A0A096NRC6_PAPAN Loading...

T cell receptor delta variable 3

AlphaFold DB , UniProt , Accession A0A096NRC6, Species PAPAN (Papio anubis, Olive baboon), Gene TRDV3, Length 108 aa.

						>A0A096NRC6_PAPAN|A0A096NRC6|TRDV3
MLCDKVTQSSLDQMVASGSEVVLLCTYDSTYSDPGLFWYRIRPDYNFQFVFYGDKSRSHGSYFAKGRFSVKHLLTQKAFHLVISPVSTEDSATYYCAMSTMMQVPRKS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.7	Very low	82.5	Confident	223 Å²	223	96.5 Å²	96.5	100%	1.099	53%	0.526	S	S	*	.				0	103.6	0	-169.6	169.1	115.1	0	0	106.5
2	L	61.3	Low	82.9	Confident	122 Å²	122	102.8 Å²	102.8	64%	0.639	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-79.8	121.5	175.2	-87.6	91.7	0	0	0	107.7	D28	L2-D28 VanDerWaalsContact CD2-OD2 3.28Å; L2-D28 WeakPolarHBondContact CD2-OD2 3.48Å
3	C	79	Confident	83.4	Confident	92 Å²	92	102.5 Å²	102.5	62%	0.622	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-75.2	135.8	169.8	-66	0	0	0	0	109.1	K5	C3-K5 PolarHBondContact O-N 3.43Å
4	D	86.8	Confident	84.1	Confident	61 Å²	61	109.2 Å²	109.2	33%	0.326	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-57.4	130.5	168.8	-67.7	-54	0	0	0	109.7	D28 S29 T30 Y31 M98 T100	D4-D28 CarbonylContact C-O 3.49Å; D4-D28 VanDerWaalsContact CA-O 3.3Å; D4-D28 WeakPolarHBondContact CA-O 3.48Å; D4-S29 WeakPolarHBondContact OD1-CA 3Å; D4-S29 WeakPolarHBondContact OD1-CB 3.15Å; D4-S29 PolarHBondContact OD1-OG 3.19Å; D4-T30 PolarHBondContact OD1-N 3.22Å; D4-Y31 WeakPolarHBondContact OD2-CE2 3.03Å; D4-M98 HydrophobicContact CB-CE 3.65Å; D4-T100 HydrophobicContact CB-CG2 4.35Å; D4-T100 WeakPolarHBondContact OD2-CG2 3.49Å
5	K	92.4	Very high	84.8	Confident	118 Å²	118	105.5 Å²	105.5	51%	0.513	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-149.6	157.3	179.9	67.4	176.1	-177.6	177	0	112.8	C3 Y27 D28	C3-K5 PolarHBondContact O-N 3.43Å; K5-Y27 CarbonylContact O-C 3.55Å; K5-Y27 VanDerWaalsContact O-CA 3.27Å; K5-Y27 WeakPolarHBondContact O-CA 3.35Å; K5-D28 HydrophobicContact CG-CB 4.09Å; K5-D28 PolarHBondContact N-O 3.15Å; K5-D28 PolarHBondContact O-N 2.88Å
6	V	95.4	Very high	85.4	Confident	50 Å²	50	103.3 Å²	103.3	30%	0.303	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.7	148	165.6	-65.8	0	0	0	0	109.2	T26 M98	V6-T26 CarbonylContact C-O 3.51Å; V6-T26 WeakPolarHBondContact CA-O 3.47Å; V6-M98 HydrophobicContact CG1-CB 3.58Å
7	T	96.4	Very high	86.1	Confident	65 Å²	65	102.4 Å²	102.4	40%	0.399	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.3	120.9	176.8	-53.9	0	0	0	0	108.8	C25 T26	T7-C25 WeakPolarHBondContact O-CA 3.39Å; T7-T26 PolarHBondContact N-O 2.9Å; T7-T26 PolarHBondContact O-N 3.06Å
8	Q	95.4	Very high	86.7	Confident	73 Å²	73	99.6 Å²	99.6	34%	0.341	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	128	173	-70	178.4	-109.2	0	0	109.1	L24 C25 Y94 C96	Q8-L24 WeakPolarHBondContact CA-O 2.95Å; Q8-C25 HydrophobicContact CG-CB 4.4Å; Q8-Y94 PolarHBondContact NE2-O 3.14Å; Q8-C96 VanDerWaalsContact CD-N 3.3Å; Q8-C96 HydrophobicContact CG-CB 3.73Å
9	S	88.8	Confident	87.2	Confident	79 Å²	79	96.6 Å²	96.6	55%	0.552	55%	0.552	S	S	*	*			trans	-110	-2.7	178.6	56.2	0	0	0	0	113.4	L11 L24	S9-L11 PolarHBondContact O-N 2.79Å; S9-L24 PolarHBondContact N-O 3.16Å; S9-L24 WeakPolarHBondContact OG-CB 3.42Å
10	S	82.5	Confident	87.7	Confident	32 Å²	32	97.1 Å²	97.1	22%	0.224	55%	0.549	C	S	.	.			trans	-71	115.2	172.7	-68.4	0	0	0	0	110.4	L23 L24	S10-L23 WeakPolarHBondContact OG-CA 3.28Å; S10-L24 PolarHBondContact OG-N 3.39Å
11	L	82.4	Confident	88.2	Confident	147 Å²	147	93.1 Å²	93.1	77%	0.77	53%	0.527	S	S	*	.			trans	-75.5	174.5	168.5	-64.5	174.5	0	0	0	110.7	S9 Q13	S9-L11 PolarHBondContact O-N 2.79Å; L11-Q13 WeakPolarHBondContact O-CG 3.11Å; L11-Q13 PolarHBondContact O-N 2.83Å; L11-Q13 PolarHBondContact O-NE2 3.09Å
12	D	87.3	Confident	90.6	Very high	171 Å²	171	84.5 Å²	84.5	91%	0.914	49%	0.487	S	S	*	.			trans	-55	125.7	166.6	-67.6	-22.6	0	0	0	109.7
13	Q	89.6	Confident	92.3	Very high	99 Å²	99	79.6 Å²	79.6	46%	0.463	46%	0.461	S	S	.	.			trans	-132.5	129.6	-173.3	-76	165.7	87.8	0	0	109.6	L11 V15	L11-Q13 WeakPolarHBondContact O-CG 3.11Å; L11-Q13 PolarHBondContact O-N 2.83Å; L11-Q13 PolarHBondContact O-NE2 3.09Å; Q13-V15 HydrophobicContact CB-CG2 4.13Å
14	M	93.3	Very high	93.2	Very high	197 Å²	197	78.3 Å²	78.3	97%	0.97	45%	0.448	S	S	*	.			trans	-91.9	118.8	165.6	-70	-173.2	-69.2	0	0	108.4
15	V	94.1	Very high	93.7	Very high	53 Å²	53	75.4 Å²	75.4	32%	0.321	43%	0.432	S	S	.	.			trans	-120.8	132.2	-174.5	-178.6	0	0	0	0	108.9	Q13 S19 V21 V86	Q13-V15 HydrophobicContact CB-CG2 4.13Å; V15-S19 WeakPolarHBondContact CG1-OG 3.32Å; V15-V21 HydrophobicContact CG1-CB 4.15Å; V15-V21 HydrophobicContact CG2-CB 4.07Å; V15-V21 HydrophobicContact CG2-CG2 3.92Å; V15-V86 HydrophobicContact CG1-CB 4.33Å; V15-V86 HydrophobicContact CG1-CG1 4.31Å; V15-V86 HydrophobicContact CG1-CG2 4.03Å
16	A	95.6	Very high	94	Very high	70 Å²	70	72.5 Å²	72.5	58%	0.579	43%	0.425	S	S	*	.			trans	-69.5	139.8	178.7	0	0	0	0	0	111	G18 S19	A16-G18 PolarHBondContact O-N 2.91Å; A16-S19 WeakPolarHBondContact O-CB 3.38Å; A16-S19 PolarHBondContact O-N 2.77Å; A16-S19 PolarHBondContact O-OG 3.29Å
17	S	96.4	Very high	93.9	Very high	88 Å²	88	71.1 Å²	71.1	62%	0.615	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	140.8	172.6	-169.2	0	0	0	0	110.5	S19 V86	S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 3.29Å; S17-V86 WeakPolarHBondContact CA-O 3.41Å; S17-V86 PolarHBondContact OG-O 2.92Å
18	G	96.8	Very high	93.8	Very high	52 Å²	52	70.1 Å²	70.1	54%	0.536	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-12.1	-177.6	0	0	0	0	0	115	A16 V86	A16-G18 PolarHBondContact O-N 2.91Å; G18-V86 PolarHBondContact N-O 2.91Å
19	S	97.3	Very high	93.6	Very high	43 Å²	43	67.1 Å²	67.1	30%	0.301	39%	0.394	S	S	.	.	S	Bend	trans	-85.3	174.3	177	69.9	0	0	0	0	112.7	V15 A16 S17 V86	V15-S19 WeakPolarHBondContact CG1-OG 3.32Å; A16-S19 WeakPolarHBondContact O-CB 3.38Å; A16-S19 PolarHBondContact O-N 2.77Å; A16-S19 PolarHBondContact O-OG 3.29Å; S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 3.29Å; S19-V86 WeakPolarHBondContact O-CG2 3.39Å; S19-V86 PolarHBondContact O-N 2.67Å
20	E	97.3	Very high	93.5	Very high	106 Å²	106	68.7 Å²	68.7	50%	0.495	40%	0.4	S	S	.	.			trans	-99.2	139.2	171.9	176	171.4	122	0	0	110.1	V82 I83	E20-V82 HydrophobicContact CG-CG1 3.91Å; E20-I83 WeakPolarHBondContact CA-O 3.23Å
21	V	96.3	Very high	93.7	Very high	15 Å²	15	72.9 Å²	72.9	9%	0.091	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145.2	166.3	64.9	0	0	0	0	110.6	V15 L23 V82 I83 V86	V15-V21 HydrophobicContact CG1-CB 4.15Å; V15-V21 HydrophobicContact CG2-CB 4.07Å; V15-V21 HydrophobicContact CG2-CG2 3.92Å; V21-L23 HydrophobicContact CG2-CD2 4.11Å; V21-V82 WeakPolarHBondContact O-CA 3.27Å; V21-I83 HydrophobicContact CG1-CB 3.85Å; V21-I83 HydrophobicContact CG1-CD1 4.16Å; V21-I83 HydrophobicContact CG1-CG1 4.19Å; V21-I83 PolarHBondContact N-O 3.04Å; V21-I83 PolarHBondContact O-N 3.29Å; V21-V86 HydrophobicContact CB-CG2 4.3Å; V21-V86 HydrophobicContact CG1-CG2 3.59Å
22	V	97.6	Very high	93.8	Very high	41 Å²	41	70 Å²	70	25%	0.248	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.4	173.6	-173	0	0	0	0	109.3	L24 H80 L81 V82	V22-L24 HydrophobicContact CG1-CD2 3.93Å; V22-H80 HydrophobicContact CG1-CB 3.86Å; V22-L81 CarbonylContact C-O 3.58Å; V22-L81 WeakPolarHBondContact CA-O 3.3Å; V22-V82 HydrophobicContact CG1-CG2 4.36Å; V22-V82 HydrophobicContact CG2-CG1 4.47Å; V22-V82 HydrophobicContact CG2-CG2 4.25Å
23	L	97.8	Very high	93.9	Very high	19 Å²	19	64.1 Å²	64.1	10%	0.099	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	121.3	173.5	-54.4	-179.7	0	0	0	109.5	S10 V21 W38 H80 L81 I83 Y94	S10-L23 WeakPolarHBondContact OG-CA 3.28Å; V21-L23 HydrophobicContact CG2-CD2 4.11Å; L23-W38 HydrophobicContact CB-CH2 3.6Å; L23-W38 HydrophobicContact CB-CZ2 4.14Å; L23-W38 HydrophobicContact CB-CZ3 4.06Å; L23-W38 HydrophobicContact CD1-CZ3 4.3Å; L23-W38 WeakPolarHBondContact O-CZ2 3.28Å; L23-H80 CarbonylContact O-C 3.56Å; L23-H80 WeakPolarHBondContact O-CA 3.35Å; L23-H80 WeakPolarHBondContact O-CB 3.34Å; L23-L81 HydrophobicContact CB-CB 4.27Å; L23-L81 HydrophobicContact CD1-CD2 4.27Å; L23-L81 PolarHBondContact N-O 3.23Å; L23-L81 PolarHBondContact O-N 3.41Å; L23-I83 HydrophobicContact CD1-CD1 4.43Å; L23-Y94 VanDerWaalsContact CD1-CB 3.49Å; L23-Y94 HydrophobicContact CD1-CD1 3.91Å; L23-Y94 HydrophobicContact CD1-CD2 3.68Å; L23-Y94 HydrophobicContact CD1-CE2 4.4Å; L23-Y94 HydrophobicContact CD1-CG 3.41Å; L23-Y94 VanDerWaalsContact CD1-CG 3.41Å
24	L	97.8	Very high	94	Very high	65 Å²	65	59.5 Å²	59.5	34%	0.34	35%	0.351	S	S	.	.			trans	-90.4	126	-171.4	-57.2	179.1	0	0	0	110.1	Q8 S9 S10 V22 H80	Q8-L24 WeakPolarHBondContact CA-O 2.95Å; S9-L24 PolarHBondContact N-O 3.16Å; S9-L24 WeakPolarHBondContact OG-CB 3.42Å; S10-L24 PolarHBondContact OG-N 3.39Å; V22-L24 HydrophobicContact CG1-CD2 3.93Å; L24-H80 HydrophobicContact CD2-CB 4.48Å
25	C	97.6	Very high	94.1	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	132	170.3	177.6	0	0	0	0	109.7	T7 Q8 W38 A78 F79 H80 C96	T7-C25 WeakPolarHBondContact O-CA 3.39Å; Q8-C25 HydrophobicContact CG-CB 4.4Å; C25-W38 HydrophobicContact CB-CH2 3.99Å; C25-W38 HydrophobicContact CB-CZ2 3.43Å; C25-W38 VanDerWaalsContact CB-CZ2 3.43Å; C25-A78 WeakPolarHBondContact O-CA 3.45Å; C25-F79 PolarHBondContact O-N 2.84Å; C25-H80 PolarHBondContact N-ND1 3.44Å; C25-H80 VanDerWaalsContact N-ND1 3.2Å; C25-H80 PolarHBondContact O-CE1 2.84Å; C25-H80 VanDerWaalsContact O-CE1 3.31Å; C25-H80 PolarHBondContact O-ND1 3.03Å; C25-C96 HydrophobicContact CB-CB 3.49Å; C25-C96 VanDerWaalsContact CB-CB 3.49Å; C25-C96 WeakPolarHBondContact CB-SG 3.28Å; C25-C96 WeakPolarHBondContact SG-CB 3.17Å; C25-C96 CovalentContact SG-SG 2.02Å; C25-C96 PolarHBondContact SG-SG 3.34Å
26	T	97.3	Very high	94.2	Very high	57 Å²	57	47.9 Å²	47.9	35%	0.35	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	157.2	166.2	58.2	0	0	0	0	109.7	V6 T7 K77 A78	V6-T26 CarbonylContact C-O 3.51Å; V6-T26 WeakPolarHBondContact CA-O 3.47Å; T7-T26 PolarHBondContact N-O 2.9Å; T7-T26 PolarHBondContact O-N 3.06Å; T26-K77 CarbonylContact C-O 3.59Å; T26-K77 VanDerWaalsContact CA-O 3.23Å; T26-K77 WeakPolarHBondContact CA-O 3.33Å; T26-K77 WeakPolarHBondContact CB-O 3.47Å; T26-A78 HydrophobicContact CG2-CB 4.14Å
27	Y	94.9	Very high	94.3	Very high	20 Å²	20	45.1 Å²	45.1	8%	0.078	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153.5	177.2	65.9	-84.5	0	0	0	110.2	K5 P34 L36 K77 M98	K5-Y27 CarbonylContact O-C 3.55Å; K5-Y27 VanDerWaalsContact O-CA 3.27Å; K5-Y27 WeakPolarHBondContact O-CA 3.35Å; Y27-P34 HydrophobicContact CD2-CG 4.08Å; Y27-P34 HydrophobicContact CE2-CG 3.68Å; Y27-L36 HydrophobicContact CD1-CD1 3.71Å; Y27-L36 HydrophobicContact CD1-CD2 3.78Å; Y27-L36 HydrophobicContact CD1-CG 4.43Å; Y27-L36 HydrophobicContact CD2-CD2 4.32Å; Y27-L36 HydrophobicContact CE1-CD1 3.38Å; Y27-L36 HydrophobicContact CE1-CD2 4.26Å; Y27-L36 HydrophobicContact CE1-CG 4.46Å; Y27-L36 HydrophobicContact CG-CD1 4.44Å; Y27-L36 HydrophobicContact CG-CD2 3.82Å; Y27-K77 HydrophobicContact CD1-CB 4.08Å; Y27-K77 WeakPolarHBondContact CD1-O 3.13Å; Y27-K77 HydrophobicContact CD2-CB 4.14Å; Y27-K77 VanDerWaalsContact CE1-CA 3.45Å; Y27-K77 HydrophobicContact CE1-CB 3.89Å; Y27-K77 WeakPolarHBondContact CE1-O 3.5Å; Y27-K77 HydrophobicContact CE2-CB 3.96Å; Y27-K77 HydrophobicContact CE2-CD 4.38Å; Y27-K77 HydrophobicContact CE2-CG 4.24Å; Y27-K77 HydrophobicContact CG-CB 4.19Å; Y27-K77 PolarHBondContact N-O 2.86Å; Y27-K77 WeakPolarHBondContact O-CB 3.26Å; Y27-K77 VanDerWaalsContact O-CD 3.3Å; Y27-K77 WeakPolarHBondContact O-CD 3.4Å; Y27-M98 HydrophobicContact CD2-SD 3.82Å; Y27-M98 HydrophobicContact CG-SD 4.19Å
28	D	94	Very high	94.4	Very high	45 Å²	45	40.9 Å²	40.9	24%	0.241	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.8	167.3	-162.7	-0.1	0	0	0	108	L2 D4 K5 K77	L2-D28 VanDerWaalsContact CD2-OD2 3.28Å; L2-D28 WeakPolarHBondContact CD2-OD2 3.48Å; D4-D28 CarbonylContact C-O 3.49Å; D4-D28 VanDerWaalsContact CA-O 3.3Å; D4-D28 WeakPolarHBondContact CA-O 3.48Å; K5-D28 HydrophobicContact CG-CB 4.09Å; K5-D28 PolarHBondContact N-O 3.15Å; K5-D28 PolarHBondContact O-N 2.88Å; D28-K77 IonicContact OD1-NZ 2.77Å; D28-K77 PolarHBondContact OD1-NZ 3.2Å
29	S	90	Very high	94.4	Very high	10 Å²	10	41.1 Å²	41.1	7%	0.07	22%	0.223	C	C	.	.			trans	-148.4	150.1	178.7	-171.3	0	0	0	0	111.2	D4 Y31 K77	D4-S29 WeakPolarHBondContact OD1-CA 3Å; D4-S29 WeakPolarHBondContact OD1-CB 3.15Å; D4-S29 PolarHBondContact OD1-OG 3.19Å; S29-Y31 WeakPolarHBondContact OG-CD2 3.3Å; S29-Y31 PolarHBondContact OG-N 2.87Å; S29-Y31 VanDerWaalsContact OG-N 3.11Å; S29-K77 PolarHBondContact O-NZ 2.95Å
30	T	87.7	Confident	94.4	Very high	112 Å²	112	39.6 Å²	39.6	69%	0.687	21%	0.21	S	C	*	.	S	Bend	trans	-84.8	-14.2	168.6	54.6	0	0	0	0	112.4	D4	D4-T30 PolarHBondContact OD1-N 3.22Å
31	Y	86.6	Confident	94.4	Very high	119 Å²	119	36.8 Å²	36.8	47%	0.467	20%	0.198	S	C	.	.			trans	-71.2	137.3	177.4	-69.7	-94.7	0	0	0	110.1	D4 S29 D33 T100	D4-Y31 WeakPolarHBondContact OD2-CE2 3.03Å; S29-Y31 WeakPolarHBondContact OG-CD2 3.3Å; S29-Y31 PolarHBondContact OG-N 2.87Å; S29-Y31 VanDerWaalsContact OG-N 3.11Å; Y31-D33 VanDerWaalsContact C-N 3.32Å; Y31-T100 HydrophobicContact CD2-CG2 3.32Å; Y31-T100 HydrophobicContact CE2-CG2 3.42Å; Y31-T100 VanDerWaalsContact CE2-CG2 3.42Å; Y31-T100 HydrophobicContact CG-CG2 4.03Å
32	S	85.1	Confident	94.3	Very high	86 Å²	86	39.2 Å²	39.2	60%	0.601	21%	0.206	S	C	*	.	S	Bend	trans	-69.8	-33	-179.9	59.7	0	0	0	0	111.3	K55	S32-K55 VanDerWaalsContact O-CD 3.28Å; S32-K55 WeakPolarHBondContact O-CD 3.4Å; S32-K55 WeakPolarHBondContact O-CE 3.1Å; S32-K55 PolarHBondContact O-NZ 2.71Å
33	D	88.6	Confident	94.2	Very high	48 Å²	48	42.1 Å²	42.1	26%	0.257	23%	0.226	S	C	.	.	S	Bend	trans	-139	70.3	-177.3	-165.7	22.8	0	0	0	111.9	Y31 K55	Y31-D33 VanDerWaalsContact C-N 3.32Å; D33-K55 HydrophobicContact CB-CD 3.98Å; D33-K55 HydrophobicContact CB-CG 4.46Å; D33-K55 WeakPolarHBondContact OD1-CB 3.39Å; D33-K55 WeakPolarHBondContact OD1-CG 3.31Å; D33-K55 PolarHBondContact OD1-N 3.18Å
34	P	92.1	Very high	94	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.019	25%	0.246	C	C	.	.			trans	-70.7	142.1	175.1	31.3	-33.4	0	0	0	110.1	Y27 M98 S99	Y27-P34 HydrophobicContact CD2-CG 4.08Å; Y27-P34 HydrophobicContact CE2-CG 3.68Å; P34-M98 HydrophobicContact CB-CG 3.73Å; P34-M98 HydrophobicContact CB-SD 3.69Å; P34-M98 HydrophobicContact CG-SD 4.01Å; P34-S99 WeakPolarHBondContact CA-O 2.83Å
35	G	94.3	Very high	93.7	Very high	5 Å²	5	52.5 Å²	52.5	5%	0.052	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.5	168.6	0	0	0	0	0	110.1	F37 M98 S99	G35-F37 VanDerWaalsContact C-CE2 3.45Å; G35-F37 VanDerWaalsContact O-CE2 3.31Å; G35-F37 WeakPolarHBondContact O-CE2 3.34Å; G35-M98 CarbonylContact O-C 3.49Å; G35-M98 VanDerWaalsContact O-CA 3.31Å; G35-M98 WeakPolarHBondContact O-CA 3.28Å; G35-S99 PolarHBondContact N-O 3.02Å; G35-S99 PolarHBondContact O-N 2.77Å
36	L	96.7	Very high	93.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.1	-178.3	-60.1	165.2	0	0	0	109.8	Y27 Y52 G53 H72 F79 M98	Y27-L36 HydrophobicContact CD1-CD1 3.71Å; Y27-L36 HydrophobicContact CD1-CD2 3.78Å; Y27-L36 HydrophobicContact CD1-CG 4.43Å; Y27-L36 HydrophobicContact CD2-CD2 4.32Å; Y27-L36 HydrophobicContact CE1-CD1 3.38Å; Y27-L36 HydrophobicContact CE1-CD2 4.26Å; Y27-L36 HydrophobicContact CE1-CG 4.46Å; Y27-L36 HydrophobicContact CG-CD1 4.44Å; Y27-L36 HydrophobicContact CG-CD2 3.82Å; L36-Y52 CarbonylContact O-C 3.6Å; L36-Y52 VanDerWaalsContact O-CA 3.32Å; L36-Y52 WeakPolarHBondContact O-CA 3.43Å; L36-Y52 WeakPolarHBondContact O-CD2 3.4Å; L36-G53 PolarHBondContact N-O 3.38Å; L36-G53 PolarHBondContact O-N 3.36Å; L36-H72 WeakPolarHBondContact CD1-NE2 3.41Å; L36-F79 HydrophobicContact CB-CB 4.23Å; L36-F79 HydrophobicContact CB-CD1 3.49Å; L36-F79 VanDerWaalsContact CB-CD1 3.49Å; L36-F79 HydrophobicContact CB-CD2 4.05Å; L36-F79 HydrophobicContact CB-CE1 3.72Å; L36-F79 HydrophobicContact CB-CE2 4.28Å; L36-F79 HydrophobicContact CB-CG 3.66Å; L36-F79 HydrophobicContact CB-CZ 4.12Å; L36-F79 HydrophobicContact CD1-CB 3.72Å; L36-F79 HydrophobicContact CD1-CD2 3.94Å; L36-F79 HydrophobicContact CD1-CG 3.83Å; L36-F79 HydrophobicContact CG-CB 4.45Å; L36-F79 HydrophobicContact CG-CG 4.33Å; L36-M98 HydrophobicContact CD2-CB 3.96Å; L36-M98 HydrophobicContact CD2-CG 3.82Å; L36-M98 HydrophobicContact CD2-SD 4.15Å
37	F	97.5	Very high	93.6	Very high	12 Å²	12	58.8 Å²	58.8	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146	-170.4	-55.7	-95.1	0	0	0	111	G35 Y39 F49 F51 Y52 C96 A97	G35-F37 VanDerWaalsContact C-CE2 3.45Å; G35-F37 VanDerWaalsContact O-CE2 3.31Å; G35-F37 WeakPolarHBondContact O-CE2 3.34Å; F37-Y39 HydrophobicContact CB-CD2 4.12Å; F37-Y39 HydrophobicContact CB-CE2 3.43Å; F37-Y39 VanDerWaalsContact CB-CE2 3.43Å; F37-Y39 HydrophobicContact CG-CE2 4.1Å; F37-F49 HydrophobicContact CD1-CE2 4.17Å; F37-F51 CarbonylContact C-O 3.53Å; F37-F51 WeakPolarHBondContact CA-O 3.4Å; F37-Y52 AromaticContact CD1-CD2 3.75Å; F37-Y52 HydrophobicContact CD1-CD2 3.75Å; F37-Y52 HydrophobicContact CD1-CG 4.45Å; F37-Y52 AromaticContact CE1-CD2 3.15Å; F37-Y52 HydrophobicContact CE1-CD2 3.15Å; F37-Y52 AromaticContact CE1-CE2 3.79Å; F37-Y52 HydrophobicContact CE1-CE2 3.79Å; F37-Y52 HydrophobicContact CE1-CG 4.02Å; F37-Y52 HydrophobicContact CE2-CD2 4.1Å; F37-Y52 HydrophobicContact CE2-CE2 4.2Å; F37-Y52 HydrophobicContact CG-CD2 4.4Å; F37-Y52 AromaticContact CZ-CD2 3.31Å; F37-Y52 HydrophobicContact CZ-CD2 3.31Å; F37-Y52 AromaticContact CZ-CE2 3.45Å; F37-Y52 HydrophobicContact CZ-CE2 3.45Å; F37-Y52 VanDerWaalsContact CZ-CE2 3.45Å; F37-C96 CarbonylContact O-C 3.54Å; F37-C96 WeakPolarHBondContact O-CA 3.19Å; F37-A97 HydrophobicContact CB-CB 4.35Å; F37-A97 PolarHBondContact N-O 3.07Å; F37-A97 PolarHBondContact O-N 2.81Å
38	W	98.3	Very high	93.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.5	161	-80	97.4	0	0	0	109.8	L23 C25 V50 F51 F79 L81 Y95 C96	L23-W38 HydrophobicContact CB-CH2 3.6Å; L23-W38 HydrophobicContact CB-CZ2 4.14Å; L23-W38 HydrophobicContact CB-CZ3 4.06Å; L23-W38 HydrophobicContact CD1-CZ3 4.3Å; L23-W38 WeakPolarHBondContact O-CZ2 3.28Å; C25-W38 HydrophobicContact CB-CH2 3.99Å; C25-W38 HydrophobicContact CB-CZ2 3.43Å; C25-W38 VanDerWaalsContact CB-CZ2 3.43Å; W38-V50 HydrophobicContact CB-CB 4.08Å; W38-V50 WeakPolarHBondContact O-CA 3.32Å; W38-V50 WeakPolarHBondContact O-CB 3.33Å; W38-V50 PolarHBondContact O-N 2.92Å; W38-F51 HydrophobicContact CB-CB 4.32Å; W38-F51 PolarHBondContact N-O 3.02Å; W38-F51 PolarHBondContact O-N 3.3Å; W38-F79 AromaticContact CD1-CD1 3.61Å; W38-F79 AromaticContact CD1-CE1 3.52Å; W38-F79 AromaticContact NE1-CD1 3.56Å; W38-F79 AromaticContact NE1-CE1 3.97Å; W38-F79 PolarHBondContact NE1-O 2.83Å; W38-L81 HydrophobicContact CB-CD1 4.47Å; W38-L81 HydrophobicContact CB-CD2 4.09Å; W38-L81 HydrophobicContact CD2-CB 3.68Å; W38-L81 HydrophobicContact CD2-CD2 4.01Å; W38-L81 HydrophobicContact CD2-CG 4.41Å; W38-L81 VanDerWaalsContact CE2-CB 3.49Å; W38-L81 HydrophobicContact CE3-CB 4.32Å; W38-L81 HydrophobicContact CE3-CD2 4.17Å; W38-L81 HydrophobicContact CG-CB 3.84Å; W38-L81 HydrophobicContact CG-CD1 4.31Å; W38-L81 HydrophobicContact CG-CD2 3.99Å; W38-L81 HydrophobicContact CG-CG 4.29Å; W38-L81 HydrophobicContact CZ2-CB 3.96Å; W38-Y95 CarbonylContact C-O 3.56Å; W38-Y95 WeakPolarHBondContact CA-O 3.46Å; W38-C96 HydrophobicContact CD2-CB 4.31Å; W38-C96 HydrophobicContact CE3-CB 4.26Å; W38-C96 HydrophobicContact CH2-CB 4.03Å; W38-C96 HydrophobicContact CZ2-CB 4.05Å; W38-C96 HydrophobicContact CZ3-CB 4.12Å
39	Y	97.9	Very high	93.9	Very high	57 Å²	57	60.6 Å²	60.6	22%	0.224	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	162.1	171.6	-60.7	-81.3	0	0	0	109.6	F37 F47 Q48 F49 Y94 Y95 A97	F37-Y39 HydrophobicContact CB-CD2 4.12Å; F37-Y39 HydrophobicContact CB-CE2 3.43Å; F37-Y39 VanDerWaalsContact CB-CE2 3.43Å; F37-Y39 HydrophobicContact CG-CE2 4.1Å; Y39-F47 HydrophobicContact CD1-CD1 4.36Å; Y39-F47 AromaticContact CD1-CE1 3.31Å; Y39-F47 HydrophobicContact CD1-CE1 3.31Å; Y39-F47 HydrophobicContact CD1-CE2 4.38Å; Y39-F47 AromaticContact CD1-CZ 3.32Å; Y39-F47 HydrophobicContact CD1-CZ 3.32Å; Y39-F47 AromaticContact CD2-CZ 3.98Å; Y39-F47 HydrophobicContact CD2-CZ 3.98Å; Y39-F47 AromaticContact CE1-CE1 3.75Å; Y39-F47 HydrophobicContact CE1-CE1 3.75Å; Y39-F47 AromaticContact CE1-CZ 3.95Å; Y39-F47 HydrophobicContact CE1-CZ 3.95Å; Y39-F47 HydrophobicContact CE2-CZ 4.5Å; Y39-F47 AromaticContact CG-CE1 3.87Å; Y39-F47 HydrophobicContact CG-CE1 3.87Å; Y39-F47 HydrophobicContact CG-CE2 4.12Å; Y39-F47 AromaticContact CG-CZ 3.34Å; Y39-F47 HydrophobicContact CG-CZ 3.34Å; Y39-Q48 CarbonylContact C-O 3.53Å; Y39-Q48 VanDerWaalsContact CA-O 3.26Å; Y39-Q48 WeakPolarHBondContact CA-O 3.33Å; Y39-F49 HydrophobicContact CD1-CB 4.3Å; Y39-F49 HydrophobicContact CE1-CB 4.21Å; Y39-F49 HydrophobicContact CE1-CD2 4.04Å; Y39-Y94 CarbonylContact O-C 3.53Å; Y39-Y94 VanDerWaalsContact O-CA 3.32Å; Y39-Y94 WeakPolarHBondContact O-CA 3.45Å; Y39-Y95 PolarHBondContact N-O 2.8Å; Y39-Y95 PolarHBondContact O-N 3.41Å; Y39-A97 HydrophobicContact CD2-CB 4.26Å; Y39-A97 HydrophobicContact CE2-CB 3.97Å
40	R	96.9	Very high	94.2	Very high	10 Å²	10	60.1 Å²	60.1	4%	0.038	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.8	167.6	71.7	178.6	-176.3	-175.2	1	111.4	Q48 V50 D90 A92 T93 Y94	R40-Q48 HydrophobicContact CG-CB 3.98Å; R40-Q48 VanDerWaalsContact CZ-OE1 3.28Å; R40-Q48 PolarHBondContact N-O 3.2Å; R40-Q48 PolarHBondContact O-N 2.68Å; R40-V50 HydrophobicContact CB-CG2 3.9Å; R40-V50 HydrophobicContact CG-CG2 3.79Å; R40-D90 IonicContact NH1-OD1 3.72Å; R40-A92 HydrophobicContact CB-CB 3.95Å; R40-A92 HydrophobicContact CG-CB 4.34Å; R40-T93 CarbonylContact C-O 3.52Å; R40-T93 VanDerWaalsContact CA-O 3.23Å; R40-T93 WeakPolarHBondContact CA-O 3.3Å; R40-Y94 HydrophobicContact CB-CD1 3.74Å; R40-Y94 HydrophobicContact CB-CE1 3.7Å; R40-Y94 HydrophobicContact CB-CG 4.19Å; R40-Y94 HydrophobicContact CG-CE1 4.39Å
41	I	96.8	Very high	94.7	Very high	47 Å²	47	55.7 Å²	55.7	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.4	169.3	-57	-177.5	0	0	0	107.1	N46 F47 A92 T93 Y95	I41-N46 WeakPolarHBondContact CA-O 3.41Å; I41-F47 HydrophobicContact CD1-CD2 3.92Å; I41-F47 HydrophobicContact CD1-CE2 4.49Å; I41-F47 HydrophobicContact CG1-CD2 3.65Å; I41-F47 HydrophobicContact CG1-CE2 4.35Å; I41-A92 WeakPolarHBondContact O-CA 3.23Å; I41-A92 WeakPolarHBondContact O-CB 3.01Å; I41-T93 PolarHBondContact N-O 2.85Å; I41-T93 PolarHBondContact O-N 2.86Å; I41-Y95 HydrophobicContact CB-CE2 4.2Å; I41-Y95 HydrophobicContact CD1-CD2 4.1Å; I41-Y95 HydrophobicContact CD1-CE2 3.5Å; I41-Y95 HydrophobicContact CG1-CD2 4.05Å; I41-Y95 HydrophobicContact CG1-CE2 3.71Å
42	R	95.8	Very high	95.2	Very high	66 Å²	66	50.4 Å²	50.4	25%	0.249	25%	0.248	C	C	.	.			trans	-77.3	164.2	175.7	-73.5	-179.9	75	108.3	3.9	110.8	D44 Y45 N46 E89 A92	R42-D44 WeakPolarHBondContact CB-OD1 3.33Å; R42-D44 PolarHBondContact O-N 2.82Å; R42-Y45 WeakPolarHBondContact O-CA 2.96Å; R42-Y45 PolarHBondContact O-N 3.37Å; R42-N46 HydrophobicContact CB-CB 4.4Å; R42-N46 PolarHBondContact N-O 3.21Å; R42-N46 VanDerWaalsContact N-O 3.16Å; R42-E89 PolarHBondContact NH1-O 3.49Å; R42-A92 HydrophobicContact CG-CB 4.2Å
43	P	93.6	Very high	95.7	Very high	103 Å²	103	46.3 Å²	46.3	67%	0.669	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-20.4	179	-27.2	35.9	0	0	0	115.2	Y45	P43-Y45 PolarHBondContact O-N 2.86Å
44	D	94.2	Very high	95.9	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	13.6	174	65.4	-13	0	0	0	113.2	R42 N46	R42-D44 WeakPolarHBondContact CB-OD1 3.33Å; R42-D44 PolarHBondContact O-N 2.82Å; D44-N46 PolarHBondContact O-N 3.45Å; D44-N46 WeakPolarHBondContact OD1-CB 3.32Å; D44-N46 PolarHBondContact OD1-N 3.28Å; D44-N46 VanDerWaalsContact OD1-N 3.15Å
45	Y	92.7	Very high	95.8	Very high	204 Å²	204	49.7 Å²	49.7	80%	0.8	23%	0.232	S	C	*	.			trans	62.2	17	-176.1	-54.3	-78.2	0	0	0	114.8	R42 P43 F47	R42-Y45 WeakPolarHBondContact O-CA 2.96Å; R42-Y45 PolarHBondContact O-N 3.37Å; P43-Y45 PolarHBondContact O-N 2.86Å; Y45-F47 PolarHBondContact O-N 3.26Å
46	N	94.3	Very high	95.6	Very high	71 Å²	71	54 Å²	54	38%	0.38	26%	0.262	S	S	.	.			trans	-75	108.6	176.5	-164.9	-46.6	0	0	0	110.6	I41 R42 D44 Q48	I41-N46 WeakPolarHBondContact CA-O 3.41Å; R42-N46 HydrophobicContact CB-CB 4.4Å; R42-N46 PolarHBondContact N-O 3.21Å; R42-N46 VanDerWaalsContact N-O 3.16Å; D44-N46 PolarHBondContact O-N 3.45Å; D44-N46 WeakPolarHBondContact OD1-CB 3.32Å; D44-N46 PolarHBondContact OD1-N 3.28Å; D44-N46 VanDerWaalsContact OD1-N 3.15Å; N46-Q48 WeakPolarHBondContact OD1-CG 3.31Å; N46-Q48 PolarHBondContact OD1-NE2 2.9Å; N46-Q48 VanDerWaalsContact OD1-NE2 3.14Å
47	F	96.8	Very high	95.4	Very high	118 Å²	118	59 Å²	59	52%	0.518	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	119.3	175	-174.9	-88.3	0	0	0	110.6	Y39 I41 Y45	Y39-F47 HydrophobicContact CD1-CD1 4.36Å; Y39-F47 AromaticContact CD1-CE1 3.31Å; Y39-F47 HydrophobicContact CD1-CE1 3.31Å; Y39-F47 HydrophobicContact CD1-CE2 4.38Å; Y39-F47 AromaticContact CD1-CZ 3.32Å; Y39-F47 HydrophobicContact CD1-CZ 3.32Å; Y39-F47 AromaticContact CD2-CZ 3.98Å; Y39-F47 HydrophobicContact CD2-CZ 3.98Å; Y39-F47 AromaticContact CE1-CE1 3.75Å; Y39-F47 HydrophobicContact CE1-CE1 3.75Å; Y39-F47 AromaticContact CE1-CZ 3.95Å; Y39-F47 HydrophobicContact CE1-CZ 3.95Å; Y39-F47 HydrophobicContact CE2-CZ 4.5Å; Y39-F47 AromaticContact CG-CE1 3.87Å; Y39-F47 HydrophobicContact CG-CE1 3.87Å; Y39-F47 HydrophobicContact CG-CE2 4.12Å; Y39-F47 AromaticContact CG-CZ 3.34Å; Y39-F47 HydrophobicContact CG-CZ 3.34Å; I41-F47 HydrophobicContact CD1-CD2 3.92Å; I41-F47 HydrophobicContact CD1-CE2 4.49Å; I41-F47 HydrophobicContact CG1-CD2 3.65Å; I41-F47 HydrophobicContact CG1-CE2 4.35Å; Y45-F47 PolarHBondContact O-N 3.26Å
48	Q	97.5	Very high	95.2	Very high	43 Å²	43	61.6 Å²	61.6	20%	0.201	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.8	-173.2	-60.1	-175.8	-27.4	0	0	111.7	Y39 R40 N46 F63	Y39-Q48 CarbonylContact C-O 3.53Å; Y39-Q48 VanDerWaalsContact CA-O 3.26Å; Y39-Q48 WeakPolarHBondContact CA-O 3.33Å; R40-Q48 HydrophobicContact CG-CB 3.98Å; R40-Q48 VanDerWaalsContact CZ-OE1 3.28Å; R40-Q48 PolarHBondContact N-O 3.2Å; R40-Q48 PolarHBondContact O-N 2.68Å; N46-Q48 WeakPolarHBondContact OD1-CG 3.31Å; N46-Q48 PolarHBondContact OD1-NE2 2.9Å; N46-Q48 VanDerWaalsContact OD1-NE2 3.14Å; Q48-F63 HydrophobicContact CB-CE1 4.36Å
49	F	97.8	Very high	95.1	Very high	61 Å²	61	66.1 Å²	66.1	27%	0.268	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.3	164.4	170.6	-104	0	0	0	110.3	F37 Y39 F51 Y52 H59 S61 F63	F37-F49 HydrophobicContact CD1-CE2 4.17Å; Y39-F49 HydrophobicContact CD1-CB 4.3Å; Y39-F49 HydrophobicContact CE1-CB 4.21Å; Y39-F49 HydrophobicContact CE1-CD2 4.04Å; F49-F51 VanDerWaalsContact CE2-O 3.25Å; F49-F51 WeakPolarHBondContact CE2-O 3.05Å; F49-Y52 VanDerWaalsContact CZ-N 3.32Å; F49-H59 AromaticContact CE1-CE1 3.8Å; F49-H59 AromaticContact CE1-ND1 3.87Å; F49-H59 AromaticContact CZ-CE1 3.57Å; F49-H59 AromaticContact CZ-ND1 3.85Å; F49-S61 WeakPolarHBondContact O-CB 3.22Å; F49-F63 WeakPolarHBondContact O-CE1 3.4Å; F49-F63 WeakPolarHBondContact O-CZ 3.36Å
50	V	98.1	Very high	95	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-56.5	178.5	-177.2	0	0	0	0	110.4	W38 R40 G60 S61 F63 F68 L81 Y94	W38-V50 HydrophobicContact CB-CB 4.08Å; W38-V50 WeakPolarHBondContact O-CA 3.32Å; W38-V50 WeakPolarHBondContact O-CB 3.33Å; W38-V50 PolarHBondContact O-N 2.92Å; R40-V50 HydrophobicContact CB-CG2 3.9Å; R40-V50 HydrophobicContact CG-CG2 3.79Å; V50-G60 CarbonylContact O-C 3.48Å; V50-G60 WeakPolarHBondContact O-CA 3.25Å; V50-S61 PolarHBondContact O-N 3.05Å; V50-F63 HydrophobicContact CB-CZ 4.43Å; V50-F63 HydrophobicContact CG1-CE2 4.39Å; V50-F63 HydrophobicContact CG2-CE2 4.48Å; V50-F63 HydrophobicContact CG2-CZ 4.05Å; V50-F68 HydrophobicContact CG1-CD1 3.57Å; V50-F68 HydrophobicContact CG1-CE1 3.95Å; V50-F68 HydrophobicContact CG1-CG 4.49Å; V50-L81 HydrophobicContact CG1-CD1 4.1Å; V50-L81 HydrophobicContact CG1-CD2 3.9Å; V50-Y94 HydrophobicContact CG2-CD1 4.33Å; V50-Y94 HydrophobicContact CG2-CE1 4.13Å
51	F	97.8	Very high	95	Very high	19 Å²	19	65.3 Å²	65.3	8%	0.083	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	148	-173.3	-127.6	-83.5	0	0	0	112	F37 W38 F49 H59 A64 F68 V70 L81	F37-F51 CarbonylContact C-O 3.53Å; F37-F51 WeakPolarHBondContact CA-O 3.4Å; W38-F51 HydrophobicContact CB-CB 4.32Å; W38-F51 PolarHBondContact N-O 3.02Å; W38-F51 PolarHBondContact O-N 3.3Å; F49-F51 VanDerWaalsContact CE2-O 3.25Å; F49-F51 WeakPolarHBondContact CE2-O 3.05Å; F51-H59 WeakPolarHBondContact CD1-O 3.42Å; F51-A64 HydrophobicContact CD2-CB 4.45Å; F51-F68 HydrophobicContact CD2-CB 4.31Å; F51-F68 HydrophobicContact CE2-CB 4.31Å; F51-F68 WeakPolarHBondContact CE2-O 3.4Å; F51-V70 HydrophobicContact CB-CG1 3.83Å; F51-V70 HydrophobicContact CD1-CB 4.28Å; F51-V70 HydrophobicContact CD1-CG1 3.51Å; F51-V70 HydrophobicContact CD1-CG2 3.78Å; F51-V70 HydrophobicContact CD2-CG1 4.38Å; F51-V70 HydrophobicContact CE1-CG1 4.15Å; F51-V70 HydrophobicContact CE1-CG2 3.75Å; F51-V70 HydrophobicContact CG-CG1 3.65Å; F51-L81 HydrophobicContact CB-CD1 4.29Å; F51-L81 HydrophobicContact CD2-CD1 4.45Å
52	Y	96.8	Very high	94.9	Very high	8 Å²	8	73.1 Å²	73.1	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	146.3	169.7	165.6	-102.5	0	0	0	109.4	L36 F37 F49 D54 R57 S58 H59	L36-Y52 CarbonylContact O-C 3.6Å; L36-Y52 VanDerWaalsContact O-CA 3.32Å; L36-Y52 WeakPolarHBondContact O-CA 3.43Å; L36-Y52 WeakPolarHBondContact O-CD2 3.4Å; F37-Y52 AromaticContact CD1-CD2 3.75Å; F37-Y52 HydrophobicContact CD1-CD2 3.75Å; F37-Y52 HydrophobicContact CD1-CG 4.45Å; F37-Y52 AromaticContact CE1-CD2 3.15Å; F37-Y52 HydrophobicContact CE1-CD2 3.15Å; F37-Y52 AromaticContact CE1-CE2 3.79Å; F37-Y52 HydrophobicContact CE1-CE2 3.79Å; F37-Y52 HydrophobicContact CE1-CG 4.02Å; F37-Y52 HydrophobicContact CE2-CD2 4.1Å; F37-Y52 HydrophobicContact CE2-CE2 4.2Å; F37-Y52 HydrophobicContact CG-CD2 4.4Å; F37-Y52 AromaticContact CZ-CD2 3.31Å; F37-Y52 HydrophobicContact CZ-CD2 3.31Å; F37-Y52 AromaticContact CZ-CE2 3.45Å; F37-Y52 HydrophobicContact CZ-CE2 3.45Å; F37-Y52 VanDerWaalsContact CZ-CE2 3.45Å; F49-Y52 VanDerWaalsContact CZ-N 3.32Å; Y52-D54 HydrophobicContact CE1-CB 4.46Å; Y52-D54 WeakPolarHBondContact CE1-OD2 3.34Å; Y52-D54 WeakPolarHBondContact OH-CB 3.48Å; Y52-D54 PolarHBondContact OH-OD2 2.99Å; Y52-R57 HydrophobicContact CE1-CG 4.41Å; Y52-S58 CarbonylContact O-C 3.59Å; Y52-S58 WeakPolarHBondContact O-CA 3.36Å; Y52-S58 VanDerWaalsContact O-CB 3.25Å; Y52-S58 WeakPolarHBondContact O-CB 3.4Å; Y52-H59 AromaticContact CD1-CD2 3.56Å; Y52-H59 AromaticContact CD1-NE2 3.6Å; Y52-H59 AromaticContact CG-NE2 3.96Å; Y52-H59 PolarHBondContact N-O 3.04Å; Y52-H59 PolarHBondContact O-N 3.29Å
53	G	94.9	Very high	94.9	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	148.9	166.8	0	0	0	0	0	112.8	L36 R57	L36-G53 PolarHBondContact N-O 3.38Å; L36-G53 PolarHBondContact O-N 3.36Å; G53-R57 WeakPolarHBondContact CA-O 3.02Å
54	D	93.4	Very high	94.9	Very high	12 Å²	12	68 Å²	68	6%	0.064	33%	0.327	C	S	.	.			trans	-127.5	-167.9	166	58.9	45.8	0	0	0	108.6	Y52 S56 R57 H72	Y52-D54 HydrophobicContact CE1-CB 4.46Å; Y52-D54 WeakPolarHBondContact CE1-OD2 3.34Å; Y52-D54 WeakPolarHBondContact OH-CB 3.48Å; Y52-D54 PolarHBondContact OH-OD2 2.99Å; D54-S56 PolarHBondContact O-N 3.48Å; D54-S56 WeakPolarHBondContact OD1-CA 3.28Å; D54-S56 WeakPolarHBondContact OD1-CB 3.48Å; D54-S56 PolarHBondContact OD1-N 2.82Å; D54-S56 PolarHBondContact OD1-OG 2.82Å; D54-R57 PolarHBondContact N-O 2.87Å; D54-R57 WeakPolarHBondContact OD1-CG 3.23Å; D54-R57 PolarHBondContact OD1-N 2.95Å; D54-R57 WeakPolarHBondContact OD2-CG 3.43Å; D54-R57 IonicContact OD2-NE 3.29Å; D54-R57 PolarHBondContact OD2-NE 2.62Å; D54-H72 PolarHBondContact O-CE1 2.92Å; D54-H72 PolarHBondContact O-ND1 2.9Å; D54-H72 VanDerWaalsContact O-ND1 3.07Å
55	K	90.8	Very high	94.9	Very high	109 Å²	109	71.4 Å²	71.4	47%	0.474	34%	0.337	S	S	.	.	S	Bend	trans	-63	-26.5	176.6	-82.2	176.6	160.5	-179.3	0	114.3	S32 D33 L74	S32-K55 VanDerWaalsContact O-CD 3.28Å; S32-K55 WeakPolarHBondContact O-CD 3.4Å; S32-K55 WeakPolarHBondContact O-CE 3.1Å; S32-K55 PolarHBondContact O-NZ 2.71Å; D33-K55 HydrophobicContact CB-CD 3.98Å; D33-K55 HydrophobicContact CB-CG 4.46Å; D33-K55 WeakPolarHBondContact OD1-CB 3.39Å; D33-K55 WeakPolarHBondContact OD1-CG 3.31Å; D33-K55 PolarHBondContact OD1-N 3.18Å; K55-L74 HydrophobicContact CD-CD2 4.46Å; K55-L74 HydrophobicContact CG-CD1 4.03Å; K55-L74 HydrophobicContact CG-CD2 3.52Å; K55-L74 HydrophobicContact CG-CG 4.45Å
56	S	88.9	Confident	95	Very high	97 Å²	97	65.5 Å²	65.5	68%	0.678	34%	0.338	S	S	*	.	S	Bend	trans	-103.5	-32.6	-168.7	71.3	0	0	0	0	113.4	D54	D54-S56 PolarHBondContact O-N 3.48Å; D54-S56 WeakPolarHBondContact OD1-CA 3.28Å; D54-S56 WeakPolarHBondContact OD1-CB 3.48Å; D54-S56 PolarHBondContact OD1-N 2.82Å; D54-S56 PolarHBondContact OD1-OG 2.82Å
57	R	91.9	Very high	95.1	Very high	103 Å²	103	65 Å²	65	39%	0.389	33%	0.331	S	S	.	.			trans	-150.6	162.2	-170.7	62.3	-177.3	175.2	175.8	1.1	111.8	Y52 G53 D54	Y52-R57 HydrophobicContact CE1-CG 4.41Å; G53-R57 WeakPolarHBondContact CA-O 3.02Å; D54-R57 PolarHBondContact N-O 2.87Å; D54-R57 WeakPolarHBondContact OD1-CG 3.23Å; D54-R57 PolarHBondContact OD1-N 2.95Å; D54-R57 WeakPolarHBondContact OD2-CG 3.43Å; D54-R57 IonicContact OD2-NE 3.29Å; D54-R57 PolarHBondContact OD2-NE 2.62Å
58	S	94.4	Very high	95.1	Very high	68 Å²	68	59.9 Å²	59.9	48%	0.476	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.6	167.6	68.9	0	0	0	0	110.1	Y52	Y52-S58 CarbonylContact O-C 3.59Å; Y52-S58 WeakPolarHBondContact O-CA 3.36Å; Y52-S58 VanDerWaalsContact O-CB 3.25Å; Y52-S58 WeakPolarHBondContact O-CB 3.4Å
59	H	95.3	Very high	95.2	Very high	94 Å²	94	60.6 Å²	60.6	44%	0.435	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	144.1	172.6	72.8	81.1	0	0	0	111.2	F49 F51 Y52	F49-H59 AromaticContact CE1-CE1 3.8Å; F49-H59 AromaticContact CE1-ND1 3.87Å; F49-H59 AromaticContact CZ-CE1 3.57Å; F49-H59 AromaticContact CZ-ND1 3.85Å; F51-H59 WeakPolarHBondContact CD1-O 3.42Å; Y52-H59 AromaticContact CD1-CD2 3.56Å; Y52-H59 AromaticContact CD1-NE2 3.6Å; Y52-H59 AromaticContact CG-NE2 3.96Å; Y52-H59 PolarHBondContact N-O 3.04Å; Y52-H59 PolarHBondContact O-N 3.29Å
60	G	96.3	Very high	95.1	Very high	30 Å²	30	58.9 Å²	58.9	31%	0.309	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	170.8	177.1	0	0	0	0	0	112.9	V50	V50-G60 CarbonylContact O-C 3.48Å; V50-G60 WeakPolarHBondContact O-CA 3.25Å
61	S	96.8	Very high	95.1	Very high	20 Å²	20	63.6 Å²	63.6	14%	0.14	33%	0.334	C	S	.	.			trans	-68.4	168.7	164.4	69.2	0	0	0	0	111.8	F49 V50 F63 A64	F49-S61 WeakPolarHBondContact O-CB 3.22Å; V50-S61 PolarHBondContact O-N 3.05Å; S61-F63 PolarHBondContact O-N 2.89Å; S61-F63 WeakPolarHBondContact OG-CD1 3.32Å; S61-F63 WeakPolarHBondContact OG-CE1 3.23Å; S61-F63 WeakPolarHBondContact OG-CE2 3.45Å; S61-F63 WeakPolarHBondContact OG-CG 3.5Å; S61-F63 WeakPolarHBondContact OG-CZ 3.37Å; S61-A64 WeakPolarHBondContact O-CB 3.39Å; S61-A64 PolarHBondContact O-N 2.8Å; S61-A64 VanDerWaalsContact OG-CB 3.3Å; S61-A64 WeakPolarHBondContact OG-CB 3.4Å; S61-A64 PolarHBondContact OG-N 2.85Å
62	Y	95.7	Very high	95	Very high	212 Å²	212	65 Å²	65	83%	0.831	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-42.4	178	-176.9	-95.2	0	0	0	112.5	A64 K65	Y62-A64 PolarHBondContact O-N 2.9Å; Y62-K65 VanDerWaalsContact O-CB 3.28Å; Y62-K65 WeakPolarHBondContact O-CB 3.35Å; Y62-K65 PolarHBondContact O-N 2.95Å
63	F	94.5	Very high	95	Very high	61 Å²	61	67.8 Å²	67.8	27%	0.268	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.3	178.8	69.7	-103.5	0	0	0	113.2	Q48 F49 V50 S61 K65 F68	Q48-F63 HydrophobicContact CB-CE1 4.36Å; F49-F63 WeakPolarHBondContact O-CE1 3.4Å; F49-F63 WeakPolarHBondContact O-CZ 3.36Å; V50-F63 HydrophobicContact CB-CZ 4.43Å; V50-F63 HydrophobicContact CG1-CE2 4.39Å; V50-F63 HydrophobicContact CG2-CE2 4.48Å; V50-F63 HydrophobicContact CG2-CZ 4.05Å; S61-F63 PolarHBondContact O-N 2.89Å; S61-F63 WeakPolarHBondContact OG-CD1 3.32Å; S61-F63 WeakPolarHBondContact OG-CE1 3.23Å; S61-F63 WeakPolarHBondContact OG-CE2 3.45Å; S61-F63 WeakPolarHBondContact OG-CG 3.5Å; S61-F63 WeakPolarHBondContact OG-CZ 3.37Å; F63-K65 VanDerWaalsContact C-N 3.29Å; F63-F68 HydrophobicContact CE2-CE1 4.5Å; F63-F68 HydrophobicContact CE2-CZ 4.41Å
64	A	94.9	Very high	94.9	Very high	1 Å²	1	71.4 Å²	71.4	1%	0.008	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-17.3	178.4	0	0	0	0	0	112.5	F51 S61 Y62 G66 R67 F68	F51-A64 HydrophobicContact CD2-CB 4.45Å; S61-A64 WeakPolarHBondContact O-CB 3.39Å; S61-A64 PolarHBondContact O-N 2.8Å; S61-A64 VanDerWaalsContact OG-CB 3.3Å; S61-A64 WeakPolarHBondContact OG-CB 3.4Å; S61-A64 PolarHBondContact OG-N 2.85Å; Y62-A64 PolarHBondContact O-N 2.9Å; A64-G66 PolarHBondContact O-N 3.22Å; A64-R67 PolarHBondContact O-N 3.25Å; A64-F68 HydrophobicContact CB-CB 3.65Å; A64-F68 HydrophobicContact CB-CD2 4.12Å; A64-F68 HydrophobicContact CB-CG 3.87Å; A64-F68 WeakPolarHBondContact O-CB 3.44Å; A64-F68 PolarHBondContact O-N 2.94Å
65	K	94.3	Very high	94.8	Very high	169 Å²	169	77.8 Å²	77.8	74%	0.735	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	125.4	-173.2	-168.8	177.1	-177.8	-178.9	0	111.6	Y62 F63 R67	Y62-K65 VanDerWaalsContact O-CB 3.28Å; Y62-K65 WeakPolarHBondContact O-CB 3.35Å; Y62-K65 PolarHBondContact O-N 2.95Å; F63-K65 VanDerWaalsContact C-N 3.29Å; K65-R67 PolarHBondContact O-N 3.02Å
66	G	93.9	Very high	95	Very high	79 Å²	79	78.9 Å²	78.9	81%	0.814	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-5.4	175.2	0	0	0	0	0	115.6	A64	A64-G66 PolarHBondContact O-N 3.22Å
67	R	96.4	Very high	95.3	Very high	60 Å²	60	77.7 Å²	77.7	23%	0.226	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-26.4	177.5	-54	-168.4	-58.9	111.8	-4.1	114.2	A64 K65 S84 P85 D90	A64-R67 PolarHBondContact O-N 3.25Å; K65-R67 PolarHBondContact O-N 3.02Å; R67-S84 CarbonylContact C-O 3.5Å; R67-S84 VanDerWaalsContact CA-O 3.23Å; R67-S84 WeakPolarHBondContact CA-O 3.32Å; R67-S84 PolarHBondContact O-N 2.75Å; R67-S84 VanDerWaalsContact O-O 3.04Å; R67-P85 PolarHBondContact NH1-O 2.84Å; R67-D90 IonicContact CZ-OD1 3.65Å; R67-D90 IonicContact CZ-OD2 3.59Å; R67-D90 IonicContact NH1-OD1 3.49Å; R67-D90 PolarHBondContact NH1-OD1 3.07Å; R67-D90 IonicContact NH1-OD2 2.68Å; R67-D90 PolarHBondContact NH1-OD2 2.82Å; R67-D90 IonicContact NH2-OD1 2.86Å; R67-D90 PolarHBondContact NH2-OD1 3.35Å; R67-D90 IonicContact NH2-OD2 3.56Å
68	F	97.8	Very high	95.5	Very high	11 Å²	11	72.9 Å²	72.9	5%	0.048	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	142.6	-178.9	-67.5	-121.4	0	0	0	109.3	V50 F51 F63 A64 L81 V82 I83 D90 Y94	V50-F68 HydrophobicContact CG1-CD1 3.57Å; V50-F68 HydrophobicContact CG1-CE1 3.95Å; V50-F68 HydrophobicContact CG1-CG 4.49Å; F51-F68 HydrophobicContact CD2-CB 4.31Å; F51-F68 HydrophobicContact CE2-CB 4.31Å; F51-F68 WeakPolarHBondContact CE2-O 3.4Å; F63-F68 HydrophobicContact CE2-CE1 4.5Å; F63-F68 HydrophobicContact CE2-CZ 4.41Å; A64-F68 HydrophobicContact CB-CB 3.65Å; A64-F68 HydrophobicContact CB-CD2 4.12Å; A64-F68 HydrophobicContact CB-CG 3.87Å; A64-F68 WeakPolarHBondContact O-CB 3.44Å; A64-F68 PolarHBondContact O-N 2.94Å; F68-L81 HydrophobicContact CD1-CD1 4.21Å; F68-L81 HydrophobicContact CD1-CD2 4.32Å; F68-L81 HydrophobicContact CD1-CG 4.48Å; F68-V82 CarbonylContact C-O 3.57Å; F68-V82 VanDerWaalsContact CA-O 3.28Å; F68-V82 WeakPolarHBondContact CA-O 3.49Å; F68-I83 HydrophobicContact CD1-CB 4.46Å; F68-I83 HydrophobicContact CD1-CD1 4.13Å; F68-I83 HydrophobicContact CD1-CG1 3.7Å; F68-I83 HydrophobicContact CD1-CG2 4.31Å; F68-I83 HydrophobicContact CD2-CG2 4.16Å; F68-I83 HydrophobicContact CE1-CB 4.32Å; F68-I83 HydrophobicContact CE1-CD1 3.5Å; F68-I83 HydrophobicContact CE1-CG1 3.56Å; F68-I83 HydrophobicContact CE1-CG2 3.91Å; F68-I83 HydrophobicContact CE2-CG2 3.72Å; F68-I83 HydrophobicContact CG-CG1 4.39Å; F68-I83 HydrophobicContact CG-CG2 4.42Å; F68-I83 HydrophobicContact CZ-CB 4.46Å; F68-I83 HydrophobicContact CZ-CD1 4.04Å; F68-I83 HydrophobicContact CZ-CG1 4.15Å; F68-I83 HydrophobicContact CZ-CG2 3.58Å; F68-D90 HydrophobicContact CZ-CB 4.34Å; F68-D90 WeakPolarHBondContact CZ-OD1 3.35Å; F68-Y94 HydrophobicContact CE1-CE1 4.14Å
69	S	97.8	Very high	95.7	Very high	58 Å²	58	69.6 Å²	69.6	41%	0.406	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	167.8	173.1	63.2	0	0	0	0	110.4	V82	S69-V82 PolarHBondContact N-O 2.65Å; S69-V82 PolarHBondContact O-N 2.8Å
70	V	97.6	Very high	95.8	Very high	26 Å²	26	66.4 Å²	66.4	16%	0.158	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136	176.4	-67.3	0	0	0	0	111	F51 F79 H80 L81	F51-V70 HydrophobicContact CB-CG1 3.83Å; F51-V70 HydrophobicContact CD1-CB 4.28Å; F51-V70 HydrophobicContact CD1-CG1 3.51Å; F51-V70 HydrophobicContact CD1-CG2 3.78Å; F51-V70 HydrophobicContact CD2-CG1 4.38Å; F51-V70 HydrophobicContact CE1-CG1 4.15Å; F51-V70 HydrophobicContact CE1-CG2 3.75Å; F51-V70 HydrophobicContact CG-CG1 3.65Å; V70-F79 HydrophobicContact CB-CD2 4.33Å; V70-F79 HydrophobicContact CB-CE1 4.48Å; V70-F79 HydrophobicContact CB-CE2 3.72Å; V70-F79 HydrophobicContact CB-CZ 3.81Å; V70-F79 HydrophobicContact CG1-CE1 3.97Å; V70-F79 HydrophobicContact CG1-CE2 4.08Å; V70-F79 HydrophobicContact CG1-CZ 3.61Å; V70-F79 HydrophobicContact CG2-CE2 3.61Å; V70-F79 HydrophobicContact CG2-CZ 3.81Å; V70-H80 CarbonylContact C-O 3.55Å; V70-H80 VanDerWaalsContact CA-O 3.23Å; V70-H80 WeakPolarHBondContact CA-O 3.12Å; V70-L81 HydrophobicContact CG1-CD1 4.09Å
71	K	97.3	Very high	95.9	Very high	99 Å²	99	65 Å²	65	43%	0.43	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	94.6	167.8	-69.9	174.2	176.7	166.5	0	107.8	H80 V82	K71-H80 HydrophobicContact CB-CB 4.28Å; K71-H80 PolarHBondContact N-O 2.83Å; K71-H80 PolarHBondContact O-N 2.89Å; K71-V82 HydrophobicContact CD-CG2 3.79Å; K71-V82 HydrophobicContact CG-CG2 3.86Å
72	H	96.1	Very high	96	Very high	48 Å²	48	64.2 Å²	64.2	22%	0.222	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	104.7	177.2	-166.4	-179.9	0	0	0	110.2	L36 D54 L74 A78 F79	L36-H72 WeakPolarHBondContact CD1-NE2 3.41Å; D54-H72 PolarHBondContact O-CE1 2.92Å; D54-H72 PolarHBondContact O-ND1 2.9Å; D54-H72 VanDerWaalsContact O-ND1 3.07Å; H72-L74 VanDerWaalsContact CE1-CD2 3.46Å; H72-L74 WeakPolarHBondContact CE1-CD2 3.39Å; H72-L74 VanDerWaalsContact NE2-CD2 3.31Å; H72-L74 WeakPolarHBondContact NE2-CD2 3.25Å; H72-A78 CarbonylContact C-O 3.51Å; H72-A78 WeakPolarHBondContact CA-O 3.2Å; H72-A78 PolarHBondContact CD2-O 2.78Å; H72-F79 HydrophobicContact CB-CD2 3.8Å; H72-F79 HydrophobicContact CB-CE2 4.1Å; H72-F79 AromaticContact CD2-CD2 3.9Å; H72-F79 AromaticContact CG-CD2 3.7Å
73	L	95.7	Very high	96.1	Very high	67 Å²	67	54.3 Å²	54.3	35%	0.351	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	88.8	-179	-57	172.5	0	0	0	109.3	T75 Q76 K77 A78	L73-T75 PolarHBondContact O-N 3.28Å; L73-Q76 HydrophobicContact CB-CB 4.09Å; L73-Q76 HydrophobicContact CB-CG 4.45Å; L73-Q76 CarbonylContact O-C 3.57Å; L73-Q76 PolarHBondContact O-N 3.4Å; L73-Q76 VanDerWaalsContact O-N 3.11Å; L73-K77 PolarHBondContact O-N 2.02Å; L73-A78 HydrophobicContact CB-CB 4.07Å; L73-A78 HydrophobicContact CD1-CB 4.42Å; L73-A78 PolarHBondContact N-O 2.85Å; L73-A78 PolarHBondContact O-N 2.77Å
74	L	92.4	Very high	96.2	Very high	76 Å²	76	53.6 Å²	53.6	40%	0.398	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-55.8	-44.8	-173.3	-67.3	173.4	0	0	0	113.4	K55 H72 Q76 K77	K55-L74 HydrophobicContact CD-CD2 4.46Å; K55-L74 HydrophobicContact CG-CD1 4.03Å; K55-L74 HydrophobicContact CG-CD2 3.52Å; K55-L74 HydrophobicContact CG-CG 4.45Å; H72-L74 VanDerWaalsContact CE1-CD2 3.46Å; H72-L74 WeakPolarHBondContact CE1-CD2 3.39Å; H72-L74 VanDerWaalsContact NE2-CD2 3.31Å; H72-L74 WeakPolarHBondContact NE2-CD2 3.25Å; L74-Q76 VanDerWaalsContact C-N 3.28Å; L74-Q76 PolarHBondContact O-N 2.81Å; L74-K77 PolarHBondContact O-N 3.2Å
75	T	92.9	Very high	96.3	Very high	146 Å²	146	56.7 Å²	56.7	90%	0.896	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-65	-33.1	-179.5	-48.3	0	0	0	0	112.4	L73 K77	L73-T75 PolarHBondContact O-N 3.28Å; T75-K77 VanDerWaalsContact C-N 3.31Å
76	Q	94.9	Very high	96.5	Very high	132 Å²	132	49.4 Å²	49.4	62%	0.617	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-90.5	-0.3	-179.2	-60.9	174.4	27.1	0	0	112.1	L73 L74 A78	L73-Q76 HydrophobicContact CB-CB 4.09Å; L73-Q76 HydrophobicContact CB-CG 4.45Å; L73-Q76 CarbonylContact O-C 3.57Å; L73-Q76 PolarHBondContact O-N 3.4Å; L73-Q76 VanDerWaalsContact O-N 3.11Å; L74-Q76 VanDerWaalsContact C-N 3.28Å; L74-Q76 PolarHBondContact O-N 2.81Å; Q76-A78 VanDerWaalsContact C-N 3.27Å; Q76-A78 HydrophobicContact CB-CB 4.19Å; Q76-A78 PolarHBondContact O-N 3.07Å
77	K	94.9	Very high	96.5	Very high	72 Å²	72	47.2 Å²	47.2	31%	0.313	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	44	53.6	-167.9	-54.2	-169.8	-175.1	-172.7	0	111.6	T26 Y27 D28 S29 L73 L74 T75	T26-K77 CarbonylContact C-O 3.59Å; T26-K77 VanDerWaalsContact CA-O 3.23Å; T26-K77 WeakPolarHBondContact CA-O 3.33Å; T26-K77 WeakPolarHBondContact CB-O 3.47Å; Y27-K77 HydrophobicContact CD1-CB 4.08Å; Y27-K77 WeakPolarHBondContact CD1-O 3.13Å; Y27-K77 HydrophobicContact CD2-CB 4.14Å; Y27-K77 VanDerWaalsContact CE1-CA 3.45Å; Y27-K77 HydrophobicContact CE1-CB 3.89Å; Y27-K77 WeakPolarHBondContact CE1-O 3.5Å; Y27-K77 HydrophobicContact CE2-CB 3.96Å; Y27-K77 HydrophobicContact CE2-CD 4.38Å; Y27-K77 HydrophobicContact CE2-CG 4.24Å; Y27-K77 HydrophobicContact CG-CB 4.19Å; Y27-K77 PolarHBondContact N-O 2.86Å; Y27-K77 WeakPolarHBondContact O-CB 3.26Å; Y27-K77 VanDerWaalsContact O-CD 3.3Å; Y27-K77 WeakPolarHBondContact O-CD 3.4Å; D28-K77 IonicContact OD1-NZ 2.77Å; D28-K77 PolarHBondContact OD1-NZ 3.2Å; S29-K77 PolarHBondContact O-NZ 2.95Å; L73-K77 PolarHBondContact O-N 2.02Å; L74-K77 PolarHBondContact O-N 3.2Å; T75-K77 VanDerWaalsContact C-N 3.31Å
78	A	96.6	Very high	96.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.4	-175.4	0	0	0	0	0	112.2	C25 T26 H72 L73 Q76	C25-A78 WeakPolarHBondContact O-CA 3.45Å; T26-A78 HydrophobicContact CG2-CB 4.14Å; H72-A78 CarbonylContact C-O 3.51Å; H72-A78 WeakPolarHBondContact CA-O 3.2Å; H72-A78 PolarHBondContact CD2-O 2.78Å; L73-A78 HydrophobicContact CB-CB 4.07Å; L73-A78 HydrophobicContact CD1-CB 4.42Å; L73-A78 PolarHBondContact N-O 2.85Å; L73-A78 PolarHBondContact O-N 2.77Å; Q76-A78 VanDerWaalsContact C-N 3.27Å; Q76-A78 HydrophobicContact CB-CB 4.19Å; Q76-A78 PolarHBondContact O-N 3.07Å
79	F	97.4	Very high	96.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	73.8	-178.7	-169.7	-112.2	0	0	0	110.5	C25 L36 W38 V70 H72	C25-F79 PolarHBondContact O-N 2.84Å; L36-F79 HydrophobicContact CB-CB 4.23Å; L36-F79 HydrophobicContact CB-CD1 3.49Å; L36-F79 VanDerWaalsContact CB-CD1 3.49Å; L36-F79 HydrophobicContact CB-CD2 4.05Å; L36-F79 HydrophobicContact CB-CE1 3.72Å; L36-F79 HydrophobicContact CB-CE2 4.28Å; L36-F79 HydrophobicContact CB-CG 3.66Å; L36-F79 HydrophobicContact CB-CZ 4.12Å; L36-F79 HydrophobicContact CD1-CB 3.72Å; L36-F79 HydrophobicContact CD1-CD2 3.94Å; L36-F79 HydrophobicContact CD1-CG 3.83Å; L36-F79 HydrophobicContact CG-CB 4.45Å; L36-F79 HydrophobicContact CG-CG 4.33Å; W38-F79 AromaticContact CD1-CD1 3.61Å; W38-F79 AromaticContact CD1-CE1 3.52Å; W38-F79 AromaticContact NE1-CD1 3.56Å; W38-F79 AromaticContact NE1-CE1 3.97Å; W38-F79 PolarHBondContact NE1-O 2.83Å; V70-F79 HydrophobicContact CB-CD2 4.33Å; V70-F79 HydrophobicContact CB-CE1 4.48Å; V70-F79 HydrophobicContact CB-CE2 3.72Å; V70-F79 HydrophobicContact CB-CZ 3.81Å; V70-F79 HydrophobicContact CG1-CE1 3.97Å; V70-F79 HydrophobicContact CG1-CE2 4.08Å; V70-F79 HydrophobicContact CG1-CZ 3.61Å; V70-F79 HydrophobicContact CG2-CE2 3.61Å; V70-F79 HydrophobicContact CG2-CZ 3.81Å; H72-F79 HydrophobicContact CB-CD2 3.8Å; H72-F79 HydrophobicContact CB-CE2 4.1Å; H72-F79 AromaticContact CD2-CD2 3.9Å; H72-F79 AromaticContact CG-CD2 3.7Å
80	H	98.1	Very high	96.1	Very high	26 Å²	26	53 Å²	53	12%	0.12	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	138.3	-173.1	-54.1	-22.1	0	0	0	111	V22 L23 L24 C25 V70 K71	V22-H80 HydrophobicContact CG1-CB 3.86Å; L23-H80 CarbonylContact O-C 3.56Å; L23-H80 WeakPolarHBondContact O-CA 3.35Å; L23-H80 WeakPolarHBondContact O-CB 3.34Å; L24-H80 HydrophobicContact CD2-CB 4.48Å; C25-H80 PolarHBondContact N-ND1 3.44Å; C25-H80 VanDerWaalsContact N-ND1 3.2Å; C25-H80 PolarHBondContact O-CE1 2.84Å; C25-H80 VanDerWaalsContact O-CE1 3.31Å; C25-H80 PolarHBondContact O-ND1 3.03Å; V70-H80 CarbonylContact C-O 3.55Å; V70-H80 VanDerWaalsContact CA-O 3.23Å; V70-H80 WeakPolarHBondContact CA-O 3.12Å; K71-H80 HydrophobicContact CB-CB 4.28Å; K71-H80 PolarHBondContact N-O 2.83Å; K71-H80 PolarHBondContact O-N 2.89Å
81	L	98.1	Very high	96	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.2	171.9	-177.1	65.9	0	0	0	109.3	V22 L23 W38 V50 F51 F68 V70 I83 Y94	V22-L81 CarbonylContact C-O 3.58Å; V22-L81 WeakPolarHBondContact CA-O 3.3Å; L23-L81 HydrophobicContact CB-CB 4.27Å; L23-L81 HydrophobicContact CD1-CD2 4.27Å; L23-L81 PolarHBondContact N-O 3.23Å; L23-L81 PolarHBondContact O-N 3.41Å; W38-L81 HydrophobicContact CB-CD1 4.47Å; W38-L81 HydrophobicContact CB-CD2 4.09Å; W38-L81 HydrophobicContact CD2-CB 3.68Å; W38-L81 HydrophobicContact CD2-CD2 4.01Å; W38-L81 HydrophobicContact CD2-CG 4.41Å; W38-L81 VanDerWaalsContact CE2-CB 3.49Å; W38-L81 HydrophobicContact CE3-CB 4.32Å; W38-L81 HydrophobicContact CE3-CD2 4.17Å; W38-L81 HydrophobicContact CG-CB 3.84Å; W38-L81 HydrophobicContact CG-CD1 4.31Å; W38-L81 HydrophobicContact CG-CD2 3.99Å; W38-L81 HydrophobicContact CG-CG 4.29Å; W38-L81 HydrophobicContact CZ2-CB 3.96Å; V50-L81 HydrophobicContact CG1-CD1 4.1Å; V50-L81 HydrophobicContact CG1-CD2 3.9Å; F51-L81 HydrophobicContact CB-CD1 4.29Å; F51-L81 HydrophobicContact CD2-CD1 4.45Å; F68-L81 HydrophobicContact CD1-CD1 4.21Å; F68-L81 HydrophobicContact CD1-CD2 4.32Å; F68-L81 HydrophobicContact CD1-CG 4.48Å; V70-L81 HydrophobicContact CG1-CD1 4.09Å; L81-I83 HydrophobicContact CD2-CD1 4.36Å; L81-I83 HydrophobicContact CD2-CG1 4.38Å; L81-I83 HydrophobicContact CG-CG1 4.26Å; L81-Y94 HydrophobicContact CD2-CD1 3.71Å; L81-Y94 HydrophobicContact CD2-CE1 3.96Å
82	V	98.1	Very high	96	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.03	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.8	174.2	-175	0	0	0	0	108.1	E20 V21 V22 F68 S69 K71	E20-V82 HydrophobicContact CG-CG1 3.91Å; V21-V82 WeakPolarHBondContact O-CA 3.27Å; V22-V82 HydrophobicContact CG1-CG2 4.36Å; V22-V82 HydrophobicContact CG2-CG1 4.47Å; V22-V82 HydrophobicContact CG2-CG2 4.25Å; F68-V82 CarbonylContact C-O 3.57Å; F68-V82 VanDerWaalsContact CA-O 3.28Å; F68-V82 WeakPolarHBondContact CA-O 3.49Å; S69-V82 PolarHBondContact N-O 2.65Å; S69-V82 PolarHBondContact O-N 2.8Å; K71-V82 HydrophobicContact CD-CG2 3.79Å; K71-V82 HydrophobicContact CG-CG2 3.86Å
83	I	97.8	Very high	96	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.3	175.6	-46.6	176.8	0	0	0	107.5	E20 V21 L23 F68 L81 V86 Y94	E20-I83 WeakPolarHBondContact CA-O 3.23Å; V21-I83 HydrophobicContact CG1-CB 3.85Å; V21-I83 HydrophobicContact CG1-CD1 4.16Å; V21-I83 HydrophobicContact CG1-CG1 4.19Å; V21-I83 PolarHBondContact N-O 3.04Å; V21-I83 PolarHBondContact O-N 3.29Å; L23-I83 HydrophobicContact CD1-CD1 4.43Å; F68-I83 HydrophobicContact CD1-CB 4.46Å; F68-I83 HydrophobicContact CD1-CD1 4.13Å; F68-I83 HydrophobicContact CD1-CG1 3.7Å; F68-I83 HydrophobicContact CD1-CG2 4.31Å; F68-I83 HydrophobicContact CD2-CG2 4.16Å; F68-I83 HydrophobicContact CE1-CB 4.32Å; F68-I83 HydrophobicContact CE1-CD1 3.5Å; F68-I83 HydrophobicContact CE1-CG1 3.56Å; F68-I83 HydrophobicContact CE1-CG2 3.91Å; F68-I83 HydrophobicContact CE2-CG2 3.72Å; F68-I83 HydrophobicContact CG-CG1 4.39Å; F68-I83 HydrophobicContact CG-CG2 4.42Å; F68-I83 HydrophobicContact CZ-CB 4.46Å; F68-I83 HydrophobicContact CZ-CD1 4.04Å; F68-I83 HydrophobicContact CZ-CG1 4.15Å; F68-I83 HydrophobicContact CZ-CG2 3.58Å; L81-I83 HydrophobicContact CD2-CD1 4.36Å; L81-I83 HydrophobicContact CD2-CG1 4.38Å; L81-I83 HydrophobicContact CG-CG1 4.26Å; I83-V86 HydrophobicContact CB-CG2 4.13Å; I83-V86 HydrophobicContact CG2-CG2 3.94Å; I83-Y94 HydrophobicContact CD1-CE1 3.99Å; I83-Y94 HydrophobicContact CD1-CE2 4.32Å
84	S	97.6	Very high	96.1	Very high	46 Å²	46	51.7 Å²	51.7	32%	0.322	30%	0.295	S	S	.	.	S	Bend	trans	-158.8	121.9	-177.4	-171.5	0	0	0	0	111.4	R67	R67-S84 CarbonylContact C-O 3.5Å; R67-S84 VanDerWaalsContact CA-O 3.23Å; R67-S84 WeakPolarHBondContact CA-O 3.32Å; R67-S84 PolarHBondContact O-N 2.75Å; R67-S84 VanDerWaalsContact O-O 3.04Å
85	P	97.4	Very high	96.3	Very high	65 Å²	65	52.8 Å²	52.8	42%	0.422	30%	0.295	S	S	.	.	S	Bend	cis	-73.9	144.2	-9.2	29.8	-33.6	0	0	0	111.5	R67	R67-P85 PolarHBondContact NH1-O 2.84Å
86	V	96.9	Very high	96.5	Very high	16 Å²	16	46.2 Å²	46.2	10%	0.097	26%	0.255	C	S	.	.			trans	-68.9	138	169.6	174.1	0	0	0	0	110.5	V15 S17 G18 S19 V21 I83	V15-V86 HydrophobicContact CG1-CB 4.33Å; V15-V86 HydrophobicContact CG1-CG1 4.31Å; V15-V86 HydrophobicContact CG1-CG2 4.03Å; S17-V86 WeakPolarHBondContact CA-O 3.41Å; S17-V86 PolarHBondContact OG-O 2.92Å; G18-V86 PolarHBondContact N-O 2.91Å; S19-V86 WeakPolarHBondContact O-CG2 3.39Å; S19-V86 PolarHBondContact O-N 2.67Å; V21-V86 HydrophobicContact CB-CG2 4.3Å; V21-V86 HydrophobicContact CG1-CG2 3.59Å; I83-V86 HydrophobicContact CB-CG2 4.13Å; I83-V86 HydrophobicContact CG2-CG2 3.94Å
87	S	95.8	Very high	96.6	Very high	33 Å²	33	41.4 Å²	41.4	23%	0.231	24%	0.238	C	C	.	.			trans	-119.5	166.1	169.2	78.6	0	0	0	0	111.3	E89 D90	S87-E89 PolarHBondContact O-N 3.49Å; S87-E89 PolarHBondContact OG-N 2.6Å; S87-D90 PolarHBondContact N-OD2 3.31Å; S87-D90 WeakPolarHBondContact O-CB 3.47Å; S87-D90 PolarHBondContact O-N 2.81Å; S87-D90 PolarHBondContact OG-OD2 3.41Å
88	T	94.1	Very high	96.6	Very high	122 Å²	122	40 Å²	40	75%	0.748	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-59.4	-29.4	175.9	49.7	0	0	0	0	112.7	D90 S91	T88-D90 PolarHBondContact O-N 3.11Å; T88-S91 WeakPolarHBondContact O-CB 3.12Å; T88-S91 PolarHBondContact O-N 3.06Å
89	E	93.8	Very high	96.3	Very high	122 Å²	122	41.7 Å²	41.7	57%	0.57	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-70	-14.4	177.2	-60.1	-175.8	160.8	0	0	113.6	R42 S87 S91	R42-E89 PolarHBondContact NH1-O 3.49Å; S87-E89 PolarHBondContact O-N 3.49Å; S87-E89 PolarHBondContact OG-N 2.6Å; E89-S91 VanDerWaalsContact C-N 3.28Å
90	D	95.4	Very high	95.6	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.043	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-84.4	-6.3	178.3	-56.5	-37.3	0	0	0	112.4	R40 R67 F68 S87 T88 A92 Y94	R40-D90 IonicContact NH1-OD1 3.72Å; R67-D90 IonicContact CZ-OD1 3.65Å; R67-D90 IonicContact CZ-OD2 3.59Å; R67-D90 IonicContact NH1-OD1 3.49Å; R67-D90 PolarHBondContact NH1-OD1 3.07Å; R67-D90 IonicContact NH1-OD2 2.68Å; R67-D90 PolarHBondContact NH1-OD2 2.82Å; R67-D90 IonicContact NH2-OD1 2.86Å; R67-D90 PolarHBondContact NH2-OD1 3.35Å; R67-D90 IonicContact NH2-OD2 3.56Å; F68-D90 HydrophobicContact CZ-CB 4.34Å; F68-D90 WeakPolarHBondContact CZ-OD1 3.35Å; S87-D90 PolarHBondContact N-OD2 3.31Å; S87-D90 WeakPolarHBondContact O-CB 3.47Å; S87-D90 PolarHBondContact O-N 2.81Å; S87-D90 PolarHBondContact OG-OD2 3.41Å; T88-D90 PolarHBondContact O-N 3.11Å; D90-A92 PolarHBondContact O-N 2.87Å; D90-A92 VanDerWaalsContact O-N 3.09Å; D90-Y94 VanDerWaalsContact O-CE2 3.28Å; D90-Y94 WeakPolarHBondContact O-CE2 3.31Å; D90-Y94 PolarHBondContact O-OH 3.4Å
91	S	95.4	Very high	94.3	Very high	84 Å²	84	49.6 Å²	49.6	59%	0.587	29%	0.286	S	S	*	.			trans	-62	110.4	175.7	-171.2	0	0	0	0	110.8	T88 E89	T88-S91 WeakPolarHBondContact O-CB 3.12Å; T88-S91 PolarHBondContact O-N 3.06Å; E89-S91 VanDerWaalsContact C-N 3.28Å
92	A	96.3	Very high	92.3	Very high	26 Å²	26	57.1 Å²	57.1	22%	0.215	32%	0.323	C	S	.	.	S	Bend	trans	-167.6	165.5	-175.4	0	0	0	0	0	109.8	R40 I41 R42 D90 Y94	R40-A92 HydrophobicContact CB-CB 3.95Å; R40-A92 HydrophobicContact CG-CB 4.34Å; I41-A92 WeakPolarHBondContact O-CA 3.23Å; I41-A92 WeakPolarHBondContact O-CB 3.01Å; R42-A92 HydrophobicContact CG-CB 4.2Å; D90-A92 PolarHBondContact O-N 2.87Å; D90-A92 VanDerWaalsContact O-N 3.09Å; A92-Y94 HydrophobicContact CB-CD2 4.41Å; A92-Y94 HydrophobicContact CB-CE2 3.9Å; A92-Y94 WeakPolarHBondContact O-CD2 3.37Å
93	T	96.4	Very high	90.4	Very high	74 Å²	74	61 Å²	61	45%	0.454	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.1	164.8	-49.7	0	0	0	0	109.2	R40 I41 Y95	R40-T93 CarbonylContact C-O 3.52Å; R40-T93 VanDerWaalsContact CA-O 3.23Å; R40-T93 WeakPolarHBondContact CA-O 3.3Å; I41-T93 PolarHBondContact N-O 2.85Å; I41-T93 PolarHBondContact O-N 2.86Å; T93-Y95 HydrophobicContact CG2-CD2 4.36Å; T93-Y95 HydrophobicContact CG2-CE1 4.25Å; T93-Y95 HydrophobicContact CG2-CE2 3.51Å; T93-Y95 VanDerWaalsContact CG2-CZ 3.46Å; T93-Y95 WeakPolarHBondContact CG2-OH 3.46Å
94	Y	97.2	Very high	88.2	Confident	27 Å²	27	66.6 Å²	66.6	11%	0.106	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.3	-178.4	-71.6	-98.9	0	0	0	111.4	Q8 L23 Y39 R40 V50 F68 L81 I83 D90 A92	Q8-Y94 PolarHBondContact NE2-O 3.14Å; L23-Y94 VanDerWaalsContact CD1-CB 3.49Å; L23-Y94 HydrophobicContact CD1-CD1 3.91Å; L23-Y94 HydrophobicContact CD1-CD2 3.68Å; L23-Y94 HydrophobicContact CD1-CE2 4.4Å; L23-Y94 HydrophobicContact CD1-CG 3.41Å; L23-Y94 VanDerWaalsContact CD1-CG 3.41Å; Y39-Y94 CarbonylContact O-C 3.53Å; Y39-Y94 VanDerWaalsContact O-CA 3.32Å; Y39-Y94 WeakPolarHBondContact O-CA 3.45Å; R40-Y94 HydrophobicContact CB-CD1 3.74Å; R40-Y94 HydrophobicContact CB-CE1 3.7Å; R40-Y94 HydrophobicContact CB-CG 4.19Å; R40-Y94 HydrophobicContact CG-CE1 4.39Å; V50-Y94 HydrophobicContact CG2-CD1 4.33Å; V50-Y94 HydrophobicContact CG2-CE1 4.13Å; F68-Y94 HydrophobicContact CE1-CE1 4.14Å; L81-Y94 HydrophobicContact CD2-CD1 3.71Å; L81-Y94 HydrophobicContact CD2-CE1 3.96Å; I83-Y94 HydrophobicContact CD1-CE1 3.99Å; I83-Y94 HydrophobicContact CD1-CE2 4.32Å; D90-Y94 VanDerWaalsContact O-CE2 3.28Å; D90-Y94 WeakPolarHBondContact O-CE2 3.31Å; D90-Y94 PolarHBondContact O-OH 3.4Å; A92-Y94 HydrophobicContact CB-CD2 4.41Å; A92-Y94 HydrophobicContact CB-CE2 3.9Å; A92-Y94 WeakPolarHBondContact O-CD2 3.37Å
95	Y	97.4	Very high	85.9	Confident	100 Å²	100	68.2 Å²	68.2	39%	0.392	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.4	-177.6	-64.4	-85.4	0	0	0	110.6	W38 Y39 I41 T93	W38-Y95 CarbonylContact C-O 3.56Å; W38-Y95 WeakPolarHBondContact CA-O 3.46Å; Y39-Y95 PolarHBondContact N-O 2.8Å; Y39-Y95 PolarHBondContact O-N 3.41Å; I41-Y95 HydrophobicContact CB-CE2 4.2Å; I41-Y95 HydrophobicContact CD1-CD2 4.1Å; I41-Y95 HydrophobicContact CD1-CE2 3.5Å; I41-Y95 HydrophobicContact CG1-CD2 4.05Å; I41-Y95 HydrophobicContact CG1-CE2 3.71Å; T93-Y95 HydrophobicContact CG2-CD2 4.36Å; T93-Y95 HydrophobicContact CG2-CE1 4.25Å; T93-Y95 HydrophobicContact CG2-CE2 3.51Å; T93-Y95 VanDerWaalsContact CG2-CZ 3.46Å; T93-Y95 WeakPolarHBondContact CG2-OH 3.46Å
96	C	97.3	Very high	83.4	Confident	8 Å²	8	76.5 Å²	76.5	5%	0.054	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	140	169.9	-172.5	0	0	0	0	109	Q8 C25 F37 W38	Q8-C96 VanDerWaalsContact CD-N 3.3Å; Q8-C96 HydrophobicContact CG-CB 3.73Å; C25-C96 HydrophobicContact CB-CB 3.49Å; C25-C96 VanDerWaalsContact CB-CB 3.49Å; C25-C96 WeakPolarHBondContact CB-SG 3.28Å; C25-C96 WeakPolarHBondContact SG-CB 3.17Å; C25-C96 CovalentContact SG-SG 2.02Å; C25-C96 PolarHBondContact SG-SG 3.34Å; F37-C96 CarbonylContact O-C 3.54Å; F37-C96 WeakPolarHBondContact O-CA 3.19Å; W38-C96 HydrophobicContact CD2-CB 4.31Å; W38-C96 HydrophobicContact CE3-CB 4.26Å; W38-C96 HydrophobicContact CH2-CB 4.03Å; W38-C96 HydrophobicContact CZ2-CB 4.05Å; W38-C96 HydrophobicContact CZ3-CB 4.12Å
97	A	96.2	Very high	80.7	Confident	31 Å²	31	85.4 Å²	85.4	26%	0.256	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	162.3	177.1	0	0	0	0	0	111.1	F37 Y39	F37-A97 HydrophobicContact CB-CB 4.35Å; F37-A97 PolarHBondContact N-O 3.07Å; F37-A97 PolarHBondContact O-N 2.81Å; Y39-A97 HydrophobicContact CD2-CB 4.26Å; Y39-A97 HydrophobicContact CE2-CB 3.97Å
98	M	94.8	Very high	78.3	Confident	41 Å²	41	92.8 Å²	92.8	20%	0.202	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.9	179.4	-178.4	173.6	58.9	0	0	109.9	D4 V6 Y27 P34 G35 L36	D4-M98 HydrophobicContact CB-CE 3.65Å; V6-M98 HydrophobicContact CG1-CB 3.58Å; Y27-M98 HydrophobicContact CD2-SD 3.82Å; Y27-M98 HydrophobicContact CG-SD 4.19Å; P34-M98 HydrophobicContact CB-CG 3.73Å; P34-M98 HydrophobicContact CB-SD 3.69Å; P34-M98 HydrophobicContact CG-SD 4.01Å; G35-M98 CarbonylContact O-C 3.49Å; G35-M98 VanDerWaalsContact O-CA 3.31Å; G35-M98 WeakPolarHBondContact O-CA 3.28Å; L36-M98 HydrophobicContact CD2-CB 3.96Å; L36-M98 HydrophobicContact CD2-CG 3.82Å; L36-M98 HydrophobicContact CD2-SD 4.15Å
99	S	91.5	Very high	77.5	Confident	37 Å²	37	91.4 Å²	91.4	26%	0.259	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.8	169.2	-178.7	0	0	0	0	109.4	P34 G35 M101	P34-S99 WeakPolarHBondContact CA-O 2.83Å; G35-S99 PolarHBondContact N-O 3.02Å; G35-S99 PolarHBondContact O-N 2.77Å; S99-M101 PolarHBondContact OG-N 3.18Å
100	T	82.8	Confident	76.7	Confident	42 Å²	42	89.7 Å²	89.7	26%	0.258	48%	0.479	S	S	.	.			trans	-89.8	-7.5	177.4	56.8	0	0	0	0	112.7	D4 Y31	D4-T100 HydrophobicContact CB-CG2 4.35Å; D4-T100 WeakPolarHBondContact OD2-CG2 3.49Å; Y31-T100 HydrophobicContact CD2-CG2 3.32Å; Y31-T100 HydrophobicContact CE2-CG2 3.42Å; Y31-T100 VanDerWaalsContact CE2-CG2 3.42Å; Y31-T100 HydrophobicContact CG-CG2 4.03Å
101	M	69.8	Low	75.6	Confident	151 Å²	151	94.3 Å²	94.3	74%	0.744	50%	0.504	S	S	*	.	S	Bend	trans	-82.4	123.8	174.8	-58.4	-167	111.1	0	0	109.7	S99 Q103	S99-M101 PolarHBondContact OG-N 3.18Å; M101-Q103 PolarHBondContact O-N 3.07Å; M101-Q103 VanDerWaalsContact O-N 3.07Å
102	M	57.1	Low	74.5	Confident	157 Å²	157	94.9 Å²	94.9	77%	0.773	50%	0.499	S	S	*	.			trans	-54.5	114.7	171	-72.7	-177.7	154.5	0	0	109.3	V104	M102-V104 PolarHBondContact O-N 3.37Å
103	Q	56.8	Low	73.1	Confident	86 Å²	86	99.2 Å²	99.2	40%	0.402	52%	0.517	S	S	.	.			trans	-72.9	103.3	171.9	-67.9	-155.1	13.6	0	0	108.8	M101	M101-Q103 PolarHBondContact O-N 3.07Å; M101-Q103 VanDerWaalsContact O-N 3.07Å
104	V	51.5	Low	71.5	Confident	122 Å²	122	100.9 Å²	100.9	74%	0.739	52%	0.521	S	S	*	.			trans	-51.5	128.6	167.3	-178.4	0	0	0	0	107.5	M102 R106	M102-V104 PolarHBondContact O-N 3.37Å; V104-R106 PolarHBondContact O-N 3.11Å
105	P	49.4	Very low	69.7	Low	81 Å²	81	106.1 Å²	106.1	53%	0.526	55%	0.55	S	S	.	*			trans	-54.6	120.1	177.9	-21.1	30.6	0	0	0	109.3	K107	P105-K107 PolarHBondContact O-N 2.63Å
106	R	46.4	Very low	67.6	Low	238 Å²	238	106.6 Å²	106.6	90%	0.898	56%	0.563	S	S	*	*			trans	-62.9	110.6	164.1	-68.9	-170.2	-154.9	168.1	6.6	106.2	V104 S108	V104-R106 PolarHBondContact O-N 3.11Å; R106-S108 PolarHBondContact O-N 3.32Å
107	K	39.7	Very low	65.1	Low	204 Å²	204	114.8 Å²	114.8	89%	0.887	61%	0.605	S	S	*	*			trans	-63.1	119.5	165.2	-76.4	-175.7	175.6	-177.8	0	106.9	P105	P105-K107 PolarHBondContact O-N 2.63Å
108	S	45.3	Very low	62.3	Low	188 Å²	188	122.5 Å²	122.5	100%	1.315	64%	0.637	S	S	*	*			trans	-72.6	0	157.8	59.8	0	0	0	0	109.3	R106	R106-S108 PolarHBondContact O-N 3.32Å

Retrieved 108 of 108 residues in 526 ms (Link to these results)

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