A0A068LL60_HUMAN Loading...

Ig heavy chain variable region

AlphaFold DB , UniProt , Accession A0A068LL60, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 120 aa.

						>A0A068LL60_HUMAN|A0A068LL60
QVQLVQSGAEVKKPGASVKVSCKASGYTFTSYDINWVRQATGQGLEWMGWMNPNSGNTDYAQKFQGRVTMTRNTSISTVYMELNSLRSEDTAVYYCARVGDSGYDSFDYWGQGSKVTVSS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	Q	87.1	Confident	96.7	Very high	202 Å²	202	66.5 Å²	66.5	94%	0.944	40%	0.396	S	S	*	.				0	138.1	0	-172.4	174.5	26	0	0	108
2	V	94.2	Very high	96.8	Very high	26 Å²	26	66 Å²	66	16%	0.158	39%	0.385	C	S	.	.			trans	-74.7	134.6	176.9	173.9	0	0	0	0	109.7	S25 G26 Y27 Y109	V2-S25 WeakPolarHBondContact CA-O 3.37Å; V2-G26 WeakPolarHBondContact CG2-O 3.41Å; V2-Y27 HydrophobicContact CB-CD1 4.49Å; V2-Y27 HydrophobicContact CG1-CD1 3.66Å; V2-Y27 HydrophobicContact CG1-CE1 3.88Å; V2-Y27 HydrophobicContact CG2-CD1 4.21Å; V2-Y109 HydrophobicContact CB-CD1 3.82Å; V2-Y109 HydrophobicContact CB-CD2 4.29Å; V2-Y109 HydrophobicContact CB-CE1 3.58Å; V2-Y109 HydrophobicContact CB-CE2 4.1Å; V2-Y109 HydrophobicContact CB-CG 4.16Å; V2-Y109 HydrophobicContact CG1-CD1 3.59Å; V2-Y109 HydrophobicContact CG1-CD2 3.61Å; V2-Y109 HydrophobicContact CG1-CE1 3.85Å; V2-Y109 HydrophobicContact CG1-CE2 3.89Å; V2-Y109 HydrophobicContact CG1-CG 3.46Å; V2-Y109 VanDerWaalsContact CG1-CG 3.46Å; V2-Y109 HydrophobicContact CG2-CE1 4.29Å; V2-Y109 HydrophobicContact CG2-CE2 4.19Å
3	Q	96.5	Very high	96.9	Very high	93 Å²	93	71.6 Å²	71.6	44%	0.435	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.5	177.5	-62.4	-176.3	-24.3	0	0	111.7	V5 A24 S25	Q3-V5 HydrophobicContact CB-CG2 4.44Å; Q3-A24 WeakPolarHBondContact O-CA 3.38Å; Q3-S25 PolarHBondContact N-O 2.98Å; Q3-S25 PolarHBondContact O-N 3.37Å
4	L	98.1	Very high	97	Very high	9 Å²	9	71.9 Å²	71.9	5%	0.047	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	111.5	168.1	-63.2	-176	0	0	0	107.7	K23 A24 Y27 R98 Y109 G111 Q112	L4-K23 WeakPolarHBondContact CA-O 3.48Å; L4-A24 HydrophobicContact CD2-CB 3.88Å; L4-Y27 HydrophobicContact CD2-CE1 4.34Å; L4-R98 HydrophobicContact CD1-CB 4.39Å; L4-Y109 WeakPolarHBondContact CD1-O 3.46Å; L4-G111 WeakPolarHBondContact O-CA 3.47Å; L4-Q112 PolarHBondContact O-OE1 3.21Å
5	V	98.5	Very high	97	Very high	74 Å²	74	70.8 Å²	70.8	45%	0.448	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.9	-175.8	-179.2	0	0	0	0	109.4	Q3 C22 K23	Q3-V5 HydrophobicContact CB-CG2 4.44Å; V5-C22 WeakPolarHBondContact O-CA 3.37Å; V5-K23 PolarHBondContact N-O 3.19Å; V5-K23 PolarHBondContact O-N 3.11Å
6	Q	98.7	Very high	97.1	Very high	11 Å²	11	68.6 Å²	68.6	5%	0.051	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	161.9	-178.3	-58.9	-179.9	-119.1	0	0	114	S21 C22 Y94 C96 G111 Q112 S114	Q6-S21 CarbonylContact C-O 3.58Å; Q6-S21 WeakPolarHBondContact CA-O 3.46Å; Q6-S21 WeakPolarHBondContact CB-O 3.39Å; Q6-C22 HydrophobicContact CG-CB 4.11Å; Q6-Y94 PolarHBondContact NE2-O 2.95Å; Q6-C96 WeakPolarHBondContact CG-SG 3.35Å; Q6-G111 VanDerWaalsContact OE1-C 3.25Å; Q6-G111 VanDerWaalsContact OE1-CA 3.26Å; Q6-Q112 VanDerWaalsContact N-NE2 3.15Å; Q6-Q112 PolarHBondContact O-NE2 2.9Å; Q6-S114 VanDerWaalsContact CB-OG 3.31Å; Q6-S114 WeakPolarHBondContact CB-OG 3.22Å; Q6-S114 PolarHBondContact NE2-OG 3.32Å
7	S	98.4	Very high	97.2	Very high	26 Å²	26	67.2 Å²	67.2	18%	0.182	41%	0.406	C	S	.	.			trans	-61.2	159.8	169	53.3	0	0	0	0	112.4	S21 S114	S7-S21 WeakPolarHBondContact CB-OG 3.32Å; S7-S21 PolarHBondContact N-O 3.22Å; S7-S21 VanDerWaalsContact N-O 3.1Å; S7-S21 PolarHBondContact OG-N 2.97Å; S7-S21 VanDerWaalsContact OG-N 3.16Å; S7-S114 WeakPolarHBondContact O-CB 3.46Å; S7-S114 PolarHBondContact O-OG 3.19Å
8	G	98.1	Very high	97.2	Very high	56 Å²	56	63.6 Å²	63.6	58%	0.577	38%	0.384	S	S	*	.			trans	-68.2	-180	179.4	0	0	0	0	0	113.9
9	A	98.2	Very high	97.3	Very high	77 Å²	77	65.4 Å²	65.4	64%	0.636	39%	0.386	S	S	*	.			trans	-68.7	145.6	175.2	0	0	0	0	0	111.7	K115	A9-K115 CarbonylContact C-O 3.51Å; A9-K115 WeakPolarHBondContact CA-O 3.21Å; A9-K115 HydrophobicContact CB-CB 4.04Å; A9-K115 WeakPolarHBondContact CB-O 3.35Å
10	E	97.9	Very high	97.4	Very high	55 Å²	55	62.1 Å²	62.1	26%	0.257	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.8	178.4	-69.2	-170.9	-119.6	0	0	111.3	K12 V18 K115 V116 T117	E10-K12 WeakPolarHBondContact OE2-CE 3.13Å; E10-K12 IonicContact OE2-NZ 2.73Å; E10-K12 PolarHBondContact OE2-NZ 3.16Å; E10-V18 HydrophobicContact CB-CG2 4.4Å; E10-K115 PolarHBondContact N-O 3.12Å; E10-V116 CarbonylContact O-C 3.6Å; E10-V116 WeakPolarHBondContact O-CA 3.47Å; E10-T117 PolarHBondContact O-N 2.83Å
11	V	98.2	Very high	97.4	Very high	102 Å²	102	60.7 Å²	60.7	62%	0.618	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.2	169.6	-174.7	0	0	0	0	107.9	T117 S119	V11-T117 CarbonylContact C-O 3.51Å; V11-T117 WeakPolarHBondContact CA-O 3Å; V11-S119 WeakPolarHBondContact CG1-OG 3.38Å
12	K	98.3	Very high	98	Very high	61 Å²	61	51.2 Å²	51.2	27%	0.265	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154	-178.5	-63.6	-64.7	-174.1	-167.6	0	110.4	E10 A16 S17 V18 L86 T117 V118 S119	E10-K12 WeakPolarHBondContact OE2-CE 3.13Å; E10-K12 IonicContact OE2-NZ 2.73Å; E10-K12 PolarHBondContact OE2-NZ 3.16Å; K12-A16 HydrophobicContact CB-CB 4.34Å; K12-S17 WeakPolarHBondContact CE-O 3.31Å; K12-V18 HydrophobicContact CG-CB 4.32Å; K12-L86 HydrophobicContact CB-CD1 3.63Å; K12-L86 HydrophobicContact CG-CD1 3.82Å; K12-T117 PolarHBondContact N-O 3.13Å; K12-V118 CarbonylContact O-C 3.47Å; K12-V118 VanDerWaalsContact O-CA 3.29Å; K12-V118 WeakPolarHBondContact O-CA 3.34Å; K12-S119 PolarHBondContact O-N 2.89Å
13	K	97.9	Very high	98.2	Very high	139 Å²	139	55.4 Å²	55.4	60%	0.604	33%	0.332	S	S	*	.			trans	-79.9	153	170.2	-66.3	-172.7	176.6	-174.2	0	110.7	A16 S119	K13-A16 VanDerWaalsContact O-CB 3.27Å; K13-A16 WeakPolarHBondContact O-CB 3.44Å; K13-A16 PolarHBondContact O-N 3.14Å; K13-S119 WeakPolarHBondContact CA-O 3.42Å
14	P	98.1	Very high	98.3	Very high	76 Å²	76	51.2 Å²	51.2	49%	0.494	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	141.2	167.8	-25.3	33.9	0	0	0	111.7	A16 L86 V118	P14-A16 VanDerWaalsContact C-N 3.27Å; P14-A16 PolarHBondContact O-N 2.95Å; P14-L86 CarbonylContact C-O 3.6Å; P14-L86 WeakPolarHBondContact CA-O 3.24Å; P14-V118 HydrophobicContact CB-CG1 4.41Å; P14-V118 HydrophobicContact CG-CG1 4.07Å
15	G	97.6	Very high	98.2	Very high	55 Å²	55	53 Å²	53	57%	0.567	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	-15.3	-177.8	0	0	0	0	0	115.3	L86	G15-L86 PolarHBondContact N-O 3.39Å
16	A	98.2	Very high	98.1	Very high	35 Å²	35	52 Å²	52	29%	0.289	33%	0.332	S	S	.	.			trans	-72.6	175.2	175.1	0	0	0	0	0	112.3	K12 K13 P14 S85 L86	K12-A16 HydrophobicContact CB-CB 4.34Å; K13-A16 VanDerWaalsContact O-CB 3.27Å; K13-A16 WeakPolarHBondContact O-CB 3.44Å; K13-A16 PolarHBondContact O-N 3.14Å; P14-A16 VanDerWaalsContact C-N 3.27Å; P14-A16 PolarHBondContact O-N 2.95Å; A16-S85 PolarHBondContact O-N 3.08Å; A16-L86 VanDerWaalsContact O-CB 3.31Å; A16-L86 WeakPolarHBondContact O-CB 3.37Å; A16-L86 VanDerWaalsContact O-CG 3.24Å; A16-L86 WeakPolarHBondContact O-CG 3.35Å; A16-L86 PolarHBondContact O-N 2.83Å
17	S	98.3	Very high	97.9	Very high	46 Å²	46	53.5 Å²	53.5	32%	0.322	34%	0.337	S	S	.	.			trans	-112.1	154.2	170.2	-56.9	0	0	0	0	111.2	K12 L83 N84	K12-S17 WeakPolarHBondContact CE-O 3.31Å; S17-L83 WeakPolarHBondContact CA-O 3.15Å; S17-N84 WeakPolarHBondContact CB-OD1 3.17Å; S17-N84 PolarHBondContact OG-OD1 2.82Å
18	V	98.4	Very high	97.8	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.2	170.9	65.9	0	0	0	0	109.6	E10 K12 V20 E82 L83 L86 V116	E10-V18 HydrophobicContact CB-CG2 4.4Å; K12-V18 HydrophobicContact CG-CB 4.32Å; V18-V20 HydrophobicContact CG2-CG2 4.36Å; V18-E82 CarbonylContact O-C 3.59Å; V18-E82 VanDerWaalsContact O-CA 3.26Å; V18-E82 WeakPolarHBondContact O-CA 3.36Å; V18-L83 HydrophobicContact CG1-CB 4.12Å; V18-L83 PolarHBondContact N-O 3.39Å; V18-L83 VanDerWaalsContact N-O 3.08Å; V18-L83 PolarHBondContact O-N 3.06Å; V18-L86 HydrophobicContact CB-CD1 4Å; V18-L86 HydrophobicContact CG1-CD1 4.02Å; V18-L86 HydrophobicContact CG1-CD2 4.03Å; V18-L86 HydrophobicContact CG1-CG 4.48Å; V18-V116 HydrophobicContact CB-CG1 4.43Å; V18-V116 HydrophobicContact CG1-CG1 4.18Å; V18-V116 HydrophobicContact CG1-CG2 4.31Å; V18-V116 HydrophobicContact CG2-CG1 4.32Å; V18-V116 HydrophobicContact CG2-CG2 3.96Å
19	K	98.5	Very high	97.7	Very high	97 Å²	97	54.3 Å²	54.3	42%	0.422	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	104.6	176.3	-174.6	174.6	-175.1	168.9	0	109.8	Y80 M81 E82	K19-Y80 HydrophobicContact CD-CD1 4.41Å; K19-Y80 HydrophobicContact CG-CD1 4.33Å; K19-M81 CarbonylContact C-O 3.6Å; K19-M81 WeakPolarHBondContact CA-O 3.5Å; K19-E82 HydrophobicContact CG-CB 4.47Å
20	V	98.6	Very high	97.6	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.8	177.4	-173.1	0	0	0	0	108.8	V18 W36 Y80 M81 S114 V116	V18-V20 HydrophobicContact CG2-CG2 4.36Å; V20-W36 HydrophobicContact CB-CH2 4.02Å; V20-W36 HydrophobicContact CB-CZ3 4.05Å; V20-W36 HydrophobicContact CG1-CH2 3.67Å; V20-W36 HydrophobicContact CG1-CZ3 3.59Å; V20-Y80 CarbonylContact O-C 3.54Å; V20-Y80 VanDerWaalsContact O-CA 3.26Å; V20-Y80 WeakPolarHBondContact O-CA 3.33Å; V20-M81 HydrophobicContact CB-CE 4.23Å; V20-M81 HydrophobicContact CG2-CE 3.89Å; V20-M81 PolarHBondContact N-O 3.09Å; V20-M81 PolarHBondContact O-N 2.81Å; V20-S114 WeakPolarHBondContact CG1-OG 3.36Å; V20-V116 HydrophobicContact CG2-CG2 4.29Å
21	S	98.7	Very high	97.5	Very high	33 Å²	33	54 Å²	54	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	153.1	174.2	70.1	0	0	0	0	111.2	Q6 S7	Q6-S21 CarbonylContact C-O 3.58Å; Q6-S21 WeakPolarHBondContact CA-O 3.46Å; Q6-S21 WeakPolarHBondContact CB-O 3.39Å; S7-S21 WeakPolarHBondContact CB-OG 3.32Å; S7-S21 PolarHBondContact N-O 3.22Å; S7-S21 VanDerWaalsContact N-O 3.1Å; S7-S21 PolarHBondContact OG-N 2.97Å; S7-S21 VanDerWaalsContact OG-N 3.16Å
22	C	98.6	Very high	97.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.014	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	109.6	171.7	174.7	0	0	0	0	109.5	V5 Q6 W36 T78 V79 C96	V5-C22 WeakPolarHBondContact O-CA 3.37Å; Q6-C22 HydrophobicContact CG-CB 4.11Å; C22-W36 HydrophobicContact CB-CH2 3.75Å; C22-W36 HydrophobicContact CB-CZ2 3.92Å; C22-T78 WeakPolarHBondContact O-CA 3.28Å; C22-V79 HydrophobicContact CB-CG2 3.86Å; C22-V79 PolarHBondContact N-O 2.69Å; C22-V79 PolarHBondContact O-N 2.84Å; C22-C96 HydrophobicContact CB-CB 3.49Å; C22-C96 VanDerWaalsContact CB-CB 3.49Å; C22-C96 WeakPolarHBondContact CB-SG 3.37Å; C22-C96 WeakPolarHBondContact SG-CB 3.25Å; C22-C96 CovalentContact SG-SG 2.03Å; C22-C96 PolarHBondContact SG-SG 2.74Å
23	K	98.6	Very high	97.2	Very high	114 Å²	114	49.2 Å²	49.2	50%	0.496	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.8	178.4	-175.5	176.6	-177.3	180	0	110.1	L4 V5 S77	L4-K23 WeakPolarHBondContact CA-O 3.48Å; V5-K23 PolarHBondContact N-O 3.19Å; V5-K23 PolarHBondContact O-N 3.11Å; K23-S77 WeakPolarHBondContact CA-O 3.48Å
24	A	98	Very high	97.1	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	143.2	176.6	0	0	0	0	0	111.7	Q3 L4 Y27 F29 S77	Q3-A24 WeakPolarHBondContact O-CA 3.38Å; L4-A24 HydrophobicContact CD2-CB 3.88Å; A24-Y27 HydrophobicContact CB-CE1 3.78Å; A24-Y27 VanDerWaalsContact CB-OH 3.24Å; A24-Y27 WeakPolarHBondContact CB-OH 3.48Å; A24-F29 HydrophobicContact CB-CD2 3.56Å; A24-F29 HydrophobicContact CB-CE2 4.12Å; A24-F29 HydrophobicContact CB-CG 4.48Å; A24-S77 PolarHBondContact N-O 2.92Å; A24-S77 WeakPolarHBondContact O-CB 3.38Å
25	S	97.4	Very high	97.1	Very high	47 Å²	47	39.4 Å²	39.4	33%	0.329	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	160.3	170.7	71.2	0	0	0	0	111.3	V2 Q3 Y27	V2-S25 WeakPolarHBondContact CA-O 3.37Å; Q3-S25 PolarHBondContact N-O 2.98Å; Q3-S25 PolarHBondContact O-N 3.37Å; S25-Y27 WeakPolarHBondContact O-CD1 3.29Å
26	G	96.1	Very high	97.1	Very high	54 Å²	54	36.8 Å²	36.8	56%	0.557	22%	0.22	S	C	*	.	S	Bend	trans	84.1	8.4	177.6	0	0	0	0	0	115.6	V2	V2-G26 WeakPolarHBondContact CG2-O 3.41Å
27	Y	94.4	Very high	97.1	Very high	42 Å²	42	35.3 Å²	35.3	17%	0.165	21%	0.207	C	C	.	.	S	Bend	trans	-156.5	169.8	170.8	66.9	-79.8	0	0	0	110.5	V2 L4 A24 S25 F29 Y32 I34	V2-Y27 HydrophobicContact CB-CD1 4.49Å; V2-Y27 HydrophobicContact CG1-CD1 3.66Å; V2-Y27 HydrophobicContact CG1-CE1 3.88Å; V2-Y27 HydrophobicContact CG2-CD1 4.21Å; L4-Y27 HydrophobicContact CD2-CE1 4.34Å; A24-Y27 HydrophobicContact CB-CE1 3.78Å; A24-Y27 VanDerWaalsContact CB-OH 3.24Å; A24-Y27 WeakPolarHBondContact CB-OH 3.48Å; S25-Y27 WeakPolarHBondContact O-CD1 3.29Å; Y27-F29 PolarHBondContact O-N 3.22Å; Y27-F29 VanDerWaalsContact O-N 3.14Å; Y27-Y32 AromaticContact CD2-CD2 3.56Å; Y27-Y32 HydrophobicContact CD2-CD2 3.56Å; Y27-Y32 HydrophobicContact CD2-CE2 4.06Å; Y27-Y32 AromaticContact CE2-CD2 3.81Å; Y27-Y32 HydrophobicContact CE2-CD2 3.81Å; Y27-Y32 HydrophobicContact CE2-CG 4.43Å; Y27-I34 WeakPolarHBondContact OH-CD1 3.39Å
28	T	96.2	Very high	97.1	Very high	89 Å²	89	33.3 Å²	33.3	55%	0.546	19%	0.193	S	C	.	.			trans	-70.3	105.1	172.3	-59.1	0	0	0	0	109.6	T30 S31	T28-T30 PolarHBondContact O-N 2.65Å; T28-S31 WeakPolarHBondContact CB-OG 3.41Å; T28-S31 WeakPolarHBondContact CG2-OG 3.4Å; T28-S31 VanDerWaalsContact O-CB 3.32Å; T28-S31 WeakPolarHBondContact O-CB 3.4Å; T28-S31 PolarHBondContact O-N 3Å; T28-S31 PolarHBondContact O-OG 2.9Å
29	F	95.9	Very high	97.1	Very high	9 Å²	9	36.8 Å²	36.8	4%	0.039	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-51.9	-34.8	-173.6	172.4	-119.8	0	0	0	114.5	A24 Y27 S31 I34 P53 T74 V79	A24-F29 HydrophobicContact CB-CD2 3.56Å; A24-F29 HydrophobicContact CB-CE2 4.12Å; A24-F29 HydrophobicContact CB-CG 4.48Å; Y27-F29 PolarHBondContact O-N 3.22Å; Y27-F29 VanDerWaalsContact O-N 3.14Å; F29-S31 VanDerWaalsContact C-N 3.3Å; F29-S31 PolarHBondContact O-N 2.89Å; F29-I34 HydrophobicContact CE2-CG1 4.35Å; F29-P53 HydrophobicContact CD1-CB 3.95Å; F29-P53 HydrophobicContact CD2-CB 4.49Å; F29-P53 HydrophobicContact CD2-CG 4.43Å; F29-P53 HydrophobicContact CE1-CB 3.57Å; F29-P53 HydrophobicContact CE1-CG 4.34Å; F29-P53 HydrophobicContact CE2-CB 4.17Å; F29-P53 HydrophobicContact CE2-CG 4.04Å; F29-P53 HydrophobicContact CG-CB 4.42Å; F29-P53 HydrophobicContact CZ-CB 3.71Å; F29-P53 HydrophobicContact CZ-CG 4Å; F29-T74 HydrophobicContact CE1-CG2 4.34Å; F29-V79 HydrophobicContact CE2-CG1 3.81Å; F29-V79 HydrophobicContact CZ-CG1 3.49Å; F29-V79 VanDerWaalsContact CZ-CG1 3.49Å
30	T	96.4	Very high	97.1	Very high	49 Å²	49	32.6 Å²	32.6	30%	0.301	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-80.1	-6.2	-179.2	52.1	0	0	0	0	114.3	T28 N54 T74	T28-T30 PolarHBondContact O-N 2.65Å; T30-N54 WeakPolarHBondContact O-CB 3.42Å; T30-T74 HydrophobicContact CG2-CG2 4.16Å
31	S	94.5	Very high	96.9	Very high	77 Å²	77	39.1 Å²	39.1	54%	0.538	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-82.5	-12.1	-177.8	-62.6	0	0	0	0	114.2	T28 F29	T28-S31 WeakPolarHBondContact CB-OG 3.41Å; T28-S31 WeakPolarHBondContact CG2-OG 3.4Å; T28-S31 VanDerWaalsContact O-CB 3.32Å; T28-S31 WeakPolarHBondContact O-CB 3.4Å; T28-S31 PolarHBondContact O-N 3Å; T28-S31 PolarHBondContact O-OG 2.9Å; F29-S31 VanDerWaalsContact C-N 3.3Å; F29-S31 PolarHBondContact O-N 2.89Å
32	Y	94.2	Very high	96.7	Very high	48 Å²	48	41.7 Å²	41.7	19%	0.188	26%	0.263	C	S	.	.	S	Bend	trans	-137.4	143.1	-173.4	-65.2	-87.9	0	0	0	112	Y27 P53 R98 V99 D101	Y27-Y32 AromaticContact CD2-CD2 3.56Å; Y27-Y32 HydrophobicContact CD2-CD2 3.56Å; Y27-Y32 HydrophobicContact CD2-CE2 4.06Å; Y27-Y32 AromaticContact CE2-CD2 3.81Å; Y27-Y32 HydrophobicContact CE2-CD2 3.81Å; Y27-Y32 HydrophobicContact CE2-CG 4.43Å; Y32-P53 WeakPolarHBondContact O-CD 3.31Å; Y32-P53 WeakPolarHBondContact O-CG 3.24Å; Y32-R98 HydrophobicContact CD1-CG 4.26Å; Y32-R98 HydrophobicContact CG-CG 3.94Å; Y32-V99 HydrophobicContact CD1-CG1 4.11Å; Y32-V99 WeakPolarHBondContact CD1-O 3.29Å; Y32-D101 WeakPolarHBondContact CE1-OD1 3.49Å; Y32-D101 VanDerWaalsContact CZ-OD1 3.29Å; Y32-D101 PolarHBondContact OH-OD1 2.84Å
33	D	95.7	Very high	96.6	Very high	14 Å²	14	46.8 Å²	46.8	8%	0.075	29%	0.287	C	S	.	.			trans	-70	142.3	169.8	-62.3	-26.7	0	0	0	110.6	W50 M51 N52 V99	D33-W50 HydrophobicContact CB-CE3 4.42Å; D33-M51 WeakPolarHBondContact CA-O 3.34Å; D33-N52 WeakPolarHBondContact OD1-CA 3Å; D33-N52 WeakPolarHBondContact OD1-CB 3.42Å; D33-N52 PolarHBondContact OD1-ND2 2.75Å; D33-V99 HydrophobicContact CB-CG1 4.02Å; D33-V99 PolarHBondContact O-N 3.19Å; D33-V99 VanDerWaalsContact O-N 3.11Å
34	I	97.3	Very high	96.4	Very high	0 Å²	0	44 Å²	44	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	173.3	-52.1	-60.4	0	0	0	109.3	Y27 F29 W50 M51 P53 V79 C96 A97 R98	Y27-I34 WeakPolarHBondContact OH-CD1 3.39Å; F29-I34 HydrophobicContact CE2-CG1 4.35Å; I34-W50 CarbonylContact O-C 3.59Å; I34-W50 WeakPolarHBondContact O-CA 3.27Å; I34-M51 PolarHBondContact N-O 2.95Å; I34-M51 PolarHBondContact O-N 2.88Å; I34-P53 HydrophobicContact CG1-CG 4.08Å; I34-V79 HydrophobicContact CB-CG1 4.18Å; I34-V79 HydrophobicContact CB-CG2 4.07Å; I34-V79 HydrophobicContact CG1-CG1 4.05Å; I34-V79 HydrophobicContact CG1-CG2 4.32Å; I34-V79 HydrophobicContact CG2-CG2 3.63Å; I34-C96 HydrophobicContact CG2-CB 3.98Å; I34-A97 CarbonylContact C-O 3.58Å; I34-A97 WeakPolarHBondContact CA-O 3.12Å; I34-R98 HydrophobicContact CD1-CB 4.3Å; I34-R98 HydrophobicContact CD1-CG 4.24Å
35	N	97.5	Very high	96.4	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.053	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	148.3	178.4	-71.9	-96.9	0	0	0	110.1	W47 G49 W50 C96 A97 F107	N35-W47 PolarHBondContact OD1-NE1 3.4Å; N35-G49 WeakPolarHBondContact CA-O 3.33Å; N35-W50 WeakPolarHBondContact OD1-CB 3.31Å; N35-C96 CarbonylContact O-C 3.58Å; N35-C96 VanDerWaalsContact O-CA 3.27Å; N35-C96 WeakPolarHBondContact O-CA 3.46Å; N35-A97 HydrophobicContact CB-CB 4.46Å; N35-A97 PolarHBondContact N-O 3.38Å; N35-A97 PolarHBondContact O-N 3.1Å; N35-F107 HydrophobicContact CB-CE1 3.79Å; N35-F107 HydrophobicContact CB-CZ 3.93Å; N35-F107 WeakPolarHBondContact ND2-CE1 3.43Å
36	W	98.3	Very high	96.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.6	168.2	-72.4	94.4	0	0	0	109.8	V20 C22 M48 G49 M70 V79 M81 Y95 C96	V20-W36 HydrophobicContact CB-CH2 4.02Å; V20-W36 HydrophobicContact CB-CZ3 4.05Å; V20-W36 HydrophobicContact CG1-CH2 3.67Å; V20-W36 HydrophobicContact CG1-CZ3 3.59Å; C22-W36 HydrophobicContact CB-CH2 3.75Å; C22-W36 HydrophobicContact CB-CZ2 3.92Å; W36-M48 HydrophobicContact CB-CB 4.23Å; W36-M48 WeakPolarHBondContact O-CB 3.33Å; W36-M48 PolarHBondContact O-N 2.86Å; W36-G49 PolarHBondContact N-O 2.93Å; W36-M70 HydrophobicContact CB-CE 3.87Å; W36-M70 HydrophobicContact CG-CE 4.04Å; W36-V79 HydrophobicContact CZ2-CG2 3.95Å; W36-M81 HydrophobicContact CD2-CB 3.52Å; W36-M81 HydrophobicContact CD2-CG 4.15Å; W36-M81 HydrophobicContact CE3-CB 4.04Å; W36-M81 HydrophobicContact CG-CB 3.85Å; W36-M81 HydrophobicContact CG-CG 4.08Å; W36-M81 HydrophobicContact CH2-CB 4.27Å; W36-M81 HydrophobicContact CZ2-CB 3.78Å; W36-M81 HydrophobicContact CZ3-CB 4.39Å; W36-Y95 WeakPolarHBondContact CA-O 3.45Å; W36-C96 HydrophobicContact CD2-CB 4.37Å; W36-C96 HydrophobicContact CE3-CB 4.17Å; W36-C96 HydrophobicContact CH2-CB 4.04Å; W36-C96 HydrophobicContact CZ2-CB 4.24Å; W36-C96 HydrophobicContact CZ3-CB 3.99Å
37	V	98.2	Very high	96.4	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.2	-178	-176.7	0	0	0	0	107.6	L45 E46 Y94 Y95 F107 W110	V37-L45 HydrophobicContact CG1-CB 3.78Å; V37-L45 HydrophobicContact CG1-CD2 3.88Å; V37-L45 HydrophobicContact CG1-CG 4.31Å; V37-E46 CarbonylContact C-O 3.6Å; V37-E46 WeakPolarHBondContact CA-O 3.45Å; V37-Y94 CarbonylContact O-C 3.56Å; V37-Y95 PolarHBondContact N-O 2.9Å; V37-Y95 PolarHBondContact O-N 2.83Å; V37-F107 HydrophobicContact CG2-CE2 4.27Å; V37-W110 HydrophobicContact CB-CH2 4.37Å; V37-W110 HydrophobicContact CB-CZ3 4.01Å; V37-W110 HydrophobicContact CG1-CH2 4.38Å; V37-W110 HydrophobicContact CG1-CZ3 4.3Å; V37-W110 HydrophobicContact CG2-CH2 4.07Å; V37-W110 HydrophobicContact CG2-CZ3 4.04Å
38	R	98.1	Very high	96.6	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	154.9	171.8	72.1	175.2	-167.3	175.4	0.4	111.8	E46 M48 F64 D90 A92 V93 Y94	R38-E46 HydrophobicContact CG-CB 4.1Å; R38-E46 IonicContact CZ-OE2 2.84Å; R38-E46 VanDerWaalsContact CZ-OE2 3.26Å; R38-E46 PolarHBondContact N-O 2.88Å; R38-E46 IonicContact NE-OE2 2.81Å; R38-E46 PolarHBondContact NE-OE2 2.75Å; R38-E46 IonicContact NH2-OE2 2.65Å; R38-E46 PolarHBondContact NH2-OE2 2.81Å; R38-E46 PolarHBondContact O-N 2.94Å; R38-M48 HydrophobicContact CB-CG 4.44Å; R38-M48 HydrophobicContact CB-SD 3.87Å; R38-M48 HydrophobicContact CG-CG 4.2Å; R38-M48 HydrophobicContact CG-SD 4.07Å; R38-F64 HydrophobicContact CG-CZ 4.43Å; R38-F64 VanDerWaalsContact CZ-CE1 3.41Å; R38-F64 VanDerWaalsContact NE-CZ 3.34Å; R38-D90 IonicContact CZ-OD1 2.82Å; R38-D90 IonicContact NH1-OD1 3.09Å; R38-D90 PolarHBondContact NH1-OD1 2.98Å; R38-A92 HydrophobicContact CB-CB 4.09Å; R38-V93 CarbonylContact C-O 3.57Å; R38-V93 VanDerWaalsContact CA-O 3.28Å; R38-V93 WeakPolarHBondContact CA-O 3.32Å; R38-Y94 HydrophobicContact CB-CD1 3.85Å; R38-Y94 HydrophobicContact CB-CE1 3.88Å; R38-Y94 HydrophobicContact CB-CG 4.36Å
39	Q	98.4	Very high	96.6	Very high	75 Å²	75	43.9 Å²	43.9	35%	0.35	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	105.8	172.9	-165.5	179.4	25.7	0	0	109.3	L45 A92 V93 Y95	Q39-L45 HydrophobicContact CB-CD2 4.05Å; Q39-L45 HydrophobicContact CG-CD2 4.32Å; Q39-A92 WeakPolarHBondContact O-CA 3.46Å; Q39-A92 WeakPolarHBondContact O-CB 3.41Å; Q39-V93 PolarHBondContact N-O 3.36Å; Q39-V93 PolarHBondContact O-N 3.03Å; Q39-Y95 HydrophobicContact CB-CE2 3.93Å
40	A	97.7	Very high	96.6	Very high	9 Å²	9	46.6 Å²	46.6	7%	0.074	27%	0.274	C	S	.	.			trans	-76.4	153.8	170.4	0	0	0	0	0	110.1	G42 Q43 A92	A40-G42 PolarHBondContact O-N 2.87Å; A40-Q43 HydrophobicContact CB-CB 4.15Å; A40-Q43 HydrophobicContact CB-CG 4.15Å; A40-Q43 PolarHBondContact O-N 2.84Å; A40-A92 HydrophobicContact CB-CB 4.36Å
41	T	94.9	Very high	96.7	Very high	137 Å²	137	44.4 Å²	44.4	84%	0.84	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	125.5	178.7	-54	0	0	0	0	110.6	Q43	T41-Q43 PolarHBondContact O-N 2.61Å
42	G	94.9	Very high	96.8	Very high	86 Å²	86	42.5 Å²	42.5	89%	0.887	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	6.3	-179.6	0	0	0	0	0	115	A40	A40-G42 PolarHBondContact O-N 2.87Å
43	Q	95.2	Very high	96.9	Very high	110 Å²	110	40.2 Å²	40.2	51%	0.514	24%	0.235	S	C	.	.			trans	-112.7	159.3	176.9	-60.6	-174.3	41.8	0	0	111.6	A40 T41	A40-Q43 HydrophobicContact CB-CB 4.15Å; A40-Q43 HydrophobicContact CB-CG 4.15Å; A40-Q43 PolarHBondContact O-N 2.84Å; T41-Q43 PolarHBondContact O-N 2.61Å
44	G	95.9	Very high	97	Very high	56 Å²	56	44.9 Å²	44.9	58%	0.577	26%	0.26	S	S	*	.			trans	-69.4	179.3	170.7	0	0	0	0	0	112.6
45	L	96.6	Very high	97	Very high	100 Å²	100	47.7 Å²	47.7	52%	0.524	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130	171.5	-67	174.4	0	0	0	110	V37 Q39 W110	V37-L45 HydrophobicContact CG1-CB 3.78Å; V37-L45 HydrophobicContact CG1-CD2 3.88Å; V37-L45 HydrophobicContact CG1-CG 4.31Å; Q39-L45 HydrophobicContact CB-CD2 4.05Å; Q39-L45 HydrophobicContact CG-CD2 4.32Å; L45-W110 HydrophobicContact CD1-CH2 4.02Å
46	E	97.3	Very high	97	Very high	48 Å²	48	48.1 Å²	48.1	22%	0.224	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.8	178.1	-178.3	170.2	-136.9	0	0	109.1	V37 R38 K63 F64	V37-E46 CarbonylContact C-O 3.6Å; V37-E46 WeakPolarHBondContact CA-O 3.45Å; R38-E46 HydrophobicContact CG-CB 4.1Å; R38-E46 IonicContact CZ-OE2 2.84Å; R38-E46 VanDerWaalsContact CZ-OE2 3.26Å; R38-E46 PolarHBondContact N-O 2.88Å; R38-E46 IonicContact NE-OE2 2.81Å; R38-E46 PolarHBondContact NE-OE2 2.75Å; R38-E46 IonicContact NH2-OE2 2.65Å; R38-E46 PolarHBondContact NH2-OE2 2.81Å; R38-E46 PolarHBondContact O-N 2.94Å; E46-K63 VanDerWaalsContact CD-NZ 3.29Å; E46-K63 WeakPolarHBondContact OE1-CD 3.49Å; E46-K63 WeakPolarHBondContact OE1-CE 3.41Å; E46-K63 IonicContact OE1-NZ 3.26Å; E46-K63 PolarHBondContact OE1-NZ 2.85Å; E46-K63 IonicContact OE2-NZ 3.98Å; E46-K63 PolarHBondContact OE2-NZ 3.2Å; E46-K63 VanDerWaalsContact OE2-NZ 3.09Å; E46-F64 HydrophobicContact CG-CE2 3.91Å; E46-F64 HydrophobicContact CG-CZ 3.97Å; E46-F64 WeakPolarHBondContact OE2-CZ 3.33Å
47	W	96.8	Very high	96.9	Very high	85 Å²	85	53 Å²	53	32%	0.322	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	133.8	177	-180	80.9	0	0	0	110.6	N35 G49 W50 A61	N35-W47 PolarHBondContact OD1-NE1 3.4Å; W47-G49 PolarHBondContact NE1-O 3.38Å; W47-W50 HydrophobicContact CZ2-CB 4.24Å; W47-W50 AromaticContact CZ2-CD1 3.49Å; W47-W50 VanDerWaalsContact CZ2-CD1 3.49Å; W47-W50 HydrophobicContact CZ2-CG 4.18Å; W47-A61 HydrophobicContact CE3-CB 3.65Å; W47-A61 HydrophobicContact CZ3-CB 3.74Å; W47-A61 WeakPolarHBondContact O-CB 3.34Å
48	M	97.8	Very high	96.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-31.9	-175.6	-60.9	-176.6	73.9	0	0	113.2	W36 R38 A61 F64 V68 M81 Y94	W36-M48 HydrophobicContact CB-CB 4.23Å; W36-M48 WeakPolarHBondContact O-CB 3.33Å; W36-M48 PolarHBondContact O-N 2.86Å; R38-M48 HydrophobicContact CB-CG 4.44Å; R38-M48 HydrophobicContact CB-SD 3.87Å; R38-M48 HydrophobicContact CG-CG 4.2Å; R38-M48 HydrophobicContact CG-SD 4.07Å; M48-A61 PolarHBondContact O-N 2.65Å; M48-F64 HydrophobicContact CB-CD2 3.96Å; M48-F64 HydrophobicContact CB-CE2 4.14Å; M48-F64 HydrophobicContact CB-CG 4.4Å; M48-F64 HydrophobicContact CE-CD1 3.71Å; M48-F64 HydrophobicContact CE-CE1 3.79Å; M48-F64 HydrophobicContact CE-CG 4.16Å; M48-F64 HydrophobicContact CE-CZ 4.3Å; M48-F64 HydrophobicContact CG-CD2 4.02Å; M48-F64 HydrophobicContact CG-CE1 4.35Å; M48-F64 HydrophobicContact CG-CE2 3.73Å; M48-F64 HydrophobicContact CG-CG 4.46Å; M48-F64 HydrophobicContact CG-CZ 3.9Å; M48-V68 HydrophobicContact CE-CG2 3.7Å; M48-M81 HydrophobicContact CE-CE 4.49Å; M48-M81 HydrophobicContact CE-SD 4.32Å; M48-Y94 HydrophobicContact CE-CD1 4.23Å; M48-Y94 HydrophobicContact CE-CE1 3.73Å; M48-Y94 HydrophobicContact SD-CD1 3.63Å; M48-Y94 HydrophobicContact SD-CE1 3.64Å
49	G	97.1	Very high	96.8	Very high	0 Å²	0	59 Å²	59	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.3	172.6	-172.3	0	0	0	0	0	112.2	N35 W36 W47 D59	N35-G49 WeakPolarHBondContact CA-O 3.33Å; W36-G49 PolarHBondContact N-O 2.93Å; W47-G49 PolarHBondContact NE1-O 3.38Å; G49-D59 CarbonylContact C-O 3.58Å; G49-D59 WeakPolarHBondContact CA-O 3Å
50	W	96.9	Very high	96.8	Very high	66 Å²	66	57.9 Å²	57.9	25%	0.25	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158.7	173.4	65.9	-109.9	0	0	0	111.4	D33 I34 N35 W47 N52 N57 T58 D59	D33-W50 HydrophobicContact CB-CE3 4.42Å; I34-W50 CarbonylContact O-C 3.59Å; I34-W50 WeakPolarHBondContact O-CA 3.27Å; N35-W50 WeakPolarHBondContact OD1-CB 3.31Å; W47-W50 HydrophobicContact CZ2-CB 4.24Å; W47-W50 AromaticContact CZ2-CD1 3.49Å; W47-W50 VanDerWaalsContact CZ2-CD1 3.49Å; W47-W50 HydrophobicContact CZ2-CG 4.18Å; W50-N52 HydrophobicContact CE3-CB 4.46Å; W50-N52 HydrophobicContact CZ3-CB 3.81Å; W50-N57 HydrophobicContact CH2-CB 4.12Å; W50-N57 HydrophobicContact CZ3-CB 4.15Å; W50-N57 WeakPolarHBondContact CZ3-O 3.27Å; W50-T58 VanDerWaalsContact O-CA 3.25Å; W50-T58 WeakPolarHBondContact O-CA 3.46Å; W50-D59 HydrophobicContact CD2-CB 4.33Å; W50-D59 HydrophobicContact CG-CB 4.5Å; W50-D59 HydrophobicContact CZ2-CB 3.98Å; W50-D59 PolarHBondContact N-O 2.83Å; W50-D59 PolarHBondContact O-N 3.36Å; W50-D59 VanDerWaalsContact O-N 3.1Å
51	M	97.1	Very high	96.7	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.02	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.1	173.2	166.5	167.8	-80.1	0	0	110.4	D33 I34 P53 N57 T58 M70 R72 V79	D33-M51 WeakPolarHBondContact CA-O 3.34Å; I34-M51 PolarHBondContact N-O 2.95Å; I34-M51 PolarHBondContact O-N 2.88Å; M51-P53 WeakPolarHBondContact O-CD 3.47Å; M51-N57 WeakPolarHBondContact CA-O 3.4Å; M51-T58 HydrophobicContact CB-CG2 4.14Å; M51-T58 HydrophobicContact CE-CG2 3.34Å; M51-T58 HydrophobicContact CG-CG2 4.35Å; M51-M70 HydrophobicContact CB-CB 4.36Å; M51-M70 HydrophobicContact CB-SD 4.39Å; M51-M70 HydrophobicContact CE-CB 3.7Å; M51-M70 WeakPolarHBondContact CE-O 3.37Å; M51-M70 HydrophobicContact SD-CB 4.46Å; M51-R72 HydrophobicContact SD-CB 3.72Å; M51-R72 HydrophobicContact SD-CG 4.25Å; M51-V79 HydrophobicContact SD-CG1 4.16Å
52	N	97.1	Very high	96.8	Very high	36 Å²	36	60.3 Å²	60.3	19%	0.193	34%	0.344	C	S	.	.			trans	-85.8	114.1	167	-175.6	-69.7	0	0	0	109.6	D33 W50 N54 S55 G56 N57	D33-N52 WeakPolarHBondContact OD1-CA 3Å; D33-N52 WeakPolarHBondContact OD1-CB 3.42Å; D33-N52 PolarHBondContact OD1-ND2 2.75Å; W50-N52 HydrophobicContact CE3-CB 4.46Å; W50-N52 HydrophobicContact CZ3-CB 3.81Å; N52-N54 PolarHBondContact O-N 3.4Å; N52-N54 WeakPolarHBondContact OD1-CA 3.42Å; N52-N54 WeakPolarHBondContact OD1-CB 2.93Å; N52-N54 PolarHBondContact OD1-N 3.25Å; N52-S55 WeakPolarHBondContact CB-OG 3.49Å; N52-S55 PolarHBondContact OD1-N 2.86Å; N52-S55 PolarHBondContact OD1-OG 3.32Å; N52-G56 WeakPolarHBondContact O-CA 3.02Å; N52-G56 PolarHBondContact O-N 3.16Å; N52-N57 HydrophobicContact CB-CB 4.49Å; N52-N57 PolarHBondContact N-O 3.47Å
53	P	97.1	Very high	96.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-14.7	-176.1	-17.5	32.4	0	0	0	114.3	F29 Y32 I34 M51 R72 V79	F29-P53 HydrophobicContact CD1-CB 3.95Å; F29-P53 HydrophobicContact CD2-CB 4.49Å; F29-P53 HydrophobicContact CD2-CG 4.43Å; F29-P53 HydrophobicContact CE1-CB 3.57Å; F29-P53 HydrophobicContact CE1-CG 4.34Å; F29-P53 HydrophobicContact CE2-CB 4.17Å; F29-P53 HydrophobicContact CE2-CG 4.04Å; F29-P53 HydrophobicContact CG-CB 4.42Å; F29-P53 HydrophobicContact CZ-CB 3.71Å; F29-P53 HydrophobicContact CZ-CG 4Å; Y32-P53 WeakPolarHBondContact O-CD 3.31Å; Y32-P53 WeakPolarHBondContact O-CG 3.24Å; I34-P53 HydrophobicContact CG1-CG 4.08Å; M51-P53 WeakPolarHBondContact O-CD 3.47Å; P53-R72 WeakPolarHBondContact O-CD 3.27Å; P53-R72 PolarHBondContact O-NE 3.45Å; P53-V79 HydrophobicContact CG-CG1 4.33Å
54	N	97.2	Very high	96.8	Very high	112 Å²	112	56.2 Å²	56.2	60%	0.599	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-63.8	174	-172.3	32.3	0	0	0	110.6	T30 N52 R72	T30-N54 WeakPolarHBondContact O-CB 3.42Å; N52-N54 PolarHBondContact O-N 3.4Å; N52-N54 WeakPolarHBondContact OD1-CA 3.42Å; N52-N54 WeakPolarHBondContact OD1-CB 2.93Å; N52-N54 PolarHBondContact OD1-N 3.25Å; N54-R72 PolarHBondContact O-NH2 3.26Å
55	S	97.3	Very high	96.7	Very high	60 Å²	60	59.9 Å²	59.9	42%	0.42	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-32.9	-176.2	62.2	0	0	0	0	113	N52 N57 R72	N52-S55 WeakPolarHBondContact CB-OG 3.49Å; N52-S55 PolarHBondContact OD1-N 2.86Å; N52-S55 PolarHBondContact OD1-OG 3.32Å; S55-N57 VanDerWaalsContact C-N 3.34Å; S55-N57 WeakPolarHBondContact OG-CB 3.47Å; S55-N57 VanDerWaalsContact OG-CG 3.32Å; S55-N57 PolarHBondContact OG-N 3.38Å; S55-R72 VanDerWaalsContact C-NH2 3.26Å; S55-R72 PolarHBondContact O-NH2 3.02Å
56	G	96.8	Very high	96.7	Very high	19 Å²	19	59 Å²	59	20%	0.196	32%	0.317	C	S	.	.			trans	86.8	5.2	-169.2	0	0	0	0	0	114.5	N52	N52-G56 WeakPolarHBondContact O-CA 3.02Å; N52-G56 PolarHBondContact O-N 3.16Å
57	N	97.4	Very high	96.7	Very high	102 Å²	102	57.9 Å²	57.9	55%	0.545	31%	0.311	S	S	.	.			trans	-61.2	144.8	174.6	-70.1	-3	0	0	0	110	W50 M51 N52 S55	W50-N57 HydrophobicContact CH2-CB 4.12Å; W50-N57 HydrophobicContact CZ3-CB 4.15Å; W50-N57 WeakPolarHBondContact CZ3-O 3.27Å; M51-N57 WeakPolarHBondContact CA-O 3.4Å; N52-N57 HydrophobicContact CB-CB 4.49Å; N52-N57 PolarHBondContact N-O 3.47Å; S55-N57 VanDerWaalsContact C-N 3.34Å; S55-N57 WeakPolarHBondContact OG-CB 3.47Å; S55-N57 VanDerWaalsContact OG-CG 3.32Å; S55-N57 PolarHBondContact OG-N 3.38Å
58	T	97.3	Very high	96.7	Very high	51 Å²	51	54.1 Å²	54.1	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.9	179.9	57.3	0	0	0	0	110.2	W50 M51 Y60 M70	W50-T58 VanDerWaalsContact O-CA 3.25Å; W50-T58 WeakPolarHBondContact O-CA 3.46Å; M51-T58 HydrophobicContact CB-CG2 4.14Å; M51-T58 HydrophobicContact CE-CG2 3.34Å; M51-T58 HydrophobicContact CG-CG2 4.35Å; T58-Y60 WeakPolarHBondContact CB-OH 3.26Å; T58-Y60 VanDerWaalsContact OG1-CE2 3.29Å; T58-Y60 WeakPolarHBondContact OG1-CE2 3.32Å; T58-Y60 PolarHBondContact OG1-OH 3.34Å; T58-M70 HydrophobicContact CG2-CB 4.08Å
59	D	96.5	Very high	96.8	Very high	82 Å²	82	57 Å²	57	44%	0.439	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.8	165.1	-166.4	17.3	0	0	0	109.8	G49 W50	G49-D59 CarbonylContact C-O 3.58Å; G49-D59 WeakPolarHBondContact CA-O 3Å; W50-D59 HydrophobicContact CD2-CB 4.33Å; W50-D59 HydrophobicContact CG-CB 4.5Å; W50-D59 HydrophobicContact CZ2-CB 3.98Å; W50-D59 PolarHBondContact N-O 2.83Å; W50-D59 PolarHBondContact O-N 3.36Å; W50-D59 VanDerWaalsContact O-N 3.1Å
60	Y	97.3	Very high	96.8	Very high	52 Å²	52	57.5 Å²	57.5	20%	0.204	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.1	-173.2	-55.1	-85.6	0	0	0	110.1	T58 V68 M70	T58-Y60 WeakPolarHBondContact CB-OH 3.26Å; T58-Y60 VanDerWaalsContact OG1-CE2 3.29Å; T58-Y60 WeakPolarHBondContact OG1-CE2 3.32Å; T58-Y60 PolarHBondContact OG1-OH 3.34Å; Y60-V68 HydrophobicContact CD1-CB 4.15Å; Y60-V68 HydrophobicContact CD1-CG1 3.98Å; Y60-V68 HydrophobicContact CE1-CB 4.34Å; Y60-V68 HydrophobicContact CE1-CG1 3.91Å; Y60-M70 HydrophobicContact CD1-CE 4.2Å; Y60-M70 HydrophobicContact CE1-CB 4.42Å; Y60-M70 HydrophobicContact CE1-CE 4.19Å; Y60-M70 HydrophobicContact CE1-CG 3.97Å; Y60-M70 HydrophobicContact CE1-SD 4.17Å; Y60-M70 PolarHBondContact OH-N 2.73Å
61	A	96.9	Very high	96.9	Very high	22 Å²	22	56.9 Å²	56.9	18%	0.182	32%	0.321	C	S	.	.			trans	-65.7	141.8	169	0	0	0	0	0	109.6	W47 M48 K63 F64 Q65	W47-A61 HydrophobicContact CE3-CB 3.65Å; W47-A61 HydrophobicContact CZ3-CB 3.74Å; W47-A61 WeakPolarHBondContact O-CB 3.34Å; M48-A61 PolarHBondContact O-N 2.65Å; A61-K63 PolarHBondContact O-N 2.82Å; A61-F64 HydrophobicContact CB-CD2 3.95Å; A61-F64 HydrophobicContact CB-CE2 4.47Å; A61-F64 PolarHBondContact O-N 2.61Å; A61-Q65 PolarHBondContact O-N 2.87Å
62	Q	96.6	Very high	96.9	Very high	176 Å²	176	61 Å²	61	82%	0.822	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-51.3	-36.3	-174.5	-171.3	178.8	2.6	0	0	113.4	F64 Q65	Q62-F64 PolarHBondContact O-N 3.42Å; Q62-Q65 PolarHBondContact O-N 2.76Å
63	K	94.5	Very high	97	Very high	108 Å²	108	62.3 Å²	62.3	47%	0.47	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-61.9	-27.1	178.1	-171.7	-176.8	-179.4	175.5	0	114.1	E46 A61	E46-K63 VanDerWaalsContact CD-NZ 3.29Å; E46-K63 WeakPolarHBondContact OE1-CD 3.49Å; E46-K63 WeakPolarHBondContact OE1-CE 3.41Å; E46-K63 IonicContact OE1-NZ 3.26Å; E46-K63 PolarHBondContact OE1-NZ 2.85Å; E46-K63 IonicContact OE2-NZ 3.98Å; E46-K63 PolarHBondContact OE2-NZ 3.2Å; E46-K63 VanDerWaalsContact OE2-NZ 3.09Å; A61-K63 PolarHBondContact O-N 2.82Å
64	F	95.6	Very high	97	Very high	1 Å²	1	65.6 Å²	65.6	0%	0.004	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-106.2	-7.2	-175.2	-60.7	-68.7	0	0	0	113.5	R38 E46 M48 A61 Q62 G66 R67 V68	R38-F64 HydrophobicContact CG-CZ 4.43Å; R38-F64 VanDerWaalsContact CZ-CE1 3.41Å; R38-F64 VanDerWaalsContact NE-CZ 3.34Å; E46-F64 HydrophobicContact CG-CE2 3.91Å; E46-F64 HydrophobicContact CG-CZ 3.97Å; E46-F64 WeakPolarHBondContact OE2-CZ 3.33Å; M48-F64 HydrophobicContact CB-CD2 3.96Å; M48-F64 HydrophobicContact CB-CE2 4.14Å; M48-F64 HydrophobicContact CB-CG 4.4Å; M48-F64 HydrophobicContact CE-CD1 3.71Å; M48-F64 HydrophobicContact CE-CE1 3.79Å; M48-F64 HydrophobicContact CE-CG 4.16Å; M48-F64 HydrophobicContact CE-CZ 4.3Å; M48-F64 HydrophobicContact CG-CD2 4.02Å; M48-F64 HydrophobicContact CG-CE1 4.35Å; M48-F64 HydrophobicContact CG-CE2 3.73Å; M48-F64 HydrophobicContact CG-CG 4.46Å; M48-F64 HydrophobicContact CG-CZ 3.9Å; A61-F64 HydrophobicContact CB-CD2 3.95Å; A61-F64 HydrophobicContact CB-CE2 4.47Å; A61-F64 PolarHBondContact O-N 2.61Å; Q62-F64 PolarHBondContact O-N 3.42Å; F64-G66 PolarHBondContact O-N 3.02Å; F64-R67 PolarHBondContact O-N 3.39Å; F64-V68 HydrophobicContact CB-CB 4.24Å; F64-V68 HydrophobicContact CB-CG2 3.68Å; F64-V68 HydrophobicContact CD1-CG2 4.22Å; F64-V68 HydrophobicContact CG-CG2 4.23Å; F64-V68 PolarHBondContact O-N 2.76Å
65	Q	94.4	Very high	97	Very high	134 Å²	134	65.5 Å²	65.5	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	133.1	-179.2	-161.3	167.7	18.1	0	0	110.5	A61 Q62 R67	A61-Q65 PolarHBondContact O-N 2.87Å; Q62-Q65 PolarHBondContact O-N 2.76Å; Q65-R67 VanDerWaalsContact C-N 3.25Å; Q65-R67 PolarHBondContact O-N 2.86Å
66	G	95.2	Very high	97.1	Very high	81 Å²	81	66.3 Å²	66.3	84%	0.835	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-6.7	-176.9	0	0	0	0	0	115.7	F64	F64-G66 PolarHBondContact O-N 3.02Å
67	R	97.3	Very high	97.1	Very high	24 Å²	24	67.1 Å²	67.1	9%	0.091	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-31.4	173.3	-57.7	-161	-58.4	144.8	3.1	113.6	F64 Q65 L83 N84 S85 D90	F64-R67 PolarHBondContact O-N 3.39Å; Q65-R67 VanDerWaalsContact C-N 3.25Å; Q65-R67 PolarHBondContact O-N 2.86Å; R67-L83 HydrophobicContact CB-CD1 3.9Å; R67-N84 PolarHBondContact O-N 2.03Å; R67-N84 PolarHBondContact O-ND2 2.93Å; R67-S85 PolarHBondContact NH1-O 2.91Å; R67-D90 IonicContact CZ-OD1 3.75Å; R67-D90 IonicContact CZ-OD2 3.61Å; R67-D90 IonicContact NH1-OD1 3.63Å; R67-D90 IonicContact NH1-OD2 2.75Å; R67-D90 PolarHBondContact NH1-OD2 3.16Å; R67-D90 IonicContact NH2-OD1 2.94Å; R67-D90 PolarHBondContact NH2-OD1 3.1Å; R67-D90 IonicContact NH2-OD2 3.56Å
68	V	98.2	Very high	97.2	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.6	178.7	176.6	0	0	0	0	110.7	M48 Y60 F64 M70 M81 E82 L83	M48-V68 HydrophobicContact CE-CG2 3.7Å; Y60-V68 HydrophobicContact CD1-CB 4.15Å; Y60-V68 HydrophobicContact CD1-CG1 3.98Å; Y60-V68 HydrophobicContact CE1-CB 4.34Å; Y60-V68 HydrophobicContact CE1-CG1 3.91Å; F64-V68 HydrophobicContact CB-CB 4.24Å; F64-V68 HydrophobicContact CB-CG2 3.68Å; F64-V68 HydrophobicContact CD1-CG2 4.22Å; F64-V68 HydrophobicContact CG-CG2 4.23Å; F64-V68 PolarHBondContact O-N 2.76Å; V68-M70 HydrophobicContact CG1-CE 3.87Å; V68-M70 HydrophobicContact CG1-CG 4.22Å; V68-M81 HydrophobicContact CG1-CG 3.74Å; V68-M81 HydrophobicContact CG1-SD 4.15Å; V68-M81 HydrophobicContact CG2-SD 4.46Å; V68-E82 CarbonylContact C-O 3.54Å; V68-E82 WeakPolarHBondContact CA-O 3.48Å; V68-L83 HydrophobicContact CG2-CD1 3.63Å
69	T	98.3	Very high	97.2	Very high	61 Å²	61	60.2 Å²	60.2	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.3	170.4	-58.9	0	0	0	0	108.8	T71 E82	T69-T71 HydrophobicContact CG2-CG2 4.25Å; T69-E82 PolarHBondContact N-O 2.86Å; T69-E82 PolarHBondContact O-N 2.97Å
70	M	98.5	Very high	97.4	Very high	9 Å²	9	58.5 Å²	58.5	4%	0.044	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	135.8	175.4	-65.6	175.8	-169.2	0	0	110.1	W36 M51 T58 Y60 V68 Y80	W36-M70 HydrophobicContact CB-CE 3.87Å; W36-M70 HydrophobicContact CG-CE 4.04Å; M51-M70 HydrophobicContact CB-CB 4.36Å; M51-M70 HydrophobicContact CB-SD 4.39Å; M51-M70 HydrophobicContact CE-CB 3.7Å; M51-M70 WeakPolarHBondContact CE-O 3.37Å; M51-M70 HydrophobicContact SD-CB 4.46Å; T58-M70 HydrophobicContact CG2-CB 4.08Å; Y60-M70 HydrophobicContact CD1-CE 4.2Å; Y60-M70 HydrophobicContact CE1-CB 4.42Å; Y60-M70 HydrophobicContact CE1-CE 4.19Å; Y60-M70 HydrophobicContact CE1-CG 3.97Å; Y60-M70 HydrophobicContact CE1-SD 4.17Å; Y60-M70 PolarHBondContact OH-N 2.73Å; V68-M70 HydrophobicContact CG1-CE 3.87Å; V68-M70 HydrophobicContact CG1-CG 4.22Å; M70-Y80 VanDerWaalsContact CA-O 3.3Å; M70-Y80 WeakPolarHBondContact CA-O 3.14Å
71	T	98.3	Very high	97.4	Very high	54 Å²	54	56 Å²	56	33%	0.331	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	165.3	177.5	58.6	0	0	0	0	110.9	T69 V79 Y80	T69-T71 HydrophobicContact CG2-CG2 4.25Å; T71-V79 CarbonylContact O-C 3.54Å; T71-V79 WeakPolarHBondContact O-CA 3.45Å; T71-Y80 PolarHBondContact N-O 2.92Å; T71-Y80 PolarHBondContact O-N 3.38Å
72	R	98.3	Very high	97.5	Very high	91 Å²	91	58 Å²	58	34%	0.343	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	153.2	-179.8	67.9	-169.9	-164	-75.2	13.7	112.8	M51 P53 N54 S55 T74 T78 V79	M51-R72 HydrophobicContact SD-CB 3.72Å; M51-R72 HydrophobicContact SD-CG 4.25Å; P53-R72 WeakPolarHBondContact O-CD 3.27Å; P53-R72 PolarHBondContact O-NE 3.45Å; N54-R72 PolarHBondContact O-NH2 3.26Å; S55-R72 VanDerWaalsContact C-NH2 3.26Å; S55-R72 PolarHBondContact O-NH2 3.02Å; R72-T74 HydrophobicContact CG-CG2 4.49Å; R72-T78 CarbonylContact C-O 3.51Å; R72-T78 WeakPolarHBondContact CA-O 3.48Å; R72-V79 HydrophobicContact CB-CG1 4.43Å
73	N	98.3	Very high	97.6	Very high	62 Å²	62	49.6 Å²	49.6	33%	0.332	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	103.9	163.5	-174.6	-27.5	0	0	0	108.7	S75 I76 S77 T78 Y80	N73-S75 WeakPolarHBondContact OD1-CB 3.45Å; N73-S75 PolarHBondContact OD1-N 3.43Å; N73-S75 VanDerWaalsContact OD1-N 3.13Å; N73-I76 HydrophobicContact CB-CD1 4.21Å; N73-I76 HydrophobicContact CB-CG1 3.83Å; N73-I76 PolarHBondContact OD1-N 3.28Å; N73-S77 PolarHBondContact O-N 2.91Å; N73-S77 VanDerWaalsContact O-N 3.12Å; N73-T78 PolarHBondContact N-O 3.08Å; N73-T78 PolarHBondContact O-N 2.93Å; N73-Y80 HydrophobicContact CB-CE2 4.12Å
74	T	97.6	Very high	97.7	Very high	69 Å²	69	46.5 Å²	46.5	42%	0.423	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-70.2	-31.8	-176.7	49.6	0	0	0	0	112.3	F29 T30 R72 I76 S77	F29-T74 HydrophobicContact CE1-CG2 4.34Å; T30-T74 HydrophobicContact CG2-CG2 4.16Å; R72-T74 HydrophobicContact CG-CG2 4.49Å; T74-I76 PolarHBondContact O-N 3.17Å; T74-S77 PolarHBondContact O-N 2.87Å
75	S	97.4	Very high	97.8	Very high	111 Å²	111	50 Å²	50	78%	0.776	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-62.7	-27.5	179.5	-54	0	0	0	0	113.4	N73	N73-S75 WeakPolarHBondContact OD1-CB 3.45Å; N73-S75 PolarHBondContact OD1-N 3.43Å; N73-S75 VanDerWaalsContact OD1-N 3.13Å
76	I	97.8	Very high	98	Very high	76 Å²	76	43.7 Å²	43.7	39%	0.39	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-115.4	7.7	177.5	64.6	171.3	0	0	0	113.3	N73 T74 T78	N73-I76 HydrophobicContact CB-CD1 4.21Å; N73-I76 HydrophobicContact CB-CG1 3.83Å; N73-I76 PolarHBondContact OD1-N 3.28Å; T74-I76 PolarHBondContact O-N 3.17Å; I76-T78 PolarHBondContact O-N 2.81Å; I76-T78 PolarHBondContact O-OG1 3.11Å
77	S	98.3	Very high	98.1	Very high	36 Å²	36	45.6 Å²	45.6	25%	0.252	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	46.5	180	-59.4	0	0	0	0	113.8	K23 A24 N73 T74	K23-S77 WeakPolarHBondContact CA-O 3.48Å; A24-S77 PolarHBondContact N-O 2.92Å; A24-S77 WeakPolarHBondContact O-CB 3.38Å; N73-S77 PolarHBondContact O-N 2.91Å; N73-S77 VanDerWaalsContact O-N 3.12Å; T74-S77 PolarHBondContact O-N 2.87Å
78	T	98.7	Very high	98	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.043	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.9	-176.6	-56.3	0	0	0	0	111.3	C22 R72 N73 I76 Y80	C22-T78 WeakPolarHBondContact O-CA 3.28Å; R72-T78 CarbonylContact C-O 3.51Å; R72-T78 WeakPolarHBondContact CA-O 3.48Å; N73-T78 PolarHBondContact N-O 3.08Å; N73-T78 PolarHBondContact O-N 2.93Å; I76-T78 PolarHBondContact O-N 2.81Å; I76-T78 PolarHBondContact O-OG1 3.11Å; T78-Y80 HydrophobicContact CG2-CD1 4.25Å; T78-Y80 HydrophobicContact CG2-CD2 4.35Å; T78-Y80 HydrophobicContact CG2-CE1 3.67Å; T78-Y80 HydrophobicContact CG2-CE2 3.77Å
79	V	98.4	Very high	97.9	Very high	1 Å²	1	53 Å²	53	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.7	162.4	-64.7	0	0	0	0	110.5	C22 F29 I34 W36 M51 P53 T71 R72	C22-V79 HydrophobicContact CB-CG2 3.86Å; C22-V79 PolarHBondContact N-O 2.69Å; C22-V79 PolarHBondContact O-N 2.84Å; F29-V79 HydrophobicContact CE2-CG1 3.81Å; F29-V79 HydrophobicContact CZ-CG1 3.49Å; F29-V79 VanDerWaalsContact CZ-CG1 3.49Å; I34-V79 HydrophobicContact CB-CG1 4.18Å; I34-V79 HydrophobicContact CB-CG2 4.07Å; I34-V79 HydrophobicContact CG1-CG1 4.05Å; I34-V79 HydrophobicContact CG1-CG2 4.32Å; I34-V79 HydrophobicContact CG2-CG2 3.63Å; W36-V79 HydrophobicContact CZ2-CG2 3.95Å; M51-V79 HydrophobicContact SD-CG1 4.16Å; P53-V79 HydrophobicContact CG-CG1 4.33Å; T71-V79 CarbonylContact O-C 3.54Å; T71-V79 WeakPolarHBondContact O-CA 3.45Å; R72-V79 HydrophobicContact CB-CG1 4.43Å
80	Y	98.7	Very high	97.9	Very high	47 Å²	47	50.1 Å²	50.1	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.2	177	-53.2	-90.6	0	0	0	110.1	K19 V20 M70 T71 N73 T78	K19-Y80 HydrophobicContact CD-CD1 4.41Å; K19-Y80 HydrophobicContact CG-CD1 4.33Å; V20-Y80 CarbonylContact O-C 3.54Å; V20-Y80 VanDerWaalsContact O-CA 3.26Å; V20-Y80 WeakPolarHBondContact O-CA 3.33Å; M70-Y80 VanDerWaalsContact CA-O 3.3Å; M70-Y80 WeakPolarHBondContact CA-O 3.14Å; T71-Y80 PolarHBondContact N-O 2.92Å; T71-Y80 PolarHBondContact O-N 3.38Å; N73-Y80 HydrophobicContact CB-CE2 4.12Å; T78-Y80 HydrophobicContact CG2-CD1 4.25Å; T78-Y80 HydrophobicContact CG2-CD2 4.35Å; T78-Y80 HydrophobicContact CG2-CE1 3.67Å; T78-Y80 HydrophobicContact CG2-CE2 3.77Å
81	M	98.6	Very high	97.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.2	166.6	-179	-76.3	-63	0	0	108.1	K19 V20 W36 M48 V68 L83 Y94	K19-M81 CarbonylContact C-O 3.6Å; K19-M81 WeakPolarHBondContact CA-O 3.5Å; V20-M81 HydrophobicContact CB-CE 4.23Å; V20-M81 HydrophobicContact CG2-CE 3.89Å; V20-M81 PolarHBondContact N-O 3.09Å; V20-M81 PolarHBondContact O-N 2.81Å; W36-M81 HydrophobicContact CD2-CB 3.52Å; W36-M81 HydrophobicContact CD2-CG 4.15Å; W36-M81 HydrophobicContact CE3-CB 4.04Å; W36-M81 HydrophobicContact CG-CB 3.85Å; W36-M81 HydrophobicContact CG-CG 4.08Å; W36-M81 HydrophobicContact CH2-CB 4.27Å; W36-M81 HydrophobicContact CZ2-CB 3.78Å; W36-M81 HydrophobicContact CZ3-CB 4.39Å; M48-M81 HydrophobicContact CE-CE 4.49Å; M48-M81 HydrophobicContact CE-SD 4.32Å; V68-M81 HydrophobicContact CG1-CG 3.74Å; V68-M81 HydrophobicContact CG1-SD 4.15Å; V68-M81 HydrophobicContact CG2-SD 4.46Å; M81-L83 HydrophobicContact SD-CB 3.79Å; M81-Y94 HydrophobicContact CE-CD1 3.46Å; M81-Y94 VanDerWaalsContact CE-CD1 3.46Å; M81-Y94 HydrophobicContact CE-CE1 3.92Å; M81-Y94 HydrophobicContact CE-CG 4.16Å
82	E	98.6	Very high	97.9	Very high	62 Å²	62	49.2 Å²	49.2	29%	0.29	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.2	172.2	-175.4	163.8	-165	0	0	109.2	V18 K19 V68 T69	V18-E82 CarbonylContact O-C 3.59Å; V18-E82 VanDerWaalsContact O-CA 3.26Å; V18-E82 WeakPolarHBondContact O-CA 3.36Å; K19-E82 HydrophobicContact CG-CB 4.47Å; V68-E82 CarbonylContact C-O 3.54Å; V68-E82 WeakPolarHBondContact CA-O 3.48Å; T69-E82 PolarHBondContact N-O 2.86Å; T69-E82 PolarHBondContact O-N 2.97Å
83	L	98.4	Very high	97.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117	174.6	176.8	61.5	0	0	0	108.7	S17 V18 R67 V68 M81 L86 D90 Y94	S17-L83 WeakPolarHBondContact CA-O 3.15Å; V18-L83 HydrophobicContact CG1-CB 4.12Å; V18-L83 PolarHBondContact N-O 3.39Å; V18-L83 VanDerWaalsContact N-O 3.08Å; V18-L83 PolarHBondContact O-N 3.06Å; R67-L83 HydrophobicContact CB-CD1 3.9Å; V68-L83 HydrophobicContact CG2-CD1 3.63Å; M81-L83 HydrophobicContact SD-CB 3.79Å; L83-L86 HydrophobicContact CB-CD2 4.36Å; L83-L86 HydrophobicContact CD2-CD2 3.58Å; L83-L86 HydrophobicContact CG-CD2 3.77Å; L83-D90 HydrophobicContact CD2-CB 3.93Å; L83-Y94 HydrophobicContact CD2-CE1 4.18Å; L83-Y94 WeakPolarHBondContact CD2-OH 3.16Å
84	N	98.1	Very high	97.9	Very high	44 Å²	44	43.7 Å²	43.7	24%	0.235	25%	0.246	C	C	.	.			trans	-95.7	158.2	-177.8	-64.6	-61.4	0	0	0	112.1	S17 R67 L86	S17-N84 WeakPolarHBondContact CB-OD1 3.17Å; S17-N84 PolarHBondContact OG-OD1 2.82Å; R67-N84 PolarHBondContact O-N 2.03Å; R67-N84 PolarHBondContact O-ND2 2.93Å; N84-L86 PolarHBondContact O-N 3.03Å
85	S	97.1	Very high	98	Very high	73 Å²	73	42.6 Å²	42.6	51%	0.51	23%	0.234	S	C	.	.	S	Bend	trans	53.4	54.6	176.2	-57.1	0	0	0	0	111.8	A16 R67	A16-S85 PolarHBondContact O-N 3.08Å; R67-S85 PolarHBondContact NH1-O 2.91Å
86	L	98	Very high	98	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	20%	0.197	C	C	.	.			trans	-57.1	136.5	-176.1	-76.1	170.2	0	0	0	112	K12 P14 G15 A16 V18 L83 N84 D90 V118	K12-L86 HydrophobicContact CB-CD1 3.63Å; K12-L86 HydrophobicContact CG-CD1 3.82Å; P14-L86 CarbonylContact C-O 3.6Å; P14-L86 WeakPolarHBondContact CA-O 3.24Å; G15-L86 PolarHBondContact N-O 3.39Å; A16-L86 VanDerWaalsContact O-CB 3.31Å; A16-L86 WeakPolarHBondContact O-CB 3.37Å; A16-L86 VanDerWaalsContact O-CG 3.24Å; A16-L86 WeakPolarHBondContact O-CG 3.35Å; A16-L86 PolarHBondContact O-N 2.83Å; V18-L86 HydrophobicContact CB-CD1 4Å; V18-L86 HydrophobicContact CG1-CD1 4.02Å; V18-L86 HydrophobicContact CG1-CD2 4.03Å; V18-L86 HydrophobicContact CG1-CG 4.48Å; L83-L86 HydrophobicContact CB-CD2 4.36Å; L83-L86 HydrophobicContact CD2-CD2 3.58Å; L83-L86 HydrophobicContact CG-CD2 3.77Å; N84-L86 PolarHBondContact O-N 3.03Å; L86-D90 HydrophobicContact CD2-CB 3.88Å; L86-V118 HydrophobicContact CB-CG1 4.2Å; L86-V118 HydrophobicContact CB-CG2 4.03Å; L86-V118 HydrophobicContact CD1-CG2 4.3Å; L86-V118 HydrophobicContact CD2-CG2 4.14Å; L86-V118 HydrophobicContact CG-CG2 4.4Å
87	R	96.8	Very high	98	Very high	121 Å²	121	33.7 Å²	33.7	46%	0.457	18%	0.179	S	C	.	.			trans	-115	162	176.1	-61.3	170.4	-172	175.7	0.1	109.5	E89 D90 V118	R87-E89 HydrophobicContact CB-CG 3.78Å; R87-E89 WeakPolarHBondContact CD-OE1 3.32Å; R87-E89 IonicContact CZ-OE1 3.91Å; R87-E89 IonicContact NE-OE1 3.97Å; R87-E89 IonicContact NH1-OE1 3Å; R87-E89 PolarHBondContact NH1-OE1 3Å; R87-E89 PolarHBondContact O-N 2.96Å; R87-D90 PolarHBondContact N-OD2 2.61Å; R87-D90 WeakPolarHBondContact O-CB 3.26Å; R87-D90 PolarHBondContact O-N 2.85Å; R87-V118 WeakPolarHBondContact O-CB 3.45Å; R87-V118 WeakPolarHBondContact O-CG1 3.43Å; R87-V118 WeakPolarHBondContact O-CG2 3.45Å
88	S	96.2	Very high	97.9	Very high	87 Å²	87	32.3 Å²	32.3	61%	0.608	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-54.9	-38.2	175.4	50.9	0	0	0	0	112.1	D90 T91	S88-D90 PolarHBondContact O-N 2.84Å; S88-T91 WeakPolarHBondContact O-CB 3.4Å; S88-T91 PolarHBondContact O-N 2.95Å; S88-T91 VanDerWaalsContact O-N 3.11Å; S88-T91 PolarHBondContact O-OG1 2.86Å; S88-T91 VanDerWaalsContact O-OG1 3.08Å
89	E	95.7	Very high	97.5	Very high	100 Å²	100	32.7 Å²	32.7	47%	0.467	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-64.4	-13	175.6	73.6	-155.5	-156.4	0	0	114.5	R87 T91	R87-E89 HydrophobicContact CB-CG 3.78Å; R87-E89 WeakPolarHBondContact CD-OE1 3.32Å; R87-E89 IonicContact CZ-OE1 3.91Å; R87-E89 IonicContact NE-OE1 3.97Å; R87-E89 IonicContact NH1-OE1 3Å; R87-E89 PolarHBondContact NH1-OE1 3Å; R87-E89 PolarHBondContact O-N 2.96Å; E89-T91 VanDerWaalsContact C-N 3.27Å
90	D	97.6	Very high	96.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-86.4	3	174.8	-60.3	-45.4	0	0	0	112.5	R38 R67 L83 L86 R87 S88 A92 Y94 V118	R38-D90 IonicContact CZ-OD1 2.82Å; R38-D90 IonicContact NH1-OD1 3.09Å; R38-D90 PolarHBondContact NH1-OD1 2.98Å; R67-D90 IonicContact CZ-OD1 3.75Å; R67-D90 IonicContact CZ-OD2 3.61Å; R67-D90 IonicContact NH1-OD1 3.63Å; R67-D90 IonicContact NH1-OD2 2.75Å; R67-D90 PolarHBondContact NH1-OD2 3.16Å; R67-D90 IonicContact NH2-OD1 2.94Å; R67-D90 PolarHBondContact NH2-OD1 3.1Å; R67-D90 IonicContact NH2-OD2 3.56Å; L83-D90 HydrophobicContact CD2-CB 3.93Å; L86-D90 HydrophobicContact CD2-CB 3.88Å; R87-D90 PolarHBondContact N-OD2 2.61Å; R87-D90 WeakPolarHBondContact O-CB 3.26Å; R87-D90 PolarHBondContact O-N 2.85Å; S88-D90 PolarHBondContact O-N 2.84Å; D90-A92 PolarHBondContact O-N 2.83Å; D90-A92 VanDerWaalsContact O-N 3.16Å; D90-Y94 WeakPolarHBondContact O-CE2 3.39Å; D90-Y94 PolarHBondContact O-OH 2.79Å; D90-V118 HydrophobicContact CB-CG2 4.42Å
91	T	98.6	Very high	95.9	Very high	38 Å²	38	36.5 Å²	36.5	23%	0.233	20%	0.195	C	C	.	.			trans	-66.8	111	169.6	-63.6	0	0	0	0	110.3	S88 E89 V116 T117 V118	S88-T91 WeakPolarHBondContact O-CB 3.4Å; S88-T91 PolarHBondContact O-N 2.95Å; S88-T91 VanDerWaalsContact O-N 3.11Å; S88-T91 PolarHBondContact O-OG1 2.86Å; S88-T91 VanDerWaalsContact O-OG1 3.08Å; E89-T91 VanDerWaalsContact C-N 3.27Å; T91-V116 WeakPolarHBondContact CA-O 2.99Å; T91-T117 HydrophobicContact CG2-CG2 4.36Å; T91-V118 PolarHBondContact OG1-N 2.94Å
92	A	98.6	Very high	94.8	Very high	5 Å²	5	41.4 Å²	41.4	4%	0.041	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	169.5	-175.4	0	0	0	0	0	111.2	R38 Q39 A40 D90 Y94 V116	R38-A92 HydrophobicContact CB-CB 4.09Å; Q39-A92 WeakPolarHBondContact O-CA 3.46Å; Q39-A92 WeakPolarHBondContact O-CB 3.41Å; A40-A92 HydrophobicContact CB-CB 4.36Å; D90-A92 PolarHBondContact O-N 2.83Å; D90-A92 VanDerWaalsContact O-N 3.16Å; A92-Y94 HydrophobicContact CB-CD2 4.31Å; A92-Y94 HydrophobicContact CB-CE2 3.75Å; A92-Y94 WeakPolarHBondContact O-CD2 3.3Å; A92-V116 PolarHBondContact N-O 2.9Å; A92-V116 VanDerWaalsContact N-O 3.14Å; A92-V116 PolarHBondContact O-N 3.22Å
93	V	98.8	Very high	93.2	Very high	38 Å²	38	40 Å²	40	23%	0.23	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.9	158.9	-171.1	0	0	0	0	108.2	R38 Q39 Y95 K115	R38-V93 CarbonylContact C-O 3.57Å; R38-V93 VanDerWaalsContact CA-O 3.28Å; R38-V93 WeakPolarHBondContact CA-O 3.32Å; Q39-V93 PolarHBondContact N-O 3.36Å; Q39-V93 PolarHBondContact O-N 3.03Å; V93-Y95 HydrophobicContact CB-CE2 3.82Å; V93-Y95 HydrophobicContact CG1-CD1 4.36Å; V93-Y95 HydrophobicContact CG1-CD2 4.37Å; V93-Y95 HydrophobicContact CG1-CE1 3.67Å; V93-Y95 HydrophobicContact CG1-CE2 3.71Å; V93-Y95 WeakPolarHBondContact CG1-OH 3.09Å; V93-K115 HydrophobicContact CG2-CB 4.45Å
94	Y	98.8	Very high	91.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.7	180	-68.3	-99.2	0	0	0	109	Q6 V37 R38 M48 M81 L83 D90 A92 G113 S114 V116	Q6-Y94 PolarHBondContact NE2-O 2.95Å; V37-Y94 CarbonylContact O-C 3.56Å; R38-Y94 HydrophobicContact CB-CD1 3.85Å; R38-Y94 HydrophobicContact CB-CE1 3.88Å; R38-Y94 HydrophobicContact CB-CG 4.36Å; M48-Y94 HydrophobicContact CE-CD1 4.23Å; M48-Y94 HydrophobicContact CE-CE1 3.73Å; M48-Y94 HydrophobicContact SD-CD1 3.63Å; M48-Y94 HydrophobicContact SD-CE1 3.64Å; M81-Y94 HydrophobicContact CE-CD1 3.46Å; M81-Y94 VanDerWaalsContact CE-CD1 3.46Å; M81-Y94 HydrophobicContact CE-CE1 3.92Å; M81-Y94 HydrophobicContact CE-CG 4.16Å; L83-Y94 HydrophobicContact CD2-CE1 4.18Å; L83-Y94 WeakPolarHBondContact CD2-OH 3.16Å; D90-Y94 WeakPolarHBondContact O-CE2 3.39Å; D90-Y94 PolarHBondContact O-OH 2.79Å; A92-Y94 HydrophobicContact CB-CD2 4.31Å; A92-Y94 HydrophobicContact CB-CE2 3.75Å; A92-Y94 WeakPolarHBondContact O-CD2 3.3Å; Y94-G113 CarbonylContact O-C 3.59Å; Y94-G113 VanDerWaalsContact O-CA 3.31Å; Y94-G113 WeakPolarHBondContact O-CA 3.47Å; Y94-S114 PolarHBondContact N-O 2.84Å; Y94-S114 PolarHBondContact O-N 3.47Å; Y94-V116 HydrophobicContact CD2-CB 3.96Å; Y94-V116 HydrophobicContact CD2-CG2 3.7Å; Y94-V116 HydrophobicContact CE2-CB 3.7Å; Y94-V116 HydrophobicContact CE2-CG2 3.89Å
95	Y	98.7	Very high	90.3	Very high	45 Å²	45	54.6 Å²	54.6	18%	0.176	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.8	-178.1	-56.1	-85.2	0	0	0	109.9	W36 V37 Q39 V93 W110 G113	W36-Y95 WeakPolarHBondContact CA-O 3.45Å; V37-Y95 PolarHBondContact N-O 2.9Å; V37-Y95 PolarHBondContact O-N 2.83Å; Q39-Y95 HydrophobicContact CB-CE2 3.93Å; V93-Y95 HydrophobicContact CB-CE2 3.82Å; V93-Y95 HydrophobicContact CG1-CD1 4.36Å; V93-Y95 HydrophobicContact CG1-CD2 4.37Å; V93-Y95 HydrophobicContact CG1-CE1 3.67Å; V93-Y95 HydrophobicContact CG1-CE2 3.71Å; V93-Y95 WeakPolarHBondContact CG1-OH 3.09Å; Y95-W110 HydrophobicContact CG-CE3 4.32Å; Y95-W110 HydrophobicContact CG-CZ3 4.48Å; Y95-G113 VanDerWaalsContact CE1-CA 3.5Å
96	C	98.2	Very high	89.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	144.6	158.2	60.2	0	0	0	0	109.4	Q6 C22 I34 N35 W36 G111	Q6-C96 WeakPolarHBondContact CG-SG 3.35Å; C22-C96 HydrophobicContact CB-CB 3.49Å; C22-C96 VanDerWaalsContact CB-CB 3.49Å; C22-C96 WeakPolarHBondContact CB-SG 3.37Å; C22-C96 WeakPolarHBondContact SG-CB 3.25Å; C22-C96 CovalentContact SG-SG 2.03Å; C22-C96 PolarHBondContact SG-SG 2.74Å; I34-C96 HydrophobicContact CG2-CB 3.98Å; N35-C96 CarbonylContact O-C 3.58Å; N35-C96 VanDerWaalsContact O-CA 3.27Å; N35-C96 WeakPolarHBondContact O-CA 3.46Å; W36-C96 HydrophobicContact CD2-CB 4.37Å; W36-C96 HydrophobicContact CE3-CB 4.17Å; W36-C96 HydrophobicContact CH2-CB 4.04Å; W36-C96 HydrophobicContact CZ2-CB 4.24Å; W36-C96 HydrophobicContact CZ3-CB 3.99Å; C96-G111 PolarHBondContact O-N 3.29Å
97	A	97.4	Very high	89.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	139.9	178.1	0	0	0	0	0	110.8	I34 N35 F107 Y109 W110	I34-A97 CarbonylContact C-O 3.58Å; I34-A97 WeakPolarHBondContact CA-O 3.12Å; N35-A97 HydrophobicContact CB-CB 4.46Å; N35-A97 PolarHBondContact N-O 3.38Å; N35-A97 PolarHBondContact O-N 3.1Å; A97-F107 HydrophobicContact CB-CB 4.08Å; A97-F107 HydrophobicContact CB-CD1 4.26Å; A97-F107 HydrophobicContact CB-CD2 4.28Å; A97-F107 HydrophobicContact CB-CG 3.94Å; A97-Y109 CarbonylContact C-O 3.57Å; A97-Y109 VanDerWaalsContact CA-O 3.27Å; A97-Y109 WeakPolarHBondContact CA-O 3.18Å; A97-W110 HydrophobicContact CB-CD2 3.8Å; A97-W110 HydrophobicContact CB-CE3 3.75Å; A97-W110 HydrophobicContact CB-CG 4.39Å; A97-W110 HydrophobicContact CB-CH2 4.26Å; A97-W110 HydrophobicContact CB-CZ2 4.33Å; A97-W110 HydrophobicContact CB-CZ3 3.97Å
98	R	95.6	Very high	88.9	Confident	8 Å²	8	53.3 Å²	53.3	3%	0.03	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	141.2	174.1	-167.3	-172.5	80.9	162.5	15.8	109.6	L4 Y32 I34 D101 F107 D108 Y109	L4-R98 HydrophobicContact CD1-CB 4.39Å; Y32-R98 HydrophobicContact CD1-CG 4.26Å; Y32-R98 HydrophobicContact CG-CG 3.94Å; I34-R98 HydrophobicContact CD1-CB 4.3Å; I34-R98 HydrophobicContact CD1-CG 4.24Å; R98-D101 IonicContact NH2-OD2 3.99Å; R98-F107 WeakPolarHBondContact O-CA 3.32Å; R98-D108 IonicContact CZ-OD1 3.74Å; R98-D108 IonicContact CZ-OD2 3.37Å; R98-D108 IonicContact NE-OD1 3.02Å; R98-D108 PolarHBondContact NE-OD1 2.9Å; R98-D108 IonicContact NE-OD2 3.42Å; R98-D108 PolarHBondContact NE-OD2 3.29Å; R98-D108 IonicContact NH2-OD1 3.74Å; R98-D108 IonicContact NH2-OD2 2.61Å; R98-D108 PolarHBondContact NH2-OD2 2.73Å; R98-D108 PolarHBondContact O-N 3.46Å; R98-Y109 VanDerWaalsContact CZ-CD2 3.44Å; R98-Y109 VanDerWaalsContact CZ-CE2 3.43Å; R98-Y109 PolarHBondContact N-O 2.8Å; R98-Y109 VanDerWaalsContact NH2-CE2 3.34Å
99	V	91.8	Very high	88.9	Confident	14 Å²	14	53.5 Å²	53.5	9%	0.085	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.9	166.9	70.6	0	0	0	0	110.6	Y32 D33 G103	Y32-V99 HydrophobicContact CD1-CG1 4.11Å; Y32-V99 WeakPolarHBondContact CD1-O 3.29Å; D33-V99 HydrophobicContact CB-CG1 4.02Å; D33-V99 PolarHBondContact O-N 3.19Å; D33-V99 VanDerWaalsContact O-N 3.11Å; V99-G103 WeakPolarHBondContact CG2-O 3.5Å
100	G	84.9	Confident	89	Confident	6 Å²	6	53.5 Å²	53.5	6%	0.062	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	160.9	178.2	0	0	0	0	0	113.7	S102 G103 S106 D108	G100-S102 PolarHBondContact O-N 3.49Å; G100-S102 VanDerWaalsContact O-N 3.17Å; G100-G103 PolarHBondContact O-N 2.93Å; G100-S106 PolarHBondContact N-O 3.01Å; G100-D108 WeakPolarHBondContact CA-OD2 3.49Å
101	D	77.1	Confident	89	Confident	123 Å²	123	53.8 Å²	53.8	66%	0.658	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.2	178.8	-66.2	-52.9	0	0	0	113.3	Y32 R98 G103	Y32-D101 WeakPolarHBondContact CE1-OD1 3.49Å; Y32-D101 VanDerWaalsContact CZ-OD1 3.29Å; Y32-D101 PolarHBondContact OH-OD1 2.84Å; R98-D101 IonicContact NH2-OD2 3.99Å; D101-G103 VanDerWaalsContact C-N 3.29Å; D101-G103 PolarHBondContact O-N 3.07Å
102	S	75.9	Confident	88.9	Confident	103 Å²	103	57.3 Å²	57.3	72%	0.72	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	0.4	180	56.6	0	0	0	0	114.7	G100	G100-S102 PolarHBondContact O-N 3.49Å; G100-S102 VanDerWaalsContact O-N 3.17Å
103	G	65.6	Low	88.9	Confident	32 Å²	32	57.8 Å²	57.8	33%	0.33	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.4	177.4	176.5	0	0	0	0	0	114.7	V99 G100 D101 D105 S106	V99-G103 WeakPolarHBondContact CG2-O 3.5Å; G100-G103 PolarHBondContact O-N 2.93Å; D101-G103 VanDerWaalsContact C-N 3.29Å; D101-G103 PolarHBondContact O-N 3.07Å; G103-D105 PolarHBondContact O-N 3.14Å; G103-S106 PolarHBondContact O-N 2.82Å
104	Y	65.6	Low	88.9	Confident	183 Å²	183	56 Å²	56	72%	0.718	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	-15.6	-169.3	-65.6	-74.4	0	0	0	116
105	D	69.2	Low	88.9	Confident	168 Å²	168	61.7 Å²	61.7	90%	0.898	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	1.5	-173.5	-60	-39	0	0	0	114.3	G103	G103-D105 PolarHBondContact O-N 3.14Å
106	S	81.8	Confident	88.9	Confident	51 Å²	51	59.6 Å²	59.6	36%	0.357	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.4	-179.1	-168.8	0	0	0	0	112.2	G100 G103	G100-S106 PolarHBondContact N-O 3.01Å; G103-S106 PolarHBondContact O-N 2.82Å
107	F	91	Very high	88.9	Confident	61 Å²	61	61.5 Å²	61.5	27%	0.268	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	120.3	173.2	-57.4	-41.3	0	0	0	110.1	N35 V37 A97 R98 W110	N35-F107 HydrophobicContact CB-CE1 3.79Å; N35-F107 HydrophobicContact CB-CZ 3.93Å; N35-F107 WeakPolarHBondContact ND2-CE1 3.43Å; V37-F107 HydrophobicContact CG2-CE2 4.27Å; A97-F107 HydrophobicContact CB-CB 4.08Å; A97-F107 HydrophobicContact CB-CD1 4.26Å; A97-F107 HydrophobicContact CB-CD2 4.28Å; A97-F107 HydrophobicContact CB-CG 3.94Å; R98-F107 WeakPolarHBondContact O-CA 3.32Å; F107-W110 HydrophobicContact CB-CZ2 3.79Å; F107-W110 AromaticContact CD2-CH2 3.74Å; F107-W110 HydrophobicContact CD2-CH2 3.74Å; F107-W110 AromaticContact CD2-CZ2 3.41Å; F107-W110 HydrophobicContact CD2-CZ2 3.41Å; F107-W110 VanDerWaalsContact CD2-CZ2 3.41Å; F107-W110 HydrophobicContact CE2-CH2 4.32Å; F107-W110 HydrophobicContact CE2-CZ2 4.39Å; F107-W110 HydrophobicContact CG-CZ2 4.02Å
108	D	90.9	Very high	89	Confident	57 Å²	57	62 Å²	62	31%	0.305	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-28.6	-173.5	58.7	-4.8	0	0	0	113.8	R98 G100	R98-D108 IonicContact CZ-OD1 3.74Å; R98-D108 IonicContact CZ-OD2 3.37Å; R98-D108 IonicContact NE-OD1 3.02Å; R98-D108 PolarHBondContact NE-OD1 2.9Å; R98-D108 IonicContact NE-OD2 3.42Å; R98-D108 PolarHBondContact NE-OD2 3.29Å; R98-D108 IonicContact NH2-OD1 3.74Å; R98-D108 IonicContact NH2-OD2 2.61Å; R98-D108 PolarHBondContact NH2-OD2 2.73Å; R98-D108 PolarHBondContact O-N 3.46Å; G100-D108 WeakPolarHBondContact CA-OD2 3.49Å
109	Y	95.2	Very high	89	Confident	91 Å²	91	64.1 Å²	64.1	36%	0.357	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.1	174.1	-59.8	-81.5	0	0	0	111.6	V2 L4 A97 R98	V2-Y109 HydrophobicContact CB-CD1 3.82Å; V2-Y109 HydrophobicContact CB-CD2 4.29Å; V2-Y109 HydrophobicContact CB-CE1 3.58Å; V2-Y109 HydrophobicContact CB-CE2 4.1Å; V2-Y109 HydrophobicContact CB-CG 4.16Å; V2-Y109 HydrophobicContact CG1-CD1 3.59Å; V2-Y109 HydrophobicContact CG1-CD2 3.61Å; V2-Y109 HydrophobicContact CG1-CE1 3.85Å; V2-Y109 HydrophobicContact CG1-CE2 3.89Å; V2-Y109 HydrophobicContact CG1-CG 3.46Å; V2-Y109 VanDerWaalsContact CG1-CG 3.46Å; V2-Y109 HydrophobicContact CG2-CE1 4.29Å; V2-Y109 HydrophobicContact CG2-CE2 4.19Å; L4-Y109 WeakPolarHBondContact CD1-O 3.46Å; A97-Y109 CarbonylContact C-O 3.57Å; A97-Y109 VanDerWaalsContact CA-O 3.27Å; A97-Y109 WeakPolarHBondContact CA-O 3.18Å; R98-Y109 VanDerWaalsContact CZ-CD2 3.44Å; R98-Y109 VanDerWaalsContact CZ-CE2 3.43Å; R98-Y109 PolarHBondContact N-O 2.8Å; R98-Y109 VanDerWaalsContact NH2-CE2 3.34Å
110	W	97.4	Very high	88.8	Confident	101 Å²	101	70.5 Å²	70.5	38%	0.383	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.7	-179.9	-68.6	78.3	0	0	0	110.5	V37 L45 Y95 A97 F107	V37-W110 HydrophobicContact CB-CH2 4.37Å; V37-W110 HydrophobicContact CB-CZ3 4.01Å; V37-W110 HydrophobicContact CG1-CH2 4.38Å; V37-W110 HydrophobicContact CG1-CZ3 4.3Å; V37-W110 HydrophobicContact CG2-CH2 4.07Å; V37-W110 HydrophobicContact CG2-CZ3 4.04Å; L45-W110 HydrophobicContact CD1-CH2 4.02Å; Y95-W110 HydrophobicContact CG-CE3 4.32Å; Y95-W110 HydrophobicContact CG-CZ3 4.48Å; A97-W110 HydrophobicContact CB-CD2 3.8Å; A97-W110 HydrophobicContact CB-CE3 3.75Å; A97-W110 HydrophobicContact CB-CG 4.39Å; A97-W110 HydrophobicContact CB-CH2 4.26Å; A97-W110 HydrophobicContact CB-CZ2 4.33Å; A97-W110 HydrophobicContact CB-CZ3 3.97Å; F107-W110 HydrophobicContact CB-CZ2 3.79Å; F107-W110 AromaticContact CD2-CH2 3.74Å; F107-W110 HydrophobicContact CD2-CH2 3.74Å; F107-W110 AromaticContact CD2-CZ2 3.41Å; F107-W110 HydrophobicContact CD2-CZ2 3.41Å; F107-W110 VanDerWaalsContact CD2-CZ2 3.41Å; F107-W110 HydrophobicContact CE2-CH2 4.32Å; F107-W110 HydrophobicContact CE2-CZ2 4.39Å; F107-W110 HydrophobicContact CG-CZ2 4.02Å
111	G	97.9	Very high	89	Confident	6 Å²	6	73.8 Å²	73.8	6%	0.062	40%	0.399	C	S	.	.			trans	-72.5	163	165.2	0	0	0	0	0	111.5	L4 Q6 C96 G113	L4-G111 WeakPolarHBondContact O-CA 3.47Å; Q6-G111 VanDerWaalsContact OE1-C 3.25Å; Q6-G111 VanDerWaalsContact OE1-CA 3.26Å; C96-G111 PolarHBondContact O-N 3.29Å; G111-G113 PolarHBondContact O-N 3.2Å; G111-G113 VanDerWaalsContact O-N 3.16Å
112	Q	97.6	Very high	89.6	Confident	111 Å²	111	71.2 Å²	71.2	52%	0.519	39%	0.385	S	S	.	.			trans	-69.1	-11.7	-176.9	78.5	-75.2	-2.9	0	0	114.2	L4 Q6	L4-Q112 PolarHBondContact O-OE1 3.21Å; Q6-Q112 VanDerWaalsContact N-NE2 3.15Å; Q6-Q112 PolarHBondContact O-NE2 2.9Å
113	G	98.3	Very high	90.3	Very high	15 Å²	15	69.4 Å²	69.4	16%	0.155	37%	0.367	C	S	.	.			trans	90.1	138.8	-175.5	0	0	0	0	0	113.7	Y94 Y95 G111	Y94-G113 CarbonylContact O-C 3.59Å; Y94-G113 VanDerWaalsContact O-CA 3.31Å; Y94-G113 WeakPolarHBondContact O-CA 3.47Å; Y95-G113 VanDerWaalsContact CE1-CA 3.5Å; G111-G113 PolarHBondContact O-N 3.2Å; G111-G113 VanDerWaalsContact O-N 3.16Å
114	S	98.6	Very high	91.8	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.007	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.9	172.3	-56.6	0	0	0	0	108.7	Q6 S7 V20 Y94 V116	Q6-S114 VanDerWaalsContact CB-OG 3.31Å; Q6-S114 WeakPolarHBondContact CB-OG 3.22Å; Q6-S114 PolarHBondContact NE2-OG 3.32Å; S7-S114 WeakPolarHBondContact O-CB 3.46Å; S7-S114 PolarHBondContact O-OG 3.19Å; V20-S114 WeakPolarHBondContact CG1-OG 3.36Å; Y94-S114 PolarHBondContact N-O 2.84Å; Y94-S114 PolarHBondContact O-N 3.47Å; S114-V116 PolarHBondContact O-N 3.47Å
115	K	98.5	Very high	93.4	Very high	119 Å²	119	64.6 Å²	64.6	52%	0.517	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119.2	175.7	-175.8	177.5	-180	179.3	0	109.7	A9 E10 V93	A9-K115 CarbonylContact C-O 3.51Å; A9-K115 WeakPolarHBondContact CA-O 3.21Å; A9-K115 HydrophobicContact CB-CB 4.04Å; A9-K115 WeakPolarHBondContact CB-O 3.35Å; E10-K115 PolarHBondContact N-O 3.12Å; V93-K115 HydrophobicContact CG2-CB 4.45Å
116	V	98.6	Very high	95	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.6	169.6	-178.8	0	0	0	0	108.2	E10 V18 V20 T91 A92 Y94 S114 V118	E10-V116 CarbonylContact O-C 3.6Å; E10-V116 WeakPolarHBondContact O-CA 3.47Å; V18-V116 HydrophobicContact CB-CG1 4.43Å; V18-V116 HydrophobicContact CG1-CG1 4.18Å; V18-V116 HydrophobicContact CG1-CG2 4.31Å; V18-V116 HydrophobicContact CG2-CG1 4.32Å; V18-V116 HydrophobicContact CG2-CG2 3.96Å; V20-V116 HydrophobicContact CG2-CG2 4.29Å; T91-V116 WeakPolarHBondContact CA-O 2.99Å; A92-V116 PolarHBondContact N-O 2.9Å; A92-V116 VanDerWaalsContact N-O 3.14Å; A92-V116 PolarHBondContact O-N 3.22Å; Y94-V116 HydrophobicContact CD2-CB 3.96Å; Y94-V116 HydrophobicContact CD2-CG2 3.7Å; Y94-V116 HydrophobicContact CE2-CB 3.7Å; Y94-V116 HydrophobicContact CE2-CG2 3.89Å; S114-V116 PolarHBondContact O-N 3.47Å; V116-V118 HydrophobicContact CG1-CG2 4.45Å
117	T	98.6	Very high	96	Very high	39 Å²	39	58.2 Å²	58.2	24%	0.239	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.3	175.7	-51.8	0	0	0	0	109.4	E10 V11 K12 T91	E10-T117 PolarHBondContact O-N 2.83Å; V11-T117 CarbonylContact C-O 3.51Å; V11-T117 WeakPolarHBondContact CA-O 3Å; K12-T117 PolarHBondContact N-O 3.13Å; T91-T117 HydrophobicContact CG2-CG2 4.36Å
118	V	98.3	Very high	96.4	Very high	10 Å²	10	58 Å²	58	6%	0.061	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	106.5	177.5	-172.2	0	0	0	0	109	K12 P14 L86 R87 D90 T91 V116	K12-V118 CarbonylContact O-C 3.47Å; K12-V118 VanDerWaalsContact O-CA 3.29Å; K12-V118 WeakPolarHBondContact O-CA 3.34Å; P14-V118 HydrophobicContact CB-CG1 4.41Å; P14-V118 HydrophobicContact CG-CG1 4.07Å; L86-V118 HydrophobicContact CB-CG1 4.2Å; L86-V118 HydrophobicContact CB-CG2 4.03Å; L86-V118 HydrophobicContact CD1-CG2 4.3Å; L86-V118 HydrophobicContact CD2-CG2 4.14Å; L86-V118 HydrophobicContact CG-CG2 4.4Å; R87-V118 WeakPolarHBondContact O-CB 3.45Å; R87-V118 WeakPolarHBondContact O-CG1 3.43Å; R87-V118 WeakPolarHBondContact O-CG2 3.45Å; D90-V118 HydrophobicContact CB-CG2 4.42Å; T91-V118 PolarHBondContact OG1-N 2.94Å; V116-V118 HydrophobicContact CG1-CG2 4.45Å
119	S	95.9	Very high	96.8	Very high	54 Å²	54	58.1 Å²	58.1	38%	0.378	31%	0.31	S	S	.	.			trans	-142.7	149	-176.5	60.6	0	0	0	0	111.7	V11 K12 K13	V11-S119 WeakPolarHBondContact CG1-OG 3.38Å; K12-S119 PolarHBondContact O-N 2.89Å; K13-S119 WeakPolarHBondContact CA-O 3.42Å
120	S	87.3	Confident	97	Very high	148 Å²	148	55.1 Å²	55.1	100%	1.035	31%	0.306	S	S	*	.			trans	-72.3	0	176.6	56.5	0	0	0	0	113

Retrieved 120 of 120 residues in 108 ms (Link to these results)

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