O-OG1 3.12Å; S68-T70 WeakPolarHBondContact OG-CB 2.98Å; S68-T70 PolarHBondContact OG-OG1 2.8Å; S68-T70 VanDerWaalsContact OG-OG1 3.08Å
69	S	96.7	Very high	97.1	Very high	43 Å²	43	42.4 Å²	42.4	30%	0.301	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	43.5	-172.6	-64.6	0	0	0	0	113.1	A16 F21 D65 K66	A16-S69 WeakPolarHBondContact CB-O 3.36Å; A16-S69 PolarHBondContact N-O 2.83Å; F21-S69 VanDerWaalsContact CD1-CA 3.46Å; D65-S69 PolarHBondContact O-N 3.23Å; D65-S69 VanDerWaalsContact O-N 3.14Å; K66-S69 PolarHBondContact O-N 3.19Å
70	T	97.8	Very high	97	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.049	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.9	-173.8	-52.9	0	0	0	0	110.9	C14 K15 D65 S68 Y72	C14-T70 WeakPolarHBondContact O-CA 3.36Å; K15-T70 HydrophobicContact CB-CG2 4.5Å; D65-T70 PolarHBondContact N-O 2.03Å; D65-T70 PolarHBondContact O-N 3.31Å; S68-T70 VanDerWaalsContact C-N 3.27Å; S68-T70 PolarHBondContact O-N 2.89Å; S68-T70 PolarHBondContact O-OG1 3.48Å; S68-T70 VanDerWaalsContact O-OG1 3.12Å; S68-T70 WeakPolarHBondContact OG-CB 2.98Å; S68-T70 PolarHBondContact OG-OG1 2.8Å; S68-T70 VanDerWaalsContact OG-OG1 3.08Å; T70-Y72 HydrophobicContact CG2-CD1 4.29Å; T70-Y72 HydrophobicContact CG2-CD2 4.36Å; T70-Y72 HydrophobicContact CG2-CE1 3.7Å; T70-Y72 HydrophobicContact CG2-CE2 3.76Å
71	A	97.9	Very high	96.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	148.6	166.8	0	0	0	0	0	110	S13 C14 F21 M26 W28 V64	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.32Å; C14-A71 PolarHBondContact N-O 3.03Å; C14-A71 PolarHBondContact O-N 3.02Å; F21-A71 HydrophobicContact CE2-CB 4.26Å; F21-A71 HydrophobicContact CZ-CB 3.97Å; M26-A71 HydrophobicContact CB-CB 4.09Å; M26-A71 HydrophobicContact CG-CB 3.65Å; W28-A71 HydrophobicContact CZ2-CB 4.36Å; V64-A71 HydrophobicContact CG1-CB 4.21Å
72	Y	98.3	Very high	96.7	Very high	50 Å²	50	47.6 Å²	47.6	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147	177.6	-57.1	-87.8	0	0	0	111.2	K11 L12 S13 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.38Å; K11-Y72 VanDerWaalsContact CE-CD1 3.43Å; K11-Y72 HydrophobicContact CG-CD1 4.3Å; L12-Y72 CarbonylContact O-C 3.57Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å; L62-Y72 WeakPolarHBondContact CA-O 3.45Å; T63-Y72 PolarHBondContact N-O 2.81Å; T63-Y72 PolarHBondContact O-N 2.96Å; D65-Y72 HydrophobicContact CB-CE2 3.85Å; T70-Y72 HydrophobicContact CG2-CD1 4.29Å; T70-Y72 HydrophobicContact CG2-CD2 4.36Å; T70-Y72 HydrophobicContact CG2-CE1 3.7Å; T70-Y72 HydrophobicContact CG2-CE2 3.76Å
73	M	98.3	Very high	96.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.5	166.6	177	178.3	69.1	0	0	108.5	L12 W28 I40 A60 T61 L62 L75 Y86	L12-M73 HydrophobicContact CD1-CE 3.7Å; L12-M73 PolarHBondContact N-O 3.07Å; L12-M73 PolarHBondContact O-N 2.82Å; W28-M73 HydrophobicContact CB-SD 3.86Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.3Å; W28-M73 HydrophobicContact CD2-CG 4.43Å; W28-M73 HydrophobicContact CD2-SD 4.08Å; W28-M73 HydrophobicContact CE3-CB 3.88Å; W28-M73 HydrophobicContact CE3-CE 3.74Å; W28-M73 HydrophobicContact CE3-SD 4.13Å; W28-M73 HydrophobicContact CG-CB 4.13Å; W28-M73 HydrophobicContact CG-SD 3.99Å; W28-M73 HydrophobicContact CH2-CB 4.09Å; W28-M73 HydrophobicContact CZ2-CB 3.86Å; W28-M73 HydrophobicContact CZ3-CB 4.1Å; W28-M73 HydrophobicContact CZ3-CE 4.26Å; I40-M73 HydrophobicContact CD1-CE 3.91Å; I40-M73 HydrophobicContact CD1-SD 3.61Å; I40-M73 HydrophobicContact CG2-SD 3.93Å; A60-M73 HydrophobicContact CB-CG 4.35Å; A60-M73 HydrophobicContact CB-SD 4.36Å; T61-M73 WeakPolarHBondContact O-CA 3.19Å; L62-M73 HydrophobicContact CD2-CB 3.7Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.22Å; M73-L75 HydrophobicContact CE-CD1 3.88Å; M73-L75 HydrophobicContact CE-CD2 4.2Å; M73-L75 HydrophobicContact CE-CG 3.99Å; M73-L75 HydrophobicContact CG-CD2 4.36Å; M73-L75 HydrophobicContact CG-CG 4.34Å; M73-L75 HydrophobicContact SD-CD2 4.06Å; M73-L75 HydrophobicContact SD-CG 4.37Å; M73-Y86 HydrophobicContact CE-CD1 3.61Å; M73-Y86 HydrophobicContact CE-CE1 4.16Å; M73-Y86 HydrophobicContact CE-CG 4.24Å
74	Q	98.2	Very high	96.6	Very high	87 Å²	87	46 Å²	46	41%	0.407	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.9	170	-177.3	172.4	-4	0	0	108.9	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.56Å; V10-Q74 WeakPolarHBondContact O-CA 3.42Å; A60-Q74 CarbonylContact C-O 3.56Å; A60-Q74 WeakPolarHBondContact CA-O 3.38Å; T61-Q74 PolarHBondContact N-O 2.88Å; T61-Q74 PolarHBondContact O-N 2.91Å
75	L	97.6	Very high	96.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.5	171.4	-63.1	165.8	0	0	0	108.5	S9 V10 K59 A60 M73 L78 Y86	S9-L75 CarbonylContact C-O 3.58Å; S9-L75 WeakPolarHBondContact CA-O 3.33Å; S9-L75 VanDerWaalsContact CB-O 3.29Å; S9-L75 WeakPolarHBondContact CB-O 3.49Å; V10-L75 HydrophobicContact CG1-CB 4.14Å; V10-L75 HydrophobicContact CG1-CD1 4.18Å; V10-L75 PolarHBondContact N-O 2.94Å; V10-L75 PolarHBondContact O-N 2.82Å; K59-L75 WeakPolarHBondContact O-CA 3.46Å; A60-L75 HydrophobicContact CB-CD2 3.95Å; M73-L75 HydrophobicContact CE-CD1 3.88Å; M73-L75 HydrophobicContact CE-CD2 4.2Å; M73-L75 HydrophobicContact CE-CG 3.99Å; M73-L75 HydrophobicContact CG-CD2 4.36Å; M73-L75 HydrophobicContact CG-CG 4.34Å; M73-L75 HydrophobicContact SD-CD2 4.06Å; M73-L75 HydrophobicContact SD-CG 4.37Å; L75-L78 HydrophobicContact CB-CD2 3.73Å; L75-L78 HydrophobicContact CB-CG 4.49Å; L75-L78 HydrophobicContact CD1-CD2 4.27Å; L75-Y86 HydrophobicContact CD1-CD1 4.14Å; L75-Y86 HydrophobicContact CD1-CE1 3.53Å; L75-Y86 HydrophobicContact CD1-CE2 4.13Å
76	S	97	Very high	96.6	Very high	34 Å²	34	43.6 Å²	43.6	24%	0.238	25%	0.254	C	S	.	.			trans	-104.9	159.1	178.2	55.2	0	0	0	0	112.1	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.28Å; K59-S76 WeakPolarHBondContact CE-O 3.41Å; K59-S76 WeakPolarHBondContact CG-O 3.44Å; K59-S76 PolarHBondContact O-N 2.86Å; K59-S76 PolarHBondContact O-OG 2.86Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 3.35Å
77	S	96	Very high	96.8	Very high	80 Å²	80	40.7 Å²	40.7	56%	0.559	24%	0.241	S	C	*	.	S	Bend	trans	49.6	52.6	171	-57.7	0	0	0	0	112.9	A8	A8-S77 PolarHBondContact O-N 2.93Å
78	L	96.4	Very high	96.9	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	21%	0.209	C	C	.	.			trans	-64.6	140.6	-173.9	-70.3	173.6	0	0	0	112.4	V4 P6 G7 A8 V10 L75 S76 D82 V106	V4-L78 HydrophobicContact CG2-CD1 3.56Å; P6-L78 CarbonylContact C-O 3.39Å; P6-L78 WeakPolarHBondContact CA-O 3.3Å; G7-L78 PolarHBondContact N-O 2.92Å; A8-L78 WeakPolarHBondContact O-CB 3.37Å; A8-L78 WeakPolarHBondContact O-CG 3.47Å; A8-L78 PolarHBondContact O-N 2.95Å; V10-L78 HydrophobicContact CB-CD1 4.05Å; V10-L78 HydrophobicContact CG1-CD1 3.82Å; L75-L78 HydrophobicContact CB-CD2 3.73Å; L75-L78 HydrophobicContact CB-CG 4.49Å; L75-L78 HydrophobicContact CD1-CD2 4.27Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 3.35Å; L78-D82 VanDerWaalsContact CA-OD2 3.3Å; L78-D82 WeakPolarHBondContact CA-OD2 3.14Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; L78-D82 WeakPolarHBondContact CD2-OD2 3.21Å; L78-V106 HydrophobicContact CB-CG1 4.23Å; L78-V106 HydrophobicContact CB-CG2 3.98Å; L78-V106 HydrophobicContact CD1-CG2 4.37Å
79	T	95.8	Very high	96.9	Very high	57 Å²	57	34.7 Å²	34.7	35%	0.35	20%	0.199	S	C	.	.			trans	-120.2	168.2	174.8	65.8	0	0	0	0	109.8	E81 D82 V106	T79-E81 PolarHBondContact O-N 2.83Å; T79-E81 VanDerWaalsContact O-N 3.11Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.18Å; T79-D82 PolarHBondContact O-N 2.9Å; T79-D82 PolarHBondContact OG1-OD2 3.03Å; T79-V106 WeakPolarHBondContact O-CB 3.29Å; T79-V106 WeakPolarHBondContact O-CG2 3.49Å
80	S	94.4	Very high	96.8	Very high	85 Å²	85	33.6 Å²	33.6	59%	0.594	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-53.4	-33	176.5	51.1	0	0	0	0	112.7	D82 S83	S80-D82 PolarHBondContact O-N 2.84Å; S80-S83 WeakPolarHBondContact O-CB 2.89Å; S80-S83 PolarHBondContact O-N 2.87Å; S80-S83 VanDerWaalsContact O-N 3.08Å; S80-S83 PolarHBondContact O-OG 2.89Å
81	E	93	Very high	96.2	Very high	132 Å²	132	37.6 Å²	37.6	62%	0.617	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-67.2	-12.4	177.1	-60.1	-175.3	174.2	0	0	114.6	K30 R32 T79 S83	K30-E81 PolarHBondContact NZ-O 3.46Å; R32-E81 PolarHBondContact NE-O 2.81Å; R32-E81 PolarHBondContact NH2-O 3.12Å; T79-E81 PolarHBondContact O-N 2.83Å; T79-E81 VanDerWaalsContact O-N 3.11Å; E81-S83 VanDerWaalsContact C-N 3.33Å
82	D	95.5	Very high	95.5	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.032	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-85.6	-6.8	172.7	-58.1	-50.2	0	0	0	113.6	K30 K59 L78 T79 S80 A84 Y86 V106	K30-D82 IonicContact NZ-OD1 3.87Å; K30-D82 PolarHBondContact NZ-OD1 2.8Å; K59-D82 WeakPolarHBondContact CE-OD1 3.43Å; K59-D82 WeakPolarHBondContact CE-OD2 3.39Å; K59-D82 IonicContact NZ-OD1 2.88Å; K59-D82 PolarHBondContact NZ-OD1 2.99Å; K59-D82 IonicContact NZ-OD2 2.54Å; K59-D82 PolarHBondContact NZ-OD2 3.42Å; L78-D82 VanDerWaalsContact CA-OD2 3.3Å; L78-D82 WeakPolarHBondContact CA-OD2 3.14Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; L78-D82 WeakPolarHBondContact CD2-OD2 3.21Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.18Å; T79-D82 PolarHBondContact O-N 2.9Å; T79-D82 PolarHBondContact OG1-OD2 3.03Å; S80-D82 PolarHBondContact O-N 2.84Å; D82-A84 PolarHBondContact O-N 3.08Å; D82-Y86 WeakPolarHBondContact O-CE2 3.44Å; D82-Y86 PolarHBondContact O-OH 2.8Å; D82-V106 HydrophobicContact CB-CG2 4.2Å
83	S	97.1	Very high	94.6	Very high	35 Å²	35	40.8 Å²	40.8	25%	0.245	25%	0.251	C	S	.	.			trans	-62.5	112.2	173.4	-57.3	0	0	0	0	110	S80 E81 V104 V106	S80-S83 WeakPolarHBondContact O-CB 2.89Å; S80-S83 PolarHBondContact O-N 2.87Å; S80-S83 VanDerWaalsContact O-N 3.08Å; S80-S83 PolarHBondContact O-OG 2.89Å; E81-S83 VanDerWaalsContact C-N 3.33Å; S83-V104 VanDerWaalsContact CA-O 3.29Å; S83-V104 WeakPolarHBondContact CA-O 3.37Å; S83-V106 PolarHBondContact OG-N 3.27Å
84	A	97.6	Very high	93.5	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	166.8	-170.1	0	0	0	0	0	110.7	K30 Q31 R32 D82 Y86 V104	K30-A84 HydrophobicContact CD-CB 4.2Å; K30-A84 HydrophobicContact CG-CB 3.55Å; Q31-A84 WeakPolarHBondContact O-CA 3.49Å; Q31-A84 VanDerWaalsContact O-CB 3.28Å; Q31-A84 WeakPolarHBondContact O-CB 3.44Å; R32-A84 HydrophobicContact CG-CB 4.24Å; D82-A84 PolarHBondContact O-N 3.08Å; A84-Y86 HydrophobicContact CB-CD2 4.34Å; A84-Y86 HydrophobicContact CB-CE2 3.84Å; A84-V104 PolarHBondContact N-O 2.8Å; A84-V104 PolarHBondContact O-N 3.02Å
85	V	98.1	Very high	92.4	Very high	37 Å²	37	49.5 Å²	49.5	22%	0.224	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.6	162.7	-169.8	0	0	0	0	108.6	Q31 Y87 L103	Q31-V85 PolarHBondContact N-O 3.43Å; Q31-V85 PolarHBondContact O-N 2.81Å; V85-Y87 HydrophobicContact CB-CE2 3.73Å; V85-Y87 HydrophobicContact CG1-CD2 4.23Å; V85-Y87 HydrophobicContact CG1-CE1 3.89Å; V85-Y87 HydrophobicContact CG1-CE2 3.52Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.35Å; V85-L103 HydrophobicContact CG2-CB 4.5Å; V85-L103 HydrophobicContact CG2-CD1 4.09Å
86	Y	98.3	Very high	91.9	Very high	3 Å²	3	51.4 Å²	51.4	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.2	179.2	-71.2	-89.3	0	0	0	110	L12 V29 K30 I40 M73 L75 D82 A84 G101 T102 V104	L12-Y86 VanDerWaalsContact CD1-CB 3.46Å; L12-Y86 HydrophobicContact CD1-CD1 4.4Å; L12-Y86 HydrophobicContact CD1-CD2 4.16Å; L12-Y86 HydrophobicContact CD1-CG 3.76Å; V29-Y86 CarbonylContact O-C 3.6Å; V29-Y86 WeakPolarHBondContact O-CA 3.49Å; K30-Y86 HydrophobicContact CB-CD1 4.13Å; K30-Y86 HydrophobicContact CB-CE1 3.9Å; K30-Y86 HydrophobicContact CD-CE1 3.99Å; K30-Y86 HydrophobicContact CG-CD1 4.3Å; K30-Y86 HydrophobicContact CG-CE1 3.77Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.79Å; M73-Y86 HydrophobicContact CE-CD1 3.61Å; M73-Y86 HydrophobicContact CE-CE1 4.16Å; M73-Y86 HydrophobicContact CE-CG 4.24Å; L75-Y86 HydrophobicContact CD1-CD1 4.14Å; L75-Y86 HydrophobicContact CD1-CE1 3.53Å; L75-Y86 HydrophobicContact CD1-CE2 4.13Å; D82-Y86 WeakPolarHBondContact O-CE2 3.44Å; D82-Y86 PolarHBondContact O-OH 2.8Å; A84-Y86 HydrophobicContact CB-CD2 4.34Å; A84-Y86 HydrophobicContact CB-CE2 3.84Å; Y86-G101 CarbonylContact O-C 3.57Å; Y86-G101 VanDerWaalsContact O-CA 3.25Å; Y86-G101 WeakPolarHBondContact O-CA 3.46Å; Y86-T102 PolarHBondContact N-O 3.3Å; Y86-T102 PolarHBondContact O-N 3.14Å; Y86-V104 HydrophobicContact CD2-CB 3.92Å; Y86-V104 HydrophobicContact CD2-CG2 3.63Å; Y86-V104 HydrophobicContact CE2-CB 3.81Å; Y86-V104 HydrophobicContact CE2-CG2 3.95Å
87	Y	98	Very high	91.7	Very high	48 Å²	48	56.4 Å²	56.4	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.3	-178.6	-60.1	-87	0	0	0	110.6	W28 V29 Q31 V85 W98 G99	W28-Y87 WeakPolarHBondContact CA-O 3.38Å; V29-Y87 PolarHBondContact N-O 3.47Å; V29-Y87 PolarHBondContact O-N 2.88Å; Q31-Y87 HydrophobicContact CB-CD2 4.38Å; Q31-Y87 HydrophobicContact CB-CE2 3.83Å; Q31-Y87 PolarHBondContact OE1-OH 3.38Å; V85-Y87 HydrophobicContact CB-CE2 3.73Å; V85-Y87 HydrophobicContact CG1-CD2 4.23Å; V85-Y87 HydrophobicContact CG1-CE1 3.89Å; V85-Y87 HydrophobicContact CG1-CE2 3.52Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.35Å; Y87-W98 HydrophobicContact CD1-CE3 4.48Å; Y87-W98 HydrophobicContact CG-CE3 4.12Å; Y87-W98 HydrophobicContact CG-CZ3 4.35Å; Y87-G99 WeakPolarHBondContact CD1-O 3.49Å
88	C	97.1	Very high	91.7	Very high	15 Å²	15	58.2 Å²	58.2	10%	0.101	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	148.7	157.7	62.7	0	0	0	0	109.7	C14 M26 H27 W28 G99	C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.31Å; C14-C88 WeakPolarHBondContact SG-CB 3.39Å; C14-C88 CovalentContact SG-SG 2.03Å; C14-C88 PolarHBondContact SG-SG 3.12Å; M26-C88 HydrophobicContact CG-CB 4.48Å; M26-C88 HydrophobicContact SD-CB 3.76Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 WeakPolarHBondContact O-CA 3.29Å; W28-C88 HydrophobicContact CD2-CB 4.47Å; W28-C88 HydrophobicContact CE3-CB 4.27Å; W28-C88 HydrophobicContact CH2-CB 4.38Å; W28-C88 HydrophobicContact CZ3-CB 4.23Å; C88-G99 PolarHBondContact O-N 3.5Å
89	A	96	Very high	91.6	Very high	5 Å²	5	59.4 Å²	59.4	4%	0.041	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.1	177.7	0	0	0	0	0	112.3	H27 Y97 W98	H27-A89 HydrophobicContact CB-CB 4.39Å; H27-A89 PolarHBondContact N-O 3.28Å; H27-A89 PolarHBondContact O-N 3.08Å; A89-Y97 CarbonylContact C-O 3.52Å; A89-Y97 WeakPolarHBondContact CA-O 3.42Å; A89-W98 HydrophobicContact CB-CD2 3.8Å; A89-W98 HydrophobicContact CB-CE3 3.83Å; A89-W98 HydrophobicContact CB-CG 4.33Å; A89-W98 HydrophobicContact CB-CH2 4.32Å; A89-W98 HydrophobicContact CB-CZ2 4.31Å; A89-W98 HydrophobicContact CB-CZ3 4.1Å
90	K	93.7	Very high	91.6	Very high	20 Å²	20	65.7 Å²	65.7	9%	0.087	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.1	170.2	178.2	-170.8	66.1	168.7	0	108.9	Y19 Y24 T92 A96 Y97	Y19-K90 HydrophobicContact CD1-CD 4.38Å; Y19-K90 VanDerWaalsContact CD1-NZ 3.34Å; Y19-K90 HydrophobicContact CD2-CD 3.94Å; Y19-K90 HydrophobicContact CE1-CD 4.07Å; Y19-K90 HydrophobicContact CE2-CD 3.59Å; Y19-K90 HydrophobicContact CG-CD 4.34Å; Y24-K90 HydrophobicContact CD1-CD 3.99Å; Y24-K90 HydrophobicContact CD1-CG 4.14Å; Y24-K90 HydrophobicContact CD2-CD 3.85Å; Y24-K90 HydrophobicContact CE2-CD 4.42Å; Y24-K90 HydrophobicContact CG-CD 3.6Å; Y24-K90 HydrophobicContact CG-CG 3.95Å; K90-T92 HydrophobicContact CD-CG2 3.99Å; K90-T92 VanDerWaalsContact CE-CG2 3.46Å; K90-T92 HydrophobicContact CG-CG2 4.21Å; K90-A96 CarbonylContact O-C 3.5Å; K90-A96 WeakPolarHBondContact O-CA 3.48Å; K90-Y97 PolarHBondContact N-O 2.94Å; K90-Y97 PolarHBondContact O-N 2.65Å
91	L	87	Confident	91.7	Very high	92 Å²	92	62.9 Å²	62.9	48%	0.482	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.1	171.3	-73.9	160.2	0	0	0	110.6	A96	L91-A96 HydrophobicContact CD2-CB 3.79Å
92	T	81.6	Confident	91.9	Very high	32 Å²	32	58.6 Å²	58.6	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	91.8	175.3	57.1	0	0	0	0	109.3	Y24 K90 T94 F95 Y97	Y24-T92 HydrophobicContact CD1-CG2 4.14Å; Y24-T92 HydrophobicContact CE1-CG2 3.73Å; K90-T92 HydrophobicContact CD-CG2 3.99Å; K90-T92 VanDerWaalsContact CE-CG2 3.46Å; K90-T92 HydrophobicContact CG-CG2 4.21Å; T92-T94 PolarHBondContact O-N 3.14Å; T92-F95 PolarHBondContact N-O 3.48Å; T92-F95 PolarHBondContact O-N 2.6Å; T92-F95 VanDerWaalsContact O-N 3.07Å; T92-F95 PolarHBondContact OG1-O 3.4Å; T92-Y97 HydrophobicContact CG2-CD2 4.03Å; T92-Y97 HydrophobicContact CG2-CE2 3.97Å; T92-Y97 VanDerWaalsContact OG1-CE2 3.26Å; T92-Y97 WeakPolarHBondContact OG1-CE2 3.35Å
93	G	79.1	Confident	92	Very high	84 Å²	84	62.2 Å²	62.2	87%	0.866	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-105.9	-177.7	0	0	0	0	0	111.5
94	T	76.8	Confident	92	Very high	127 Å²	127	60.6 Å²	60.6	78%	0.779	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.2	-177.3	51.7	0	0	0	0	115.2	T92	T92-T94 PolarHBondContact O-N 3.14Å
95	F	75.6	Confident	92	Very high	143 Å²	143	62.9 Å²	62.9	63%	0.627	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	151	-173.8	-61.4	-76.3	0	0	0	112.6	T92	T92-F95 PolarHBondContact N-O 3.48Å; T92-F95 PolarHBondContact O-N 2.6Å; T92-F95 VanDerWaalsContact O-N 3.07Å; T92-F95 PolarHBondContact OG1-O 3.4Å
96	A	86.6	Confident	91.9	Very high	42 Å²	42	61.5 Å²	61.5	35%	0.347	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.2	171.6	0	0	0	0	0	109.9	K90 L91	K90-A96 CarbonylContact O-C 3.5Å; K90-A96 WeakPolarHBondContact O-CA 3.48Å; L91-A96 HydrophobicContact CD2-CB 3.79Å
97	Y	92.3	Very high	91.7	Very high	139 Å²	139	63.9 Å²	63.9	55%	0.545	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.3	171	-66.9	-85.7	0	0	0	109	A89 K90 T92	A89-Y97 CarbonylContact C-O 3.52Å; A89-Y97 WeakPolarHBondContact CA-O 3.42Å; K90-Y97 PolarHBondContact N-O 2.94Å; K90-Y97 PolarHBondContact O-N 2.65Å; T92-Y97 HydrophobicContact CG2-CD2 4.03Å; T92-Y97 HydrophobicContact CG2-CE2 3.97Å; T92-Y97 VanDerWaalsContact OG1-CE2 3.26Å; T92-Y97 WeakPolarHBondContact OG1-CE2 3.35Å
98	W	95.1	Very high	91	Very high	117 Å²	117	68.1 Å²	68.1	44%	0.443	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.7	-176.5	-66.4	80	0	0	0	110.8	V29 L37 Y87 A89	V29-W98 HydrophobicContact CB-CH2 4.19Å; V29-W98 HydrophobicContact CB-CZ3 3.82Å; V29-W98 HydrophobicContact CG1-CH2 4.11Å; V29-W98 HydrophobicContact CG1-CZ3 4.02Å; V29-W98 HydrophobicContact CG2-CH2 3.81Å; V29-W98 HydrophobicContact CG2-CZ3 3.8Å; L37-W98 HydrophobicContact CD1-CH2 3.85Å; L37-W98 HydrophobicContact CD1-CZ2 4.28Å; L37-W98 HydrophobicContact CD1-CZ3 4.49Å; Y87-W98 HydrophobicContact CD1-CE3 4.48Å; Y87-W98 HydrophobicContact CG-CE3 4.12Å; Y87-W98 HydrophobicContact CG-CZ3 4.35Å; A89-W98 HydrophobicContact CB-CD2 3.8Å; A89-W98 HydrophobicContact CB-CE3 3.83Å; A89-W98 HydrophobicContact CB-CG 4.33Å; A89-W98 HydrophobicContact CB-CH2 4.32Å; A89-W98 HydrophobicContact CB-CZ2 4.31Å; A89-W98 HydrophobicContact CB-CZ3 4.1Å
99	G	95.2	Very high	90.6	Very high	27 Å²	27	70.8 Å²	70.8	28%	0.278	42%	0.42	S	S	.	.			trans	-69.3	165	163.1	0	0	0	0	0	111.2	Y87 C88 G101	Y87-G99 WeakPolarHBondContact CD1-O 3.49Å; C88-G99 PolarHBondContact O-N 3.5Å; G99-G101 PolarHBondContact O-N 3.04Å; G99-G101 VanDerWaalsContact O-N 3.12Å
100	Q	95.1	Very high	90.4	Very high	188 Å²	188	74.2 Å²	74.2	88%	0.879	44%	0.44	S	S	*	.			trans	-62.8	-19.1	179.2	-65.3	-62.3	-38	0	0	113.5
101	G	96.3	Very high	90.2	Very high	27 Å²	27	77.2 Å²	77.2	28%	0.278	46%	0.459	S	S	.	.			trans	84.8	150.7	-176.7	0	0	0	0	0	112.5	Y86 G99	Y86-G101 CarbonylContact O-C 3.57Å; Y86-G101 VanDerWaalsContact O-CA 3.25Å; Y86-G101 WeakPolarHBondContact O-CA 3.46Å; G99-G101 PolarHBondContact O-N 3.04Å; G99-G101 VanDerWaalsContact O-N 3.12Å
102	T	97.6	Very high	90.4	Very high	42 Å²	42	76.4 Å²	76.4	26%	0.258	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116.7	176	-59.4	0	0	0	0	108.7	E2 L12 Y86 V104	E2-T102 HydrophobicContact CG-CG2 4.3Å; L12-T102 HydrophobicContact CD2-CG2 3.89Å; Y86-T102 PolarHBondContact N-O 3.3Å; Y86-T102 PolarHBondContact O-N 3.14Å; T102-V104 PolarHBondContact O-N 3.48Å
103	L	97.6	Very high	90.9	Very high	82 Å²	82	79.1 Å²	79.1	43%	0.429	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	123.8	168.9	177.5	64.7	0	0	0	109.1	A1 E2 V85	A1-L103 CarbonylContact C-O 3.58Å; A1-L103 WeakPolarHBondContact CA-O 3.39Å; A1-L103 HydrophobicContact CB-CB 4.01Å; E2-L103 PolarHBondContact N-O 3.23Å; V85-L103 HydrophobicContact CG2-CB 4.5Å; V85-L103 HydrophobicContact CG2-CD1 4.09Å
104	V	97.5	Very high	91.7	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.1	167.2	179	0	0	0	0	107.3	E2 V4 V10 L12 S83 A84 Y86 T102 V106	E2-V104 HydrophobicContact CB-CG2 4.31Å; E2-V104 CarbonylContact O-C 3.5Å; E2-V104 WeakPolarHBondContact O-CA 3.39Å; V4-V104 HydrophobicContact CG2-CG1 4.19Å; V10-V104 HydrophobicContact CG1-CG1 4.38Å; V10-V104 HydrophobicContact CG1-CG2 4.44Å; L12-V104 HydrophobicContact CD1-CG2 4.16Å; L12-V104 HydrophobicContact CD2-CG2 3.98Å; S83-V104 VanDerWaalsContact CA-O 3.29Å; S83-V104 WeakPolarHBondContact CA-O 3.37Å; A84-V104 PolarHBondContact N-O 2.8Å; A84-V104 PolarHBondContact O-N 3.02Å; Y86-V104 HydrophobicContact CD2-CB 3.92Å; Y86-V104 HydrophobicContact CD2-CG2 3.63Å; Y86-V104 HydrophobicContact CE2-CB 3.81Å; Y86-V104 HydrophobicContact CE2-CG2 3.95Å; T102-V104 PolarHBondContact O-N 3.48Å; V104-V106 HydrophobicContact CG1-CG2 4.41Å
105	T	97.4	Very high	92.8	Very high	51 Å²	51	75.4 Å²	75.4	31%	0.313	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.7	177.3	-57.9	0	0	0	0	108.9	E2 L3 V4	E2-T105 PolarHBondContact O-N 3.34Å; L3-T105 WeakPolarHBondContact CA-O 3.36Å; L3-T105 HydrophobicContact CD1-CG2 3.82Å; V4-T105 PolarHBondContact N-O 3.16Å
106	V	96.4	Very high	94.1	Very high	8 Å²	8	70.2 Å²	70.2	5%	0.048	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.2	179.3	-169.7	0	0	0	0	108.5	V4 P6 L78 T79 D82 S83 V104	V4-V106 HydrophobicContact CG2-CB 4.41Å; V4-V106 HydrophobicContact CG2-CG1 4.49Å; V4-V106 HydrophobicContact CG2-CG2 3.84Å; V4-V106 VanDerWaalsContact O-CA 3.31Å; V4-V106 WeakPolarHBondContact O-CA 3.34Å; P6-V106 HydrophobicContact CB-CG1 4.46Å; P6-V106 HydrophobicContact CG-CG1 4.21Å; L78-V106 HydrophobicContact CB-CG1 4.23Å; L78-V106 HydrophobicContact CB-CG2 3.98Å; L78-V106 HydrophobicContact CD1-CG2 4.37Å; T79-V106 WeakPolarHBondContact O-CB 3.29Å; T79-V106 WeakPolarHBondContact O-CG2 3.49Å; D82-V106 HydrophobicContact CB-CG2 4.2Å; S83-V106 PolarHBondContact OG-N 3.27Å; V104-V106 HydrophobicContact CG1-CG2 4.41Å
107	S	93.9	Very high	94.7	Very high	53 Å²	53	72.5 Å²	72.5	37%	0.371	41%	0.414	S	S	.	.			trans	-140	151.2	-179.7	67.5	0	0	0	0	111.4	L3 V4 P6	L3-S107 WeakPolarHBondContact CD1-OG 3.46Å; V4-S107 PolarHBondContact O-N 2.77Å; V4-S107 VanDerWaalsContact O-N 3.07Å; P6-S107 WeakPolarHBondContact CD-O 2.93Å
108	A	82.3	Confident	94.9	Very high	136 Å²	136	66.5 Å²	66.5	100%	1.124	40%	0.402	S	S	*	.			trans	-70.4	0	176.3	0	0	0	0	0	111.9

Retrieved 108 of 108 residues in 26.8 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).