A0A3B3U6D9_9TELE Loading...

Large ribosomal subunit protein eL22

AlphaFold DB , UniProt , Accession A0A3B3U6D9, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 129 aa.

						>A0A3B3U6D9_9TELE|A0A3B3U6D9
MAPVKQKRAAAGKKSRKAPSWKFTLDLTHPVEDGILDSANFETFLKERIKVNGKTGNLGNIVQVGRMKNKINVTSEKQFSKRYLKYLTKKYLKKNNLRDWLRVVASDKETYELRYFQISQDDEESEADE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.1	Very low	50.9	Low	251 Å²	251	159.2 Å²	159.2	100%	1.236	88%	0.882	S	S	*	*				0	103.9	0	-154.8	145.8	158.9	0	0	107.3
2	A	46.7	Very low	50.9	Low	92 Å²	92	151.9 Å²	151.9	76%	0.76	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-91.8	141.1	-171.9	0	0	0	0	0	111.1
3	P	57.1	Low	50.7	Low	128 Å²	128	156.2 Å²	156.2	83%	0.831	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-80.2	126.9	179.2	31.1	-31	0	0	0	110.8	K5	P3-K5 PolarHBondContact O-N 3.42Å
4	V	50.8	Low	51	Low	140 Å²	140	159.7 Å²	159.7	85%	0.848	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-73.9	117.7	177	177.4	0	0	0	0	109.5	Q6	V4-Q6 PolarHBondContact O-N 3.2Å
5	K	52.2	Low	51.5	Low	205 Å²	205	156 Å²	156	89%	0.891	87%	0.865	S	S	*	*			trans	-68.9	108.1	173.6	-103.3	178	175.6	175.4	0	110.4	P3 K7	P3-K5 PolarHBondContact O-N 3.42Å; K5-K7 PolarHBondContact O-N 3.18Å
6	Q	52.3	Low	51.8	Low	188 Å²	188	161.8 Å²	161.8	88%	0.879	87%	0.869	S	S	*	*			trans	-67.9	111.3	171.2	-126.1	171.9	-25.4	0	0	110.1	V4 R8	V4-Q6 PolarHBondContact O-N 3.2Å; Q6-R8 PolarHBondContact O-N 3.31Å
7	K	48.1	Very low	52.5	Low	209 Å²	209	163.9 Å²	163.9	91%	0.909	87%	0.869	S	S	*	*			trans	-69.1	109.7	168.1	-83.9	-176.9	175.4	177.7	0	108.6	K5 A9	K5-K7 PolarHBondContact O-N 3.18Å; K7-A9 PolarHBondContact O-N 3.21Å
8	R	49.2	Very low	53.4	Low	244 Å²	244	158.8 Å²	158.8	92%	0.921	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-64.7	119.9	167.1	-72.6	-177.8	167.5	-170	-4.1	108.6	Q6 A10	Q6-R8 PolarHBondContact O-N 3.31Å; R8-A10 PolarHBondContact O-N 3.12Å
9	A	48.7	Very low	54.4	Low	99 Å²	99	155.5 Å²	155.5	82%	0.818	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-58.5	123.2	170.8	0	0	0	0	0	108.9	K7 A11	K7-A9 PolarHBondContact O-N 3.21Å; A9-A11 PolarHBondContact O-N 3.27Å
10	A	52.8	Low	56.1	Low	97 Å²	97	150.8 Å²	150.8	80%	0.802	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-60	120.1	174.4	0	0	0	0	0	108.6	R8 G12	R8-A10 PolarHBondContact O-N 3.12Å; A10-G12 PolarHBondContact O-N 3.11Å
11	A	53.2	Low	57.9	Low	98 Å²	98	147.5 Å²	147.5	81%	0.81	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-51.2	116.9	171.9	0	0	0	0	0	108.8	A9 K13	A9-A11 PolarHBondContact O-N 3.27Å; A11-K13 PolarHBondContact O-N 3.27Å; A11-K13 VanDerWaalsContact O-N 3.12Å
12	G	50.1	Low	60.2	Low	72 Å²	72	141 Å²	141	74%	0.742	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-53	119.8	-178.8	0	0	0	0	0	110.2	A10 K14	A10-G12 PolarHBondContact O-N 3.11Å; G12-K14 PolarHBondContact O-N 2.89Å
13	K	49.4	Very low	62.6	Low	208 Å²	208	137.6 Å²	137.6	90%	0.904	73%	0.729	S	S	*	*			trans	-53.9	104.9	164.9	-95.1	175.2	174	173.5	0	106.9	A11 S15	A11-K13 PolarHBondContact O-N 3.27Å; A11-K13 VanDerWaalsContact O-N 3.12Å; K13-S15 VanDerWaalsContact C-N 3.34Å; K13-S15 PolarHBondContact O-N 2.92Å
14	K	55	Low	64.6	Low	205 Å²	205	133.1 Å²	133.1	89%	0.891	70%	0.7	S	S	*	*			trans	-55.9	105.4	161.4	-83	-179	177.7	175.2	0	105.8	G12 R16	G12-K14 PolarHBondContact O-N 2.89Å; K14-R16 PolarHBondContact O-N 3.07Å; K14-R16 VanDerWaalsContact O-N 3.11Å
15	S	58	Low	66.8	Low	104 Å²	104	126.5 Å²	126.5	73%	0.727	66%	0.659	S	S	*	*			trans	-52.7	120.5	170.3	44.7	0	0	0	0	106.9	K13 K17	K13-S15 VanDerWaalsContact C-N 3.34Å; K13-S15 PolarHBondContact O-N 2.92Å; S15-K17 PolarHBondContact O-N 2.9Å
16	R	56.4	Low	69	Low	249 Å²	249	118 Å²	118	94%	0.94	62%	0.623	S	S	*	*			trans	-57.4	109.7	172.2	-77.9	-179.6	176.1	169.2	-1.9	105.9	K14 A18	K14-R16 PolarHBondContact O-N 3.07Å; K14-R16 VanDerWaalsContact O-N 3.11Å; R16-A18 PolarHBondContact O-N 2.59Å
17	K	63.7	Low	71.1	Confident	198 Å²	198	109 Å²	109	86%	0.861	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-52.6	128.8	173.5	-75.5	-174.4	176.8	-175.9	0	107.1	S15	S15-K17 PolarHBondContact O-N 2.9Å
18	A	69.2	Low	73.3	Confident	71 Å²	71	100.5 Å²	100.5	59%	0.587	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-51.6	145.6	175.6	0	0	0	0	0	109.7	R16 S20	R16-A18 PolarHBondContact O-N 2.59Å; A18-S20 PolarHBondContact O-N 3.27Å; A18-S20 VanDerWaalsContact O-N 3.14Å
19	P	72.1	Confident	75.4	Confident	96 Å²	96	92.9 Å²	92.9	62%	0.623	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-55.8	124.2	176	22.9	-31.7	0	0	0	109.2	W21	P19-W21 HydrophobicContact CG-CH2 4.29Å; P19-W21 VanDerWaalsContact O-CZ3 3.28Å; P19-W21 WeakPolarHBondContact O-CZ3 3.28Å
20	S	87.5	Confident	77.6	Confident	61 Å²	61	88.2 Å²	88.2	43%	0.427	48%	0.483	S	S	.	.			trans	-108.6	124.9	176.7	65.9	0	0	0	0	109	A18 K22 S75	A18-S20 PolarHBondContact O-N 3.27Å; A18-S20 VanDerWaalsContact O-N 3.14Å; S20-K22 WeakPolarHBondContact OG-CE 3.29Å; S20-S75 CarbonylContact C-O 3.56Å; S20-S75 WeakPolarHBondContact CA-O 3.03Å
21	W	94.9	Very high	79.6	Confident	82 Å²	82	84.9 Å²	84.9	31%	0.311	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.1	174	-67.3	-93.6	0	0	0	109.2	P19 F23 T74 S75 E76 K77 Q78 F79	P19-W21 HydrophobicContact CG-CH2 4.29Å; P19-W21 VanDerWaalsContact O-CZ3 3.28Å; P19-W21 WeakPolarHBondContact O-CZ3 3.28Å; W21-F23 HydrophobicContact CB-CE2 3.93Å; W21-F23 HydrophobicContact CB-CZ 4.42Å; W21-T74 CarbonylContact O-C 3.59Å; W21-T74 WeakPolarHBondContact O-CA 3.27Å; W21-S75 PolarHBondContact N-O 3.15Å; W21-S75 PolarHBondContact O-N 3.32Å; W21-E76 WeakPolarHBondContact CZ3-O 3.32Å; W21-K77 VanDerWaalsContact CZ3-O 3.32Å; W21-K77 WeakPolarHBondContact CZ3-O 3.37Å; W21-Q78 HydrophobicContact CH2-CB 4.14Å; W21-Q78 HydrophobicContact CZ2-CB 3.96Å; W21-Q78 HydrophobicContact CZ2-CG 4.16Å; W21-Q78 VanDerWaalsContact CZ3-N 3.31Å; W21-F79 HydrophobicContact CB-CB 4.19Å
22	K	96.1	Very high	81.6	Confident	114 Å²	114	86.3 Å²	86.3	50%	0.496	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.8	-179.5	-64.3	-179.9	-177.5	179.1	0	109	S20 V73 T74	S20-K22 WeakPolarHBondContact OG-CE 3.29Å; K22-V73 WeakPolarHBondContact CA-O 3.34Å; K22-T74 HydrophobicContact CG-CG2 3.99Å
23	F	97.9	Very high	83.6	Confident	22 Å²	22	87.6 Å²	87.6	10%	0.096	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146	175.7	-58.3	-65.4	0	0	0	109.8	W21 V73 F79 K81 L84 E109	W21-F23 HydrophobicContact CB-CE2 3.93Å; W21-F23 HydrophobicContact CB-CZ 4.42Å; F23-V73 PolarHBondContact N-O 3.14Å; F23-V73 PolarHBondContact O-N 3.24Å; F23-F79 AromaticContact CD2-CD1 3.62Å; F23-F79 HydrophobicContact CD2-CD1 3.62Å; F23-F79 HydrophobicContact CD2-CE1 4.07Å; F23-F79 AromaticContact CE2-CD1 3.75Å; F23-F79 HydrophobicContact CE2-CD1 3.75Å; F23-F79 VanDerWaalsContact CE2-O 3.27Å; F23-F79 WeakPolarHBondContact CE2-O 3.29Å; F23-K81 HydrophobicContact CD1-CB 3.74Å; F23-K81 HydrophobicContact CD1-CD 4.08Å; F23-K81 HydrophobicContact CD1-CG 3.97Å; F23-K81 HydrophobicContact CE1-CB 3.57Å; F23-K81 HydrophobicContact CE1-CD 4.32Å; F23-K81 HydrophobicContact CE1-CG 4.24Å; F23-K81 HydrophobicContact CE2-CB 4.44Å; F23-K81 HydrophobicContact CG-CB 4.28Å; F23-K81 HydrophobicContact CZ-CB 3.93Å; F23-L84 HydrophobicContact CB-CD2 3.85Å; F23-E109 WeakPolarHBondContact CA-O 3.18Å; F23-E109 HydrophobicContact CD1-CB 4.3Å; F23-E109 WeakPolarHBondContact CD1-O 3.31Å
24	T	97.9	Very high	85.7	Confident	34 Å²	34	80.8 Å²	80.8	21%	0.209	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.2	178.8	-63.8	0	0	0	0	109.9	K70 I71 N72 E109 T110 Y111	T24-K70 HydrophobicContact CG2-CB 4.36Å; T24-K70 HydrophobicContact CG2-CD 4.32Å; T24-I71 CarbonylContact C-O 3.44Å; T24-I71 WeakPolarHBondContact CA-O 3.29Å; T24-N72 WeakPolarHBondContact CG2-OD1 3.47Å; T24-N72 PolarHBondContact OG1-OD1 2.88Å; T24-E109 PolarHBondContact N-O 3.18Å; T24-E109 VanDerWaalsContact N-O 3.13Å; T24-T110 HydrophobicContact CG2-CG2 4.38Å; T24-T110 CarbonylContact O-C 3.56Å; T24-T110 WeakPolarHBondContact O-CA 3.18Å; T24-Y111 PolarHBondContact O-N 3.31Å
25	L	98.1	Very high	87.5	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.4	168.6	-88.8	163.4	0	0	0	108.3	L27 F41 K70 I71 L84 T88 Y111	L25-L27 HydrophobicContact CB-CD2 4.29Å; L25-F41 HydrophobicContact CD1-CE1 3.76Å; L25-F41 HydrophobicContact CD1-CZ 3.85Å; L25-K70 CarbonylContact O-C 3.53Å; L25-K70 VanDerWaalsContact O-CA 3.31Å; L25-K70 WeakPolarHBondContact O-CA 3.36Å; L25-I71 HydrophobicContact CB-CB 4.3Å; L25-I71 PolarHBondContact N-O 3.18Å; L25-I71 PolarHBondContact O-N 2.91Å; L25-L84 HydrophobicContact CD1-CD1 3.65Å; L25-L84 HydrophobicContact CD1-CD2 3.78Å; L25-L84 HydrophobicContact CD1-CG 3.59Å; L25-L84 HydrophobicContact CG-CD2 3.9Å; L25-L84 HydrophobicContact CG-CG 4.13Å; L25-T88 WeakPolarHBondContact CD1-OG1 3.4Å; L25-T88 HydrophobicContact CD2-CG2 4.28Å; L25-Y111 CarbonylContact C-O 3.5Å; L25-Y111 WeakPolarHBondContact CA-O 3.1Å; L25-Y111 VanDerWaalsContact CD2-CB 3.49Å; L25-Y111 HydrophobicContact CD2-CD2 4.47Å; L25-Y111 HydrophobicContact CD2-CG 4.41Å
26	D	97.6	Very high	89.2	Confident	26 Å²	26	69.4 Å²	69.4	14%	0.139	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	119.1	170.7	-155.4	-34.1	0	0	0	109.7	T28 K70 Y111 E112 L113	D26-T28 VanDerWaalsContact OD1-CB 3.26Å; D26-T28 WeakPolarHBondContact OD1-CB 3.32Å; D26-T28 PolarHBondContact OD1-N 2.78Å; D26-T28 PolarHBondContact OD1-OG1 3.44Å; D26-K70 WeakPolarHBondContact OD2-CE 3.42Å; D26-K70 IonicContact OD2-NZ 2.84Å; D26-K70 PolarHBondContact OD2-NZ 2.96Å; D26-Y111 PolarHBondContact N-O 2.98Å; D26-E112 HydrophobicContact CB-CB 4.36Å; D26-E112 HydrophobicContact CB-CG 4.25Å; D26-E112 WeakPolarHBondContact O-CA 3.41Å; D26-L113 PolarHBondContact O-N 3.39Å
27	L	96.3	Very high	91	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.			trans	-117	16.1	-178.6	-46	173.9	0	0	0	110.7	L25 H29 P30 V31 L36 F41 N69 I71 L113	L25-L27 HydrophobicContact CB-CD2 4.29Å; L27-H29 PolarHBondContact O-N 3.24Å; L27-P30 HydrophobicContact CB-CG 4.49Å; L27-P30 WeakPolarHBondContact O-CD 3.32Å; L27-P30 WeakPolarHBondContact O-CG 3.44Å; L27-V31 HydrophobicContact CB-CG2 3.73Å; L27-V31 VanDerWaalsContact O-CB 3.31Å; L27-V31 WeakPolarHBondContact O-CB 3.28Å; L27-V31 WeakPolarHBondContact O-CG2 3.35Å; L27-V31 PolarHBondContact O-N 3.36Å; L27-L36 HydrophobicContact CB-CD2 4.44Å; L27-L36 HydrophobicContact CD1-CD2 3.96Å; L27-F41 HydrophobicContact CD1-CD1 3.58Å; L27-F41 HydrophobicContact CD1-CE1 4.04Å; L27-F41 HydrophobicContact CD1-CG 4.49Å; L27-F41 HydrophobicContact CD2-CD1 4.49Å; L27-F41 HydrophobicContact CD2-CE1 4.27Å; L27-N69 CarbonylContact C-O 3.59Å; L27-N69 VanDerWaalsContact CA-O 3.31Å; L27-N69 WeakPolarHBondContact CA-O 3.16Å; L27-N69 VanDerWaalsContact CB-O 3.29Å; L27-N69 WeakPolarHBondContact CB-O 3.31Å; L27-N69 PolarHBondContact N-O 3.36Å; L27-I71 HydrophobicContact CD1-CG1 3.74Å; L27-L113 HydrophobicContact CD2-CD1 3.42Å; L27-L113 VanDerWaalsContact CD2-CD1 3.42Å; L27-L113 HydrophobicContact CD2-CG 3.79Å
28	T	95.6	Very high	92.5	Very high	31 Å²	31	52.4 Å²	52.4	19%	0.19	30%	0.299	C	S	.	.	H	α-helix	trans	-51.1	-57.8	-171.1	-61.8	0	0	0	0	112.7	D26 V31 E32 N69	D26-T28 VanDerWaalsContact OD1-CB 3.26Å; D26-T28 WeakPolarHBondContact OD1-CB 3.32Å; D26-T28 PolarHBondContact OD1-N 2.78Å; D26-T28 PolarHBondContact OD1-OG1 3.44Å; T28-V31 PolarHBondContact O-N 3.45Å; T28-E32 HydrophobicContact CG2-CG 4.38Å; T28-E32 WeakPolarHBondContact CG2-OE1 3.33Å; T28-E32 WeakPolarHBondContact O-CB 3.48Å; T28-E32 WeakPolarHBondContact O-CG 3.28Å; T28-E32 PolarHBondContact O-N 3.43Å; T28-N69 PolarHBondContact N-O 3.5Å
29	H	93	Very high	93.8	Very high	84 Å²	84	50.4 Å²	50.4	39%	0.389	28%	0.283	S	S	.	.	H	α-helix	trans	-54.6	-58	-178.4	-58.9	-58.5	0	0	0	113.8	L27 V31 E32 D33 E112 Y115	L27-H29 PolarHBondContact O-N 3.24Å; H29-V31 VanDerWaalsContact C-N 3.3Å; H29-V31 PolarHBondContact O-N 3.12Å; H29-E32 PolarHBondContact O-N 2.83Å; H29-D33 VanDerWaalsContact O-CG 3.27Å; H29-D33 PolarHBondContact O-N 2.89Å; H29-D33 VanDerWaalsContact O-N 3.08Å; H29-E112 IonicContact CD2-OE1 2.65Å; H29-E112 IonicContact NE2-OE1 2.8Å; H29-Y115 HydrophobicContact CB-CE2 4.02Å
30	P	95.1	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70.7	-22.7	-176.9	29.2	-38.3	0	0	0	114.4	L27 G34 I35 L36 L101 L113	L27-P30 HydrophobicContact CB-CG 4.49Å; L27-P30 WeakPolarHBondContact O-CD 3.32Å; L27-P30 WeakPolarHBondContact O-CG 3.44Å; P30-G34 PolarHBondContact O-N 2.73Å; P30-I35 HydrophobicContact CB-CD1 3.69Å; P30-I35 HydrophobicContact CB-CG1 3.57Å; P30-I35 WeakPolarHBondContact O-CG1 3.43Å; P30-I35 PolarHBondContact O-N 3.13Å; P30-I35 VanDerWaalsContact O-N 3.09Å; P30-L36 HydrophobicContact CB-CB 3.85Å; P30-L36 HydrophobicContact CG-CB 4.4Å; P30-L36 PolarHBondContact O-N 2.9Å; P30-L101 HydrophobicContact CB-CD1 3.68Å; P30-L101 HydrophobicContact CB-CD2 4.22Å; P30-L101 HydrophobicContact CG-CD1 4.19Å; P30-L113 HydrophobicContact CG-CB 3.97Å; P30-L113 HydrophobicContact CG-CD1 3.79Å
31	V	94.9	Very high	95.3	Very high	28 Å²	28	46.6 Å²	46.6	17%	0.17	25%	0.252	C	S	.	.	H	α-helix	trans	-76.5	-40.5	175.4	171.8	0	0	0	0	110.8	L27 T28 H29 G34 L36	L27-V31 HydrophobicContact CB-CG2 3.73Å; L27-V31 VanDerWaalsContact O-CB 3.31Å; L27-V31 WeakPolarHBondContact O-CB 3.28Å; L27-V31 WeakPolarHBondContact O-CG2 3.35Å; L27-V31 PolarHBondContact O-N 3.36Å; T28-V31 PolarHBondContact O-N 3.45Å; H29-V31 VanDerWaalsContact C-N 3.3Å; H29-V31 PolarHBondContact O-N 3.12Å; V31-G34 PolarHBondContact O-N 2.92Å; V31-L36 HydrophobicContact CG2-CD2 3.82Å; V31-L36 WeakPolarHBondContact CG2-O 3.37Å
32	E	94.3	Very high	95.4	Very high	127 Å²	127	44 Å²	44	59%	0.593	24%	0.243	S	C	*	.	H	α-helix	trans	-68.7	-36.8	178.2	-72.6	177.9	176.9	0	0	112.2	T28 H29 G34 N69	T28-E32 HydrophobicContact CG2-CG 4.38Å; T28-E32 WeakPolarHBondContact CG2-OE1 3.33Å; T28-E32 WeakPolarHBondContact O-CB 3.48Å; T28-E32 WeakPolarHBondContact O-CG 3.28Å; T28-E32 PolarHBondContact O-N 3.43Å; H29-E32 PolarHBondContact O-N 2.83Å; E32-G34 PolarHBondContact O-N 3.04Å; E32-N69 PolarHBondContact OE1-ND2 3.23Å
33	D	93	Very high	95.4	Very high	99 Å²	99	41.8 Å²	41.8	53%	0.529	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.4	175.4	-61.3	-26	0	0	0	113.2	H29 I35 Y115	H29-D33 VanDerWaalsContact O-CG 3.27Å; H29-D33 PolarHBondContact O-N 2.89Å; H29-D33 VanDerWaalsContact O-N 3.08Å; D33-I35 VanDerWaalsContact C-N 3.25Å; D33-I35 PolarHBondContact O-N 2.79Å; D33-Y115 WeakPolarHBondContact OD2-CE2 3.48Å; D33-Y115 PolarHBondContact OD2-OH 3.27Å
34	G	92.2	Very high	95.4	Very high	65 Å²	65	41.3 Å²	41.3	67%	0.67	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.2	6.1	177	0	0	0	0	0	115.5	P30 V31 E32	P30-G34 PolarHBondContact O-N 2.73Å; V31-G34 PolarHBondContact O-N 2.92Å; E32-G34 PolarHBondContact O-N 3.04Å
35	I	93.1	Very high	95.4	Very high	62 Å²	62	39.7 Å²	39.7	32%	0.318	23%	0.228	S	C	.	.	S	Bend	trans	-82.7	-19.2	-178.3	62.8	165.8	0	0	0	113.5	P30 D33 L101 Y115	P30-I35 HydrophobicContact CB-CD1 3.69Å; P30-I35 HydrophobicContact CB-CG1 3.57Å; P30-I35 WeakPolarHBondContact O-CG1 3.43Å; P30-I35 PolarHBondContact O-N 3.13Å; P30-I35 VanDerWaalsContact O-N 3.09Å; D33-I35 VanDerWaalsContact C-N 3.25Å; D33-I35 PolarHBondContact O-N 2.79Å; I35-L101 HydrophobicContact CD1-CD1 3.86Å; I35-L101 HydrophobicContact CD1-CD2 4.25Å; I35-L101 HydrophobicContact CD1-CG 4.23Å; I35-Y115 HydrophobicContact CD1-CE1 4.01Å; I35-Y115 VanDerWaalsContact CD1-OH 3.24Å; I35-Y115 WeakPolarHBondContact CD1-OH 3.45Å
36	L	93.9	Very high	95.3	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.042	25%	0.246	C	C	.	.			trans	-131.7	126.7	179.4	-173.2	149.3	0	0	0	111.1	L27 P30 V31 F41 Y91 L92 L97 L113	L27-L36 HydrophobicContact CB-CD2 4.44Å; L27-L36 HydrophobicContact CD1-CD2 3.96Å; P30-L36 HydrophobicContact CB-CB 3.85Å; P30-L36 HydrophobicContact CG-CB 4.4Å; P30-L36 PolarHBondContact O-N 2.9Å; V31-L36 HydrophobicContact CG2-CD2 3.82Å; V31-L36 WeakPolarHBondContact CG2-O 3.37Å; L36-F41 HydrophobicContact CD2-CB 4.33Å; L36-Y91 HydrophobicContact CD1-CD1 4.47Å; L36-Y91 HydrophobicContact CD1-CE1 4.02Å; L36-Y91 HydrophobicContact CG-CE1 4.24Å; L36-L92 HydrophobicContact CD1-CD2 4.32Å; L36-L97 HydrophobicContact CD1-CD1 4.34Å; L36-L113 HydrophobicContact CD1-CD1 3.83Å
37	D	94.6	Very high	95.3	Very high	83 Å²	83	48.1 Å²	48.1	44%	0.444	27%	0.265	S	S	.	.			trans	-90	117.8	170.7	172.9	24.9	0	0	0	111.2	A39 N40 F41	D37-A39 VanDerWaalsContact C-N 3.27Å; D37-A39 PolarHBondContact O-N 2.82Å; D37-A39 VanDerWaalsContact OD1-CB 3.32Å; D37-A39 WeakPolarHBondContact OD1-CB 3.33Å; D37-A39 PolarHBondContact OD1-N 3.2Å; D37-N40 HydrophobicContact CB-CB 4.07Å; D37-N40 PolarHBondContact O-N 3.05Å; D37-N40 VanDerWaalsContact OD2-CB 3.26Å; D37-N40 WeakPolarHBondContact OD2-CB 3.46Å; D37-N40 PolarHBondContact OD2-N 3.28Å; D37-F41 PolarHBondContact O-N 3.32Å
38	S	95.1	Very high	95.3	Very high	8 Å²	8	52.2 Å²	52.2	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-67.7	-25.9	178.8	64.6	0	0	0	0	113.2	E42 K68	S38-E42 WeakPolarHBondContact O-CB 3.45Å; S38-E42 PolarHBondContact O-N 3.03Å; S38-K68 WeakPolarHBondContact CB-O 3.17Å; S38-K68 PolarHBondContact OG-O 3.28Å
39	A	95.8	Very high	95.4	Very high	28 Å²	28	50.7 Å²	50.7	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-52.1	175.3	0	0	0	0	0	111.1	D37 F41 E42 T43	D37-A39 VanDerWaalsContact C-N 3.27Å; D37-A39 PolarHBondContact O-N 2.82Å; D37-A39 VanDerWaalsContact OD1-CB 3.32Å; D37-A39 WeakPolarHBondContact OD1-CB 3.33Å; D37-A39 PolarHBondContact OD1-N 3.2Å; A39-F41 VanDerWaalsContact C-N 3.29Å; A39-F41 PolarHBondContact O-N 3.48Å; A39-E42 WeakPolarHBondContact O-CB 3.43Å; A39-E42 PolarHBondContact O-N 3.04Å; A39-T43 PolarHBondContact O-N 3.24Å; A39-T43 VanDerWaalsContact O-N 3.07Å; A39-T43 PolarHBondContact O-OG1 3.45Å
40	N	95.9	Very high	95.5	Very high	76 Å²	76	51.8 Å²	51.8	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-58	-43.1	175.8	-178.2	8.4	0	0	0	111.4	D37 E42 T43 F44 Y91	D37-N40 HydrophobicContact CB-CB 4.07Å; D37-N40 PolarHBondContact O-N 3.05Å; D37-N40 VanDerWaalsContact OD2-CB 3.26Å; D37-N40 WeakPolarHBondContact OD2-CB 3.46Å; D37-N40 PolarHBondContact OD2-N 3.28Å; N40-E42 PolarHBondContact O-N 3.05Å; N40-T43 PolarHBondContact O-N 3.2Å; N40-F44 PolarHBondContact O-N 3.23Å; N40-Y91 PolarHBondContact ND2-OH 3.48Å
41	F	97.1	Very high	95.4	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-38.4	177.6	-176.8	-116.2	0	0	0	113.2	L25 L27 L36 D37 A39 F44 L45 I71 T88 Y91	L25-F41 HydrophobicContact CD1-CE1 3.76Å; L25-F41 HydrophobicContact CD1-CZ 3.85Å; L27-F41 HydrophobicContact CD1-CD1 3.58Å; L27-F41 HydrophobicContact CD1-CE1 4.04Å; L27-F41 HydrophobicContact CD1-CG 4.49Å; L27-F41 HydrophobicContact CD2-CD1 4.49Å; L27-F41 HydrophobicContact CD2-CE1 4.27Å; L36-F41 HydrophobicContact CD2-CB 4.33Å; D37-F41 PolarHBondContact O-N 3.32Å; A39-F41 VanDerWaalsContact C-N 3.29Å; A39-F41 PolarHBondContact O-N 3.48Å; F41-F44 HydrophobicContact CD2-CD1 4.38Å; F41-F44 HydrophobicContact CE2-CD1 4.32Å; F41-F44 PolarHBondContact O-N 3.31Å; F41-L45 HydrophobicContact CD1-CD1 4.14Å; F41-L45 HydrophobicContact CE1-CD1 3.59Å; F41-L45 HydrophobicContact CE1-CG 4.21Å; F41-L45 HydrophobicContact CE2-CD1 4.43Å; F41-L45 HydrophobicContact CE2-CD2 4.3Å; F41-L45 HydrophobicContact CE2-CG 4.18Å; F41-L45 HydrophobicContact CZ-CD1 3.75Å; F41-L45 HydrophobicContact CZ-CD2 4.08Å; F41-L45 HydrophobicContact CZ-CG 3.96Å; F41-L45 WeakPolarHBondContact O-CG 3.4Å; F41-L45 PolarHBondContact O-N 3.02Å; F41-I71 HydrophobicContact CD1-CG1 3.91Å; F41-I71 HydrophobicContact CE1-CG1 4.2Å; F41-T88 HydrophobicContact CE2-CG2 4.3Å; F41-T88 HydrophobicContact CZ-CG2 3.92Å; F41-Y91 HydrophobicContact CB-CE1 4.19Å; F41-Y91 HydrophobicContact CB-CE2 4.44Å; F41-Y91 AromaticContact CD2-CD1 3.48Å; F41-Y91 HydrophobicContact CD2-CD1 3.48Å; F41-Y91 VanDerWaalsContact CD2-CD1 3.48Å; F41-Y91 AromaticContact CD2-CD2 3.82Å; F41-Y91 HydrophobicContact CD2-CD2 3.82Å; F41-Y91 AromaticContact CD2-CE1 3.82Å; F41-Y91 HydrophobicContact CD2-CE1 3.82Å; F41-Y91 HydrophobicContact CD2-CE2 4.13Å; F41-Y91 AromaticContact CD2-CG 3.47Å; F41-Y91 HydrophobicContact CD2-CG 3.47Å; F41-Y91 VanDerWaalsContact CD2-CG 3.47Å; F41-Y91 HydrophobicContact CE2-CD1 4Å; F41-Y91 HydrophobicContact CE2-CD2 4.48Å; F41-Y91 AromaticContact CE2-CG 3.85Å; F41-Y91 HydrophobicContact CE2-CG 3.85Å; F41-Y91 HydrophobicContact CG-CD1 4.4Å; F41-Y91 HydrophobicContact CG-CE1 4.36Å
42	E	96.6	Very high	95.1	Very high	27 Å²	27	57.2 Å²	57.2	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-47.7	172.8	-171.1	-165.6	160.8	0	0	111.6	S38 A39 N40 L45 K46 V64 R66 I71	S38-E42 WeakPolarHBondContact O-CB 3.45Å; S38-E42 PolarHBondContact O-N 3.03Å; A39-E42 WeakPolarHBondContact O-CB 3.43Å; A39-E42 PolarHBondContact O-N 3.04Å; N40-E42 PolarHBondContact O-N 3.05Å; E42-L45 PolarHBondContact O-N 3.3Å; E42-K46 HydrophobicContact CG-CD 4.48Å; E42-K46 PolarHBondContact O-N 2.88Å; E42-K46 WeakPolarHBondContact OE1-CE 3.5Å; E42-K46 IonicContact OE1-NZ 3.68Å; E42-K46 PolarHBondContact OE1-NZ 2.83Å; E42-V64 HydrophobicContact CG-CG1 3.96Å; E42-R66 HydrophobicContact CG-CB 4.34Å; E42-R66 WeakPolarHBondContact OE2-CB 3.45Å; E42-R66 IonicContact OE2-NE 3.92Å; E42-I71 HydrophobicContact CB-CD1 4.04Å; E42-I71 HydrophobicContact CG-CD1 4.41Å
43	T	96.5	Very high	95	Very high	68 Å²	68	53.7 Å²	53.7	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-45.5	177.6	-57.4	0	0	0	0	111.4	A39 N40 L45 K46 E47	A39-T43 PolarHBondContact O-N 3.24Å; A39-T43 VanDerWaalsContact O-N 3.07Å; A39-T43 PolarHBondContact O-OG1 3.45Å; N40-T43 PolarHBondContact O-N 3.2Å; T43-L45 VanDerWaalsContact C-N 3.3Å; T43-L45 PolarHBondContact O-N 2.94Å; T43-K46 WeakPolarHBondContact O-CB 2.97Å; T43-K46 PolarHBondContact O-N 2.82Å; T43-K46 VanDerWaalsContact O-N 3.12Å; T43-E47 WeakPolarHBondContact O-CG 3.41Å; T43-E47 PolarHBondContact O-N 2.87Å
44	F	97.6	Very high	95	Very high	13 Å²	13	56.4 Å²	56.4	6%	0.057	31%	0.308	C	S	.	.	H	α-helix	trans	-56.5	-43.2	174.8	171.4	-91.7	0	0	0	112.2	N40 F41 E47 R48 L87 K90 Y91	N40-F44 PolarHBondContact O-N 3.23Å; F41-F44 HydrophobicContact CD2-CD1 4.38Å; F41-F44 HydrophobicContact CE2-CD1 4.32Å; F41-F44 PolarHBondContact O-N 3.31Å; F44-E47 PolarHBondContact O-N 3.21Å; F44-R48 HydrophobicContact CD1-CG 4.45Å; F44-R48 HydrophobicContact CD2-CG 3.83Å; F44-R48 HydrophobicContact CE1-CB 4.33Å; F44-R48 HydrophobicContact CE1-CG 4.23Å; F44-R48 HydrophobicContact CE2-CG 3.63Å; F44-R48 HydrophobicContact CG-CG 4.26Å; F44-R48 HydrophobicContact CZ-CB 4.29Å; F44-R48 HydrophobicContact CZ-CG 3.84Å; F44-R48 VanDerWaalsContact O-CB 3.24Å; F44-R48 WeakPolarHBondContact O-CB 3.38Å; F44-R48 WeakPolarHBondContact O-CG 3.35Å; F44-R48 PolarHBondContact O-N 2.84Å; F44-L87 HydrophobicContact CE1-CB 4.44Å; F44-L87 WeakPolarHBondContact CE1-O 3.45Å; F44-K90 HydrophobicContact CZ-CB 4.38Å; F44-K90 HydrophobicContact CZ-CG 4.34Å; F44-Y91 HydrophobicContact CB-CD2 3.84Å; F44-Y91 HydrophobicContact CB-CE2 4.06Å; F44-Y91 AromaticContact CD1-CD2 3.79Å; F44-Y91 HydrophobicContact CD1-CD2 3.79Å; F44-Y91 HydrophobicContact CD1-CG 4.24Å; F44-Y91 AromaticContact CD2-CD2 3.83Å; F44-Y91 HydrophobicContact CD2-CD2 3.83Å; F44-Y91 HydrophobicContact CE1-CD2 4.29Å; F44-Y91 HydrophobicContact CE1-CG 4.45Å; F44-Y91 HydrophobicContact CE2-CD2 4.29Å; F44-Y91 AromaticContact CG-CD2 3.54Å; F44-Y91 HydrophobicContact CG-CD2 3.54Å; F44-Y91 HydrophobicContact CG-CE2 4.25Å; F44-Y91 HydrophobicContact CG-CG 4.42Å
45	L	97.4	Very high	95.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-42.7	177.3	-72.8	176.4	0	0	0	111.3	F41 E42 T43 E47 R48 I49 V64 I71 L84 L87	F41-L45 HydrophobicContact CD1-CD1 4.14Å; F41-L45 HydrophobicContact CE1-CD1 3.59Å; F41-L45 HydrophobicContact CE1-CG 4.21Å; F41-L45 HydrophobicContact CE2-CD1 4.43Å; F41-L45 HydrophobicContact CE2-CD2 4.3Å; F41-L45 HydrophobicContact CE2-CG 4.18Å; F41-L45 HydrophobicContact CZ-CD1 3.75Å; F41-L45 HydrophobicContact CZ-CD2 4.08Å; F41-L45 HydrophobicContact CZ-CG 3.96Å; F41-L45 WeakPolarHBondContact O-CG 3.4Å; F41-L45 PolarHBondContact O-N 3.02Å; E42-L45 PolarHBondContact O-N 3.3Å; T43-L45 VanDerWaalsContact C-N 3.3Å; T43-L45 PolarHBondContact O-N 2.94Å; L45-E47 VanDerWaalsContact C-N 3.27Å; L45-E47 PolarHBondContact O-N 3.06Å; L45-R48 PolarHBondContact O-N 2.89Å; L45-I49 HydrophobicContact CB-CD1 4.14Å; L45-I49 VanDerWaalsContact O-CB 3.31Å; L45-I49 WeakPolarHBondContact O-CB 3.26Å; L45-I49 WeakPolarHBondContact O-CD1 3.36Å; L45-I49 WeakPolarHBondContact O-CG1 3.26Å; L45-I49 PolarHBondContact O-N 2.8Å; L45-V64 HydrophobicContact CB-CG1 4.3Å; L45-V64 HydrophobicContact CD1-CG1 4.3Å; L45-I71 HydrophobicContact CD1-CG2 3.82Å; L45-L84 HydrophobicContact CD1-CD1 4.33Å; L45-L84 HydrophobicContact CD2-CD1 4.05Å; L45-L87 HydrophobicContact CD2-CB 3.89Å; L45-L87 HydrophobicContact CD2-CD1 4.07Å
46	K	96.1	Very high	95	Very high	86 Å²	86	56.7 Å²	56.7	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-39.1	176.6	-75.8	171.4	168.8	168.9	0	112.2	E42 T43 L58 V64	E42-K46 HydrophobicContact CG-CD 4.48Å; E42-K46 PolarHBondContact O-N 2.88Å; E42-K46 WeakPolarHBondContact OE1-CE 3.5Å; E42-K46 IonicContact OE1-NZ 3.68Å; E42-K46 PolarHBondContact OE1-NZ 2.83Å; T43-K46 WeakPolarHBondContact O-CB 2.97Å; T43-K46 PolarHBondContact O-N 2.82Å; T43-K46 VanDerWaalsContact O-N 3.12Å; K46-L58 HydrophobicContact CB-CD1 4.06Å; K46-L58 HydrophobicContact CG-CD1 4.22Å; K46-L58 WeakPolarHBondContact O-CD1 3.43Å; K46-V64 HydrophobicContact CG-CB 4.2Å; K46-V64 HydrophobicContact CG-CG2 4.37Å
47	E	96.8	Very high	94.8	Very high	116 Å²	116	60.7 Å²	60.7	54%	0.542	34%	0.335	S	S	.	.	H	α-helix	trans	-76.7	-34	178.7	-69.4	174.5	-179.2	0	0	113.7	T43 F44 L45 T55	T43-E47 WeakPolarHBondContact O-CG 3.41Å; T43-E47 PolarHBondContact O-N 2.87Å; F44-E47 PolarHBondContact O-N 3.21Å; L45-E47 VanDerWaalsContact C-N 3.27Å; L45-E47 PolarHBondContact O-N 3.06Å; E47-T55 WeakPolarHBondContact O-CB 3.41Å; E47-T55 WeakPolarHBondContact O-CG2 3.34Å
48	R	97.3	Very high	94.5	Very high	86 Å²	86	58 Å²	58	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-102.4	-16.6	-167.3	-60.2	-62.9	-72.6	149.9	-17.6	114.7	F44 L45 K50 Y83 L87	F44-R48 HydrophobicContact CD1-CG 4.45Å; F44-R48 HydrophobicContact CD2-CG 3.83Å; F44-R48 HydrophobicContact CE1-CB 4.33Å; F44-R48 HydrophobicContact CE1-CG 4.23Å; F44-R48 HydrophobicContact CE2-CG 3.63Å; F44-R48 HydrophobicContact CG-CG 4.26Å; F44-R48 HydrophobicContact CZ-CB 4.29Å; F44-R48 HydrophobicContact CZ-CG 3.84Å; F44-R48 VanDerWaalsContact O-CB 3.24Å; F44-R48 WeakPolarHBondContact O-CB 3.38Å; F44-R48 WeakPolarHBondContact O-CG 3.35Å; F44-R48 PolarHBondContact O-N 2.84Å; L45-R48 PolarHBondContact O-N 2.89Å; R48-K50 PolarHBondContact O-N 3.41Å; R48-Y83 PolarHBondContact O-OH 2.82Å; R48-Y83 VanDerWaalsContact O-OH 3.11Å; R48-L87 HydrophobicContact CB-CD2 3.98Å
49	I	97.1	Very high	94	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.349	C	S	.	.			trans	-64.3	129.7	171.5	-73.5	168.1	0	0	0	109.1	L45 L58 V62 V64 V73 F79 Y83 L87	L45-I49 HydrophobicContact CB-CD1 4.14Å; L45-I49 VanDerWaalsContact O-CB 3.31Å; L45-I49 WeakPolarHBondContact O-CB 3.26Å; L45-I49 WeakPolarHBondContact O-CD1 3.36Å; L45-I49 WeakPolarHBondContact O-CG1 3.26Å; L45-I49 PolarHBondContact O-N 2.8Å; I49-L58 HydrophobicContact CB-CD2 3.85Å; I49-L58 HydrophobicContact CG2-CD2 3.5Å; I49-L58 VanDerWaalsContact CG2-CD2 3.5Å; I49-V62 HydrophobicContact CD1-CG1 4.27Å; I49-V62 HydrophobicContact CG2-CG1 4.27Å; I49-V62 HydrophobicContact CG2-CG2 4.39Å; I49-V64 HydrophobicContact CD1-CG2 3.72Å; I49-V73 HydrophobicContact CD1-CG1 4.46Å; I49-F79 HydrophobicContact CD1-CE2 4.47Å; I49-F79 HydrophobicContact CD1-CZ 4.43Å; I49-F79 HydrophobicContact CG1-CE2 4.46Å; I49-F79 HydrophobicContact CG2-CE2 4.04Å; I49-Y83 HydrophobicContact CG2-CE1 4.44Å; I49-L87 HydrophobicContact CB-CD1 4.46Å; I49-L87 HydrophobicContact CG1-CD1 3.52Å
50	K	95.1	Very high	93.6	Very high	106 Å²	106	65.2 Å²	65.2	46%	0.461	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.2	175.8	-69	179.9	171	-159.5	0	110.5	R48 G53 K54 T55 Y83	R48-K50 PolarHBondContact O-N 3.41Å; K50-G53 WeakPolarHBondContact CD-O 3.4Å; K50-K54 CarbonylContact C-O 3.58Å; K50-K54 VanDerWaalsContact CA-O 3.24Å; K50-K54 WeakPolarHBondContact CA-O 3.43Å; K50-T55 HydrophobicContact CD-CG2 4.45Å; K50-T55 HydrophobicContact CG-CG2 3.54Å; K50-Y83 WeakPolarHBondContact CB-OH 3.42Å; K50-Y83 PolarHBondContact N-OH 3.48Å
51	V	92.4	Very high	93.4	Very high	10 Å²	10	63.4 Å²	63.4	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.4	167.3	-178	0	0	0	0	106.8	G53 K54 L58 I61 V62	V51-G53 PolarHBondContact O-N 3.36Å; V51-K54 PolarHBondContact N-O 2.81Å; V51-K54 PolarHBondContact O-N 2.86Å; V51-L58 HydrophobicContact CG2-CD2 4.34Å; V51-I61 HydrophobicContact CG1-CD1 4.08Å; V51-I61 HydrophobicContact CG1-CG2 4.13Å; V51-V62 HydrophobicContact CG2-CG2 3.74Å
52	N	90	Very high	93.2	Very high	132 Å²	132	63.7 Å²	63.7	71%	0.706	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.1	-173.9	-65.9	-1.9	0	0	0	113.4	K54	N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 2.78Å
53	G	92	Very high	93.2	Very high	54 Å²	54	67.7 Å²	67.7	56%	0.557	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-10.1	176.5	0	0	0	0	0	116	K50 V51	K50-G53 WeakPolarHBondContact CD-O 3.4Å; V51-G53 PolarHBondContact O-N 3.36Å
54	K	93.5	Very high	93.1	Very high	156 Å²	156	65.2 Å²	65.2	68%	0.678	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.7	-178.9	-62.9	-176.2	-179.5	-178.1	0	111.9	K50 V51 N52	K50-K54 CarbonylContact C-O 3.58Å; K50-K54 VanDerWaalsContact CA-O 3.24Å; K50-K54 WeakPolarHBondContact CA-O 3.43Å; V51-K54 PolarHBondContact N-O 2.81Å; V51-K54 PolarHBondContact O-N 2.86Å; N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 2.78Å
55	T	94.5	Very high	93	Very high	62 Å²	62	66.1 Å²	66.1	38%	0.38	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	165.8	170.8	46.9	0	0	0	0	110.8	E47 K50 N57	E47-T55 WeakPolarHBondContact O-CB 3.41Å; E47-T55 WeakPolarHBondContact O-CG2 3.34Å; K50-T55 HydrophobicContact CD-CG2 4.45Å; K50-T55 HydrophobicContact CG-CG2 3.54Å; T55-N57 PolarHBondContact O-N 2.94Å
56	G	89.6	Confident	92.9	Very high	71 Å²	71	72 Å²	72	73%	0.732	40%	0.4	S	S	*	.	S	Bend	trans	74.2	4.7	175.6	0	0	0	0	0	115.3
57	N	88.9	Confident	92.7	Very high	91 Å²	91	73.1 Å²	73.1	49%	0.487	41%	0.408	S	S	.	.			trans	-117.1	51.7	-179	-169.2	32.7	0	0	0	111.8	T55	T55-N57 PolarHBondContact O-N 2.94Å
58	L	88.4	Confident	92.3	Very high	28 Å²	28	75.4 Å²	75.4	15%	0.147	42%	0.416	C	S	.	.			trans	-76.3	-40.7	-179	-64.6	170.2	0	0	0	112	K46 I49 V51 N60 I61 V62	K46-L58 HydrophobicContact CB-CD1 4.06Å; K46-L58 HydrophobicContact CG-CD1 4.22Å; K46-L58 WeakPolarHBondContact O-CD1 3.43Å; I49-L58 HydrophobicContact CB-CD2 3.85Å; I49-L58 HydrophobicContact CG2-CD2 3.5Å; I49-L58 VanDerWaalsContact CG2-CD2 3.5Å; V51-L58 HydrophobicContact CG2-CD2 4.34Å; L58-N60 PolarHBondContact O-N 2.98Å; L58-I61 WeakPolarHBondContact O-CB 3.43Å; L58-I61 PolarHBondContact O-N 3.48Å; L58-V62 HydrophobicContact CD2-CB 3.76Å; L58-V62 HydrophobicContact CD2-CG1 4.15Å; L58-V62 HydrophobicContact CD2-CG2 4.33Å; L58-V62 PolarHBondContact O-N 2.93Å
59	G	85.7	Confident	92.1	Very high	61 Å²	61	72.4 Å²	72.4	63%	0.629	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	-130.5	-177.7	0	0	0	0	0	111.9
60	N	86.4	Confident	92.1	Very high	125 Å²	125	76.4 Å²	76.4	67%	0.668	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	3.1	170	-72.2	-13.7	0	0	0	113.4	L58	L58-N60 PolarHBondContact O-N 2.98Å
61	I	91.6	Very high	92.2	Very high	39 Å²	39	71.4 Å²	71.4	20%	0.2	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-39.4	-172.9	-59.8	173	0	0	0	111.5	V51 L58 S75 E76 K77	V51-I61 HydrophobicContact CG1-CD1 4.08Å; V51-I61 HydrophobicContact CG1-CG2 4.13Å; L58-I61 WeakPolarHBondContact O-CB 3.43Å; L58-I61 PolarHBondContact O-N 3.48Å; I61-S75 CarbonylContact O-C 3.59Å; I61-S75 WeakPolarHBondContact O-CA 3.43Å; I61-S75 PolarHBondContact O-OG 2.8Å; I61-E76 PolarHBondContact O-N 2.57Å; I61-K77 HydrophobicContact CD1-CD 4.49Å; I61-K77 HydrophobicContact CG2-CB 3.76Å; I61-K77 HydrophobicContact CG2-CD 3.82Å; I61-K77 HydrophobicContact CG2-CG 3.7Å
62	V	94.6	Very high	92.4	Very high	6 Å²	6	73.3 Å²	73.3	4%	0.036	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.9	177.1	-177.3	0	0	0	0	108.5	I49 V51 L58 V64 V73 T74 S75	I49-V62 HydrophobicContact CD1-CG1 4.27Å; I49-V62 HydrophobicContact CG2-CG1 4.27Å; I49-V62 HydrophobicContact CG2-CG2 4.39Å; V51-V62 HydrophobicContact CG2-CG2 3.74Å; L58-V62 HydrophobicContact CD2-CB 3.76Å; L58-V62 HydrophobicContact CD2-CG1 4.15Å; L58-V62 HydrophobicContact CD2-CG2 4.33Å; L58-V62 PolarHBondContact O-N 2.93Å; V62-V64 HydrophobicContact CG1-CG2 4.42Å; V62-V73 HydrophobicContact CG1-CG1 3.91Å; V62-T74 CarbonylContact C-O 3.49Å; V62-T74 WeakPolarHBondContact CA-O 3.07Å; V62-S75 WeakPolarHBondContact CG2-OG 3.48Å
63	Q	94.6	Very high	92.7	Very high	112 Å²	112	67 Å²	67	52%	0.523	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.5	175.1	-63.1	-179.4	-4.8	0	0	108.9	V73 T74	Q63-V73 WeakPolarHBondContact O-CA 3.26Å; Q63-T74 PolarHBondContact N-O 2.94Å; Q63-T74 PolarHBondContact O-N 3.4Å
64	V	96.2	Very high	92.9	Very high	15 Å²	15	66.4 Å²	66.4	9%	0.091	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.7	172.5	-174	0	0	0	0	107	E42 L45 K46 I49 V62 I71 N72 V73	E42-V64 HydrophobicContact CG-CG1 3.96Å; L45-V64 HydrophobicContact CB-CG1 4.3Å; L45-V64 HydrophobicContact CD1-CG1 4.3Å; K46-V64 HydrophobicContact CG-CB 4.2Å; K46-V64 HydrophobicContact CG-CG2 4.37Å; I49-V64 HydrophobicContact CD1-CG2 3.72Å; V62-V64 HydrophobicContact CG1-CG2 4.42Å; V64-I71 HydrophobicContact CG1-CG2 3.77Å; V64-N72 CarbonylContact C-O 3.58Å; V64-N72 WeakPolarHBondContact CA-O 3.48Å; V64-V73 HydrophobicContact CG1-CG2 4.4Å; V64-V73 HydrophobicContact CG2-CG2 4.41Å
65	G	95.4	Very high	93	Very high	33 Å²	33	59.1 Å²	59.1	34%	0.34	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.7	179.5	0	0	0	0	0	111.3	I71 N72	G65-I71 WeakPolarHBondContact O-CA 3.38Å; G65-N72 PolarHBondContact N-O 3.11Å; G65-N72 PolarHBondContact O-N 2.92Å
66	R	95.3	Very high	92.8	Very high	122 Å²	122	62 Å²	62	46%	0.46	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.2	176.9	177.8	-173.4	69.2	157.8	0	111.1	E42 I71	E42-R66 HydrophobicContact CG-CB 4.34Å; E42-R66 WeakPolarHBondContact OE2-CB 3.45Å; E42-R66 IonicContact OE2-NE 3.92Å; R66-I71 HydrophobicContact CB-CD1 3.69Å; R66-I71 HydrophobicContact CG-CD1 3.81Å
67	M	91.8	Very high	92.8	Very high	111 Å²	111	62.8 Å²	62.8	55%	0.547	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	77.2	170.2	-73.9	-172.9	-73.3	0	0	108.7	N69 K70 N72	M67-N69 VanDerWaalsContact C-N 3.27Å; M67-N69 PolarHBondContact O-N 2.9Å; M67-K70 HydrophobicContact CB-CB 4.49Å; M67-K70 PolarHBondContact N-O 3.2Å; M67-K70 PolarHBondContact O-N 3.17Å; M67-N72 VanDerWaalsContact CE-CG 3.45Å; M67-N72 WeakPolarHBondContact CE-ND2 3.24Å
68	K	88.7	Confident	93	Very high	163 Å²	163	66.9 Å²	66.9	71%	0.709	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	-75.8	-178.3	-162.7	-173.2	176.5	-174	0	114.9	S38	S38-K68 WeakPolarHBondContact CB-O 3.17Å; S38-K68 PolarHBondContact OG-O 3.28Å
69	N	92.3	Very high	93.2	Very high	24 Å²	24	66.1 Å²	66.1	13%	0.128	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-9.5	-178.7	-65.4	6.6	0	0	0	113.4	L27 T28 E32 M67	L27-N69 CarbonylContact C-O 3.59Å; L27-N69 VanDerWaalsContact CA-O 3.31Å; L27-N69 WeakPolarHBondContact CA-O 3.16Å; L27-N69 VanDerWaalsContact CB-O 3.29Å; L27-N69 WeakPolarHBondContact CB-O 3.31Å; L27-N69 PolarHBondContact N-O 3.36Å; T28-N69 PolarHBondContact N-O 3.5Å; E32-N69 PolarHBondContact OE1-ND2 3.23Å; M67-N69 VanDerWaalsContact C-N 3.27Å; M67-N69 PolarHBondContact O-N 2.9Å
70	K	96.1	Very high	93.7	Very high	84 Å²	84	66.1 Å²	66.1	37%	0.365	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	145.9	-178.1	-57	-167	-175.2	-150.6	0	111.7	T24 L25 D26 M67	T24-K70 HydrophobicContact CG2-CB 4.36Å; T24-K70 HydrophobicContact CG2-CD 4.32Å; L25-K70 CarbonylContact O-C 3.53Å; L25-K70 VanDerWaalsContact O-CA 3.31Å; L25-K70 WeakPolarHBondContact O-CA 3.36Å; D26-K70 WeakPolarHBondContact OD2-CE 3.42Å; D26-K70 IonicContact OD2-NZ 2.84Å; D26-K70 PolarHBondContact OD2-NZ 2.96Å; M67-K70 HydrophobicContact CB-CB 4.49Å; M67-K70 PolarHBondContact N-O 3.2Å; M67-K70 PolarHBondContact O-N 3.17Å
71	I	97.6	Very high	94.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.6	168.9	-61.9	-63.5	0	0	0	109.2	T24 L25 L27 F41 E42 L45 V64 G65 R66 V73	T24-I71 CarbonylContact C-O 3.44Å; T24-I71 WeakPolarHBondContact CA-O 3.29Å; L25-I71 HydrophobicContact CB-CB 4.3Å; L25-I71 PolarHBondContact N-O 3.18Å; L25-I71 PolarHBondContact O-N 2.91Å; L27-I71 HydrophobicContact CD1-CG1 3.74Å; F41-I71 HydrophobicContact CD1-CG1 3.91Å; F41-I71 HydrophobicContact CE1-CG1 4.2Å; E42-I71 HydrophobicContact CB-CD1 4.04Å; E42-I71 HydrophobicContact CG-CD1 4.41Å; L45-I71 HydrophobicContact CD1-CG2 3.82Å; V64-I71 HydrophobicContact CG1-CG2 3.77Å; G65-I71 WeakPolarHBondContact O-CA 3.38Å; R66-I71 HydrophobicContact CB-CD1 3.69Å; R66-I71 HydrophobicContact CG-CD1 3.81Å; I71-V73 HydrophobicContact CG2-CG2 4.25Å
72	N	97.1	Very high	94.5	Very high	50 Å²	50	69.2 Å²	69.2	27%	0.267	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.7	173.2	-77	5	0	0	0	110.1	T24 V64 G65 M67	T24-N72 WeakPolarHBondContact CG2-OD1 3.47Å; T24-N72 PolarHBondContact OG1-OD1 2.88Å; V64-N72 CarbonylContact C-O 3.58Å; V64-N72 WeakPolarHBondContact CA-O 3.48Å; G65-N72 PolarHBondContact N-O 3.11Å; G65-N72 PolarHBondContact O-N 2.92Å; M67-N72 VanDerWaalsContact CE-CG 3.45Å; M67-N72 WeakPolarHBondContact CE-ND2 3.24Å
73	V	96.9	Very high	94.6	Very high	1 Å²	1	71.4 Å²	71.4	1%	0.006	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.6	172.8	-176.5	0	0	0	0	108	K22 F23 I49 V62 Q63 V64 I71 F79 L84	K22-V73 WeakPolarHBondContact CA-O 3.34Å; F23-V73 PolarHBondContact N-O 3.14Å; F23-V73 PolarHBondContact O-N 3.24Å; I49-V73 HydrophobicContact CD1-CG1 4.46Å; V62-V73 HydrophobicContact CG1-CG1 3.91Å; Q63-V73 WeakPolarHBondContact O-CA 3.26Å; V64-V73 HydrophobicContact CG1-CG2 4.4Å; V64-V73 HydrophobicContact CG2-CG2 4.41Å; I71-V73 HydrophobicContact CG2-CG2 4.25Å; V73-F79 HydrophobicContact CG1-CD1 4.42Å; V73-F79 HydrophobicContact CG1-CE1 3.88Å; V73-F79 HydrophobicContact CG1-CE2 4.42Å; V73-F79 HydrophobicContact CG1-CZ 3.89Å; V73-L84 HydrophobicContact CG2-CD1 3.96Å; V73-L84 HydrophobicContact CG2-CD2 4.21Å
74	T	95.6	Very high	94.8	Very high	41 Å²	41	66 Å²	66	25%	0.252	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.3	174.3	-58.9	0	0	0	0	108.9	W21 K22 V62 Q63	W21-T74 CarbonylContact O-C 3.59Å; W21-T74 WeakPolarHBondContact O-CA 3.27Å; K22-T74 HydrophobicContact CG-CG2 3.99Å; V62-T74 CarbonylContact C-O 3.49Å; V62-T74 WeakPolarHBondContact CA-O 3.07Å; Q63-T74 PolarHBondContact N-O 2.94Å; Q63-T74 PolarHBondContact O-N 3.4Å
75	S	94.8	Very high	94.9	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.1	174.1	-169.3	0	0	0	0	112.7	S20 W21 I61 V62 K77	S20-S75 CarbonylContact C-O 3.56Å; S20-S75 WeakPolarHBondContact CA-O 3.03Å; W21-S75 PolarHBondContact N-O 3.15Å; W21-S75 PolarHBondContact O-N 3.32Å; I61-S75 CarbonylContact O-C 3.59Å; I61-S75 WeakPolarHBondContact O-CA 3.43Å; I61-S75 PolarHBondContact O-OG 2.8Å; V62-S75 WeakPolarHBondContact CG2-OG 3.48Å; S75-K77 WeakPolarHBondContact CB-O 3.25Å; S75-K77 PolarHBondContact OG-N 3.05Å; S75-K77 PolarHBondContact OG-O 3.45Å; S75-K77 VanDerWaalsContact OG-O 3.05Å
76	E	92.1	Very high	95	Very high	121 Å²	121	72.7 Å²	72.7	57%	0.565	33%	0.327	S	S	*	.	S	Bend	trans	-85.8	-12.2	170.7	-60.7	-173.8	164	0	0	113	W21 I61	W21-E76 WeakPolarHBondContact CZ3-O 3.32Å; I61-E76 PolarHBondContact O-N 2.57Å
77	K	89.8	Confident	95.1	Very high	89 Å²	89	67 Å²	67	39%	0.387	31%	0.305	S	S	.	.	S	Bend	trans	-111.4	162.9	174.4	-79.8	-169.3	-177.3	179.4	0	110.3	W21 I61 S75 F79	W21-K77 VanDerWaalsContact CZ3-O 3.32Å; W21-K77 WeakPolarHBondContact CZ3-O 3.37Å; I61-K77 HydrophobicContact CD1-CD 4.49Å; I61-K77 HydrophobicContact CG2-CB 3.76Å; I61-K77 HydrophobicContact CG2-CD 3.82Å; I61-K77 HydrophobicContact CG2-CG 3.7Å; S75-K77 WeakPolarHBondContact CB-O 3.25Å; S75-K77 PolarHBondContact OG-N 3.05Å; S75-K77 PolarHBondContact OG-O 3.45Å; S75-K77 VanDerWaalsContact OG-O 3.05Å; K77-F79 PolarHBondContact O-N 3.36Å
78	Q	91.7	Very high	95.4	Very high	177 Å²	177	61.7 Å²	61.7	83%	0.827	28%	0.279	S	S	*	.			trans	-53.4	111.2	-179.9	-169.7	177.9	21.1	0	0	110.5	W21	W21-Q78 HydrophobicContact CH2-CB 4.14Å; W21-Q78 HydrophobicContact CZ2-CB 3.96Å; W21-Q78 HydrophobicContact CZ2-CG 4.16Å; W21-Q78 VanDerWaalsContact CZ3-N 3.31Å
79	F	93.9	Very high	95.9	Very high	11 Å²	11	58.3 Å²	58.3	5%	0.048	26%	0.264	C	S	.	.			trans	-126	130.7	178.3	-169.7	-89.2	0	0	0	107.4	W21 F23 I49 V73 K77 Y83 L84	W21-F79 HydrophobicContact CB-CB 4.19Å; F23-F79 AromaticContact CD2-CD1 3.62Å; F23-F79 HydrophobicContact CD2-CD1 3.62Å; F23-F79 HydrophobicContact CD2-CE1 4.07Å; F23-F79 AromaticContact CE2-CD1 3.75Å; F23-F79 HydrophobicContact CE2-CD1 3.75Å; F23-F79 VanDerWaalsContact CE2-O 3.27Å; F23-F79 WeakPolarHBondContact CE2-O 3.29Å; I49-F79 HydrophobicContact CD1-CE2 4.47Å; I49-F79 HydrophobicContact CD1-CZ 4.43Å; I49-F79 HydrophobicContact CG1-CE2 4.46Å; I49-F79 HydrophobicContact CG2-CE2 4.04Å; V73-F79 HydrophobicContact CG1-CD1 4.42Å; V73-F79 HydrophobicContact CG1-CE1 3.88Å; V73-F79 HydrophobicContact CG1-CE2 4.42Å; V73-F79 HydrophobicContact CG1-CZ 3.89Å; K77-F79 PolarHBondContact O-N 3.36Å; F79-Y83 HydrophobicContact CD2-CD1 4.35Å; F79-Y83 AromaticContact CE2-CD1 3.69Å; F79-Y83 HydrophobicContact CE2-CD1 3.69Å; F79-Y83 HydrophobicContact CE2-CE1 4.06Å; F79-Y83 AromaticContact CZ-CD1 3.97Å; F79-Y83 HydrophobicContact CZ-CD1 3.97Å; F79-L84 HydrophobicContact CE1-CB 4.13Å
80	S	94.9	Very high	96.2	Very high	62 Å²	62	60.5 Å²	60.5	43%	0.434	27%	0.273	S	S	.	.			trans	-100.1	136.2	-178.1	73	0	0	0	0	110.7	R82 Y83 L84	S80-R82 PolarHBondContact O-N 2.79Å; S80-Y83 WeakPolarHBondContact O-CB 3.48Å; S80-Y83 PolarHBondContact O-N 3.13Å; S80-Y83 WeakPolarHBondContact OG-CB 3.31Å; S80-Y83 PolarHBondContact OG-N 3.47Å; S80-L84 PolarHBondContact O-N 2.91Å
81	K	96.7	Very high	96.3	Very high	26 Å²	26	56.9 Å²	56.9	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-52.7	-41.6	169.7	-174.4	170.4	-178.3	-153.6	0	111.3	F23 Y83 L84 K85 D107 K108 T110 Y111	F23-K81 HydrophobicContact CD1-CB 3.74Å; F23-K81 HydrophobicContact CD1-CD 4.08Å; F23-K81 HydrophobicContact CD1-CG 3.97Å; F23-K81 HydrophobicContact CE1-CB 3.57Å; F23-K81 HydrophobicContact CE1-CD 4.32Å; F23-K81 HydrophobicContact CE1-CG 4.24Å; F23-K81 HydrophobicContact CE2-CB 4.44Å; F23-K81 HydrophobicContact CG-CB 4.28Å; F23-K81 HydrophobicContact CZ-CB 3.93Å; K81-Y83 PolarHBondContact O-N 2.84Å; K81-L84 WeakPolarHBondContact O-CB 3.31Å; K81-L84 PolarHBondContact O-N 2.89Å; K81-K85 PolarHBondContact O-N 2.8Å; K81-K85 VanDerWaalsContact O-N 3.12Å; K81-D107 PolarHBondContact NZ-O 3.16Å; K81-K108 WeakPolarHBondContact CD-O 3.17Å; K81-K108 PolarHBondContact NZ-O 2.84Å; K81-T110 VanDerWaalsContact CE-O 3.28Å; K81-T110 WeakPolarHBondContact CE-O 3.49Å; K81-T110 PolarHBondContact NZ-O 3.4Å; K81-Y111 HydrophobicContact CB-CE2 4.38Å; K81-Y111 HydrophobicContact CD-CD2 4.35Å; K81-Y111 HydrophobicContact CD-CE2 3.88Å; K81-Y111 VanDerWaalsContact CE-CE2 3.43Å; K81-Y111 HydrophobicContact CG-CD2 3.86Å; K81-Y111 HydrophobicContact CG-CE2 3.16Å; K81-Y111 VanDerWaalsContact O-CE2 3.28Å; K81-Y111 WeakPolarHBondContact O-CE2 3.41Å
82	R	97.9	Very high	96.3	Very high	202 Å²	202	57 Å²	57	76%	0.762	26%	0.258	S	S	*	.	H	α-helix	trans	-55.8	-38	177.7	-173.4	-178	-62.1	-84.2	-0.3	112.9	S80 L84 K85 Y86	S80-R82 PolarHBondContact O-N 2.79Å; R82-L84 VanDerWaalsContact C-N 3.33Å; R82-K85 WeakPolarHBondContact O-CB 3.39Å; R82-K85 PolarHBondContact O-N 3.21Å; R82-Y86 PolarHBondContact O-N 2.92Å
83	Y	97.6	Very high	96.3	Very high	52 Å²	52	60.5 Å²	60.5	20%	0.204	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-39.8	177.3	-179.1	-140.6	0	0	0	111.9	R48 I49 K50 F79 S80 K81 K85 Y86 L87	R48-Y83 PolarHBondContact O-OH 2.82Å; R48-Y83 VanDerWaalsContact O-OH 3.11Å; I49-Y83 HydrophobicContact CG2-CE1 4.44Å; K50-Y83 WeakPolarHBondContact CB-OH 3.42Å; K50-Y83 PolarHBondContact N-OH 3.48Å; F79-Y83 HydrophobicContact CD2-CD1 4.35Å; F79-Y83 AromaticContact CE2-CD1 3.69Å; F79-Y83 HydrophobicContact CE2-CD1 3.69Å; F79-Y83 HydrophobicContact CE2-CE1 4.06Å; F79-Y83 AromaticContact CZ-CD1 3.97Å; F79-Y83 HydrophobicContact CZ-CD1 3.97Å; S80-Y83 WeakPolarHBondContact O-CB 3.48Å; S80-Y83 PolarHBondContact O-N 3.13Å; S80-Y83 WeakPolarHBondContact OG-CB 3.31Å; S80-Y83 PolarHBondContact OG-N 3.47Å; K81-Y83 PolarHBondContact O-N 2.84Å; Y83-K85 PolarHBondContact O-N 3.12Å; Y83-Y86 AromaticContact CD2-CD1 3.9Å; Y83-Y86 HydrophobicContact CD2-CD1 3.9Å; Y83-Y86 AromaticContact CE2-CD1 3.88Å; Y83-Y86 HydrophobicContact CE2-CD1 3.88Å; Y83-Y86 HydrophobicContact CE2-CE1 4.22Å; Y83-Y86 WeakPolarHBondContact O-CB 3.49Å; Y83-Y86 PolarHBondContact O-N 3.13Å; Y83-L87 HydrophobicContact CD2-CD1 4.49Å; Y83-L87 HydrophobicContact CD2-CG 4.26Å; Y83-L87 HydrophobicContact CE1-CD1 4.09Å; Y83-L87 HydrophobicContact CE2-CD1 3.99Å; Y83-L87 HydrophobicContact CE2-CD2 4.02Å; Y83-L87 HydrophobicContact CE2-CG 3.84Å; Y83-L87 PolarHBondContact O-N 3.04Å
84	L	97.6	Very high	96.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-45.4	173.4	-169.9	57.9	0	0	0	111.5	F23 L25 L45 V73 F79 S80 K81 R82 Y86 L87 T88	F23-L84 HydrophobicContact CB-CD2 3.85Å; L25-L84 HydrophobicContact CD1-CD1 3.65Å; L25-L84 HydrophobicContact CD1-CD2 3.78Å; L25-L84 HydrophobicContact CD1-CG 3.59Å; L25-L84 HydrophobicContact CG-CD2 3.9Å; L25-L84 HydrophobicContact CG-CG 4.13Å; L45-L84 HydrophobicContact CD1-CD1 4.33Å; L45-L84 HydrophobicContact CD2-CD1 4.05Å; V73-L84 HydrophobicContact CG2-CD1 3.96Å; V73-L84 HydrophobicContact CG2-CD2 4.21Å; F79-L84 HydrophobicContact CE1-CB 4.13Å; S80-L84 PolarHBondContact O-N 2.91Å; K81-L84 WeakPolarHBondContact O-CB 3.31Å; K81-L84 PolarHBondContact O-N 2.89Å; R82-L84 VanDerWaalsContact C-N 3.33Å; L84-Y86 VanDerWaalsContact C-N 3.3Å; L84-Y86 PolarHBondContact O-N 3.02Å; L84-L87 PolarHBondContact O-N 3.32Å; L84-L87 VanDerWaalsContact O-N 3.17Å; L84-T88 PolarHBondContact O-N 2.98Å; L84-T88 PolarHBondContact O-OG1 3.05Å
85	K	98.2	Very high	96.3	Very high	65 Å²	65	68.9 Å²	68.9	28%	0.283	31%	0.306	S	S	.	.	H	α-helix	trans	-56.5	-43.1	174.4	-174.9	169.9	-173.6	165.7	0	112.6	K81 R82 Y83 T88 K89 V103 Y111	K81-K85 PolarHBondContact O-N 2.8Å; K81-K85 VanDerWaalsContact O-N 3.12Å; R82-K85 WeakPolarHBondContact O-CB 3.39Å; R82-K85 PolarHBondContact O-N 3.21Å; Y83-K85 PolarHBondContact O-N 3.12Å; K85-T88 PolarHBondContact O-N 2.93Å; K85-K89 WeakPolarHBondContact O-CB 3.45Å; K85-K89 WeakPolarHBondContact O-CG 3.18Å; K85-K89 PolarHBondContact O-N 3.07Å; K85-V103 WeakPolarHBondContact CE-O 3.42Å; K85-V103 HydrophobicContact CG-CB 4.24Å; K85-V103 HydrophobicContact CG-CG1 4.01Å; K85-V103 PolarHBondContact NZ-O 3.39Å; K85-Y111 HydrophobicContact CB-CD2 4.38Å; K85-Y111 HydrophobicContact CB-CE1 4.36Å; K85-Y111 HydrophobicContact CB-CE2 3.61Å; K85-Y111 HydrophobicContact CD-CE1 3.88Å; K85-Y111 HydrophobicContact CG-CE1 4.44Å; K85-Y111 HydrophobicContact CG-CE2 4.48Å
86	Y	98.4	Very high	96.3	Very high	122 Å²	122	74.2 Å²	74.2	48%	0.478	34%	0.335	S	S	.	.	H	α-helix	trans	-60.9	-47.9	177.5	160.5	-100.2	0	0	0	111.3	R82 Y83 L84 K89 K90	R82-Y86 PolarHBondContact O-N 2.92Å; Y83-Y86 AromaticContact CD2-CD1 3.9Å; Y83-Y86 HydrophobicContact CD2-CD1 3.9Å; Y83-Y86 AromaticContact CE2-CD1 3.88Å; Y83-Y86 HydrophobicContact CE2-CD1 3.88Å; Y83-Y86 HydrophobicContact CE2-CE1 4.22Å; Y83-Y86 WeakPolarHBondContact O-CB 3.49Å; Y83-Y86 PolarHBondContact O-N 3.13Å; L84-Y86 VanDerWaalsContact C-N 3.3Å; L84-Y86 PolarHBondContact O-N 3.02Å; Y86-K89 PolarHBondContact O-N 3.38Å; Y86-K90 HydrophobicContact CE1-CD 4.4Å; Y86-K90 WeakPolarHBondContact O-CB 3.18Å; Y86-K90 PolarHBondContact O-N 3.21Å; Y86-K90 PolarHBondContact OH-NZ 3.28Å; Y86-K90 VanDerWaalsContact OH-NZ 3.15Å
87	L	98.3	Very high	96.5	Very high	3 Å²	3	69 Å²	69	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-42.9	178.7	-69.3	177.6	0	0	0	111.9	F44 L45 R48 I49 Y83 L84 K90 Y91	F44-L87 HydrophobicContact CE1-CB 4.44Å; F44-L87 WeakPolarHBondContact CE1-O 3.45Å; L45-L87 HydrophobicContact CD2-CB 3.89Å; L45-L87 HydrophobicContact CD2-CD1 4.07Å; R48-L87 HydrophobicContact CB-CD2 3.98Å; I49-L87 HydrophobicContact CB-CD1 4.46Å; I49-L87 HydrophobicContact CG1-CD1 3.52Å; Y83-L87 HydrophobicContact CD2-CD1 4.49Å; Y83-L87 HydrophobicContact CD2-CG 4.26Å; Y83-L87 HydrophobicContact CE1-CD1 4.09Å; Y83-L87 HydrophobicContact CE2-CD1 3.99Å; Y83-L87 HydrophobicContact CE2-CD2 4.02Å; Y83-L87 HydrophobicContact CE2-CG 3.84Å; Y83-L87 PolarHBondContact O-N 3.04Å; L84-L87 PolarHBondContact O-N 3.32Å; L84-L87 VanDerWaalsContact O-N 3.17Å; L87-K90 WeakPolarHBondContact O-CB 3.43Å; L87-K90 PolarHBondContact O-N 3.21Å; L87-K90 VanDerWaalsContact O-N 3.13Å; L87-Y91 PolarHBondContact O-N 3.12Å
88	T	97.9	Very high	96.7	Very high	0 Å²	0	70 Å²	70	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-48.8	175.4	-46.9	0	0	0	0	111.1	L25 F41 L84 K85 K90 Y91 L92 V103 L113	L25-T88 WeakPolarHBondContact CD1-OG1 3.4Å; L25-T88 HydrophobicContact CD2-CG2 4.28Å; F41-T88 HydrophobicContact CE2-CG2 4.3Å; F41-T88 HydrophobicContact CZ-CG2 3.92Å; L84-T88 PolarHBondContact O-N 2.98Å; L84-T88 PolarHBondContact O-OG1 3.05Å; K85-T88 PolarHBondContact O-N 2.93Å; T88-K90 PolarHBondContact O-N 3.28Å; T88-Y91 WeakPolarHBondContact O-CB 3.36Å; T88-Y91 PolarHBondContact O-N 3.35Å; T88-Y91 VanDerWaalsContact O-N 3.12Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 3.18Å; T88-V103 HydrophobicContact CG2-CG2 3.76Å; T88-L113 HydrophobicContact CG2-CD2 3.92Å
89	K	98.3	Very high	96.7	Very high	91 Å²	91	67.5 Å²	67.5	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-29.3	175.7	-78.2	-169.5	170.9	-164.2	0	113.4	K85 Y86 K93 R98 V103	K85-K89 WeakPolarHBondContact O-CB 3.45Å; K85-K89 WeakPolarHBondContact O-CG 3.18Å; K85-K89 PolarHBondContact O-N 3.07Å; Y86-K89 PolarHBondContact O-N 3.38Å; K89-K93 PolarHBondContact O-N 3.25Å; K89-R98 PolarHBondContact O-NE 3.09Å; K89-R98 PolarHBondContact O-NH2 3.08Å; K89-V103 HydrophobicContact CG-CG2 3.91Å
90	K	98.4	Very high	96.6	Very high	71 Å²	71	73.8 Å²	73.8	31%	0.309	33%	0.328	S	S	.	.	H	α-helix	trans	-72.3	-42.7	175.8	-171.5	171.9	-165.7	160.6	0	111.2	F44 Y86 L87 T88 K93 K94	F44-K90 HydrophobicContact CZ-CB 4.38Å; F44-K90 HydrophobicContact CZ-CG 4.34Å; Y86-K90 HydrophobicContact CE1-CD 4.4Å; Y86-K90 WeakPolarHBondContact O-CB 3.18Å; Y86-K90 PolarHBondContact O-N 3.21Å; Y86-K90 PolarHBondContact OH-NZ 3.28Å; Y86-K90 VanDerWaalsContact OH-NZ 3.15Å; L87-K90 WeakPolarHBondContact O-CB 3.43Å; L87-K90 PolarHBondContact O-N 3.21Å; L87-K90 VanDerWaalsContact O-N 3.13Å; T88-K90 PolarHBondContact O-N 3.28Å; K90-K93 PolarHBondContact O-N 2.98Å; K90-K94 PolarHBondContact O-N 2.95Å
91	Y	98.1	Very high	96.7	Very high	7 Å²	7	71 Å²	71	3%	0.027	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-47.7	173	-177.4	-98.6	0	0	0	111.6	L36 N40 F41 F44 L87 T88 K93 K94 N95	L36-Y91 HydrophobicContact CD1-CD1 4.47Å; L36-Y91 HydrophobicContact CD1-CE1 4.02Å; L36-Y91 HydrophobicContact CG-CE1 4.24Å; N40-Y91 PolarHBondContact ND2-OH 3.48Å; F41-Y91 HydrophobicContact CB-CE1 4.19Å; F41-Y91 HydrophobicContact CB-CE2 4.44Å; F41-Y91 AromaticContact CD2-CD1 3.48Å; F41-Y91 HydrophobicContact CD2-CD1 3.48Å; F41-Y91 VanDerWaalsContact CD2-CD1 3.48Å; F41-Y91 AromaticContact CD2-CD2 3.82Å; F41-Y91 HydrophobicContact CD2-CD2 3.82Å; F41-Y91 AromaticContact CD2-CE1 3.82Å; F41-Y91 HydrophobicContact CD2-CE1 3.82Å; F41-Y91 HydrophobicContact CD2-CE2 4.13Å; F41-Y91 AromaticContact CD2-CG 3.47Å; F41-Y91 HydrophobicContact CD2-CG 3.47Å; F41-Y91 VanDerWaalsContact CD2-CG 3.47Å; F41-Y91 HydrophobicContact CE2-CD1 4Å; F41-Y91 HydrophobicContact CE2-CD2 4.48Å; F41-Y91 AromaticContact CE2-CG 3.85Å; F41-Y91 HydrophobicContact CE2-CG 3.85Å; F41-Y91 HydrophobicContact CG-CD1 4.4Å; F41-Y91 HydrophobicContact CG-CE1 4.36Å; F44-Y91 HydrophobicContact CB-CD2 3.84Å; F44-Y91 HydrophobicContact CB-CE2 4.06Å; F44-Y91 AromaticContact CD1-CD2 3.79Å; F44-Y91 HydrophobicContact CD1-CD2 3.79Å; F44-Y91 HydrophobicContact CD1-CG 4.24Å; F44-Y91 AromaticContact CD2-CD2 3.83Å; F44-Y91 HydrophobicContact CD2-CD2 3.83Å; F44-Y91 HydrophobicContact CE1-CD2 4.29Å; F44-Y91 HydrophobicContact CE1-CG 4.45Å; F44-Y91 HydrophobicContact CE2-CD2 4.29Å; F44-Y91 AromaticContact CG-CD2 3.54Å; F44-Y91 HydrophobicContact CG-CD2 3.54Å; F44-Y91 HydrophobicContact CG-CE2 4.25Å; F44-Y91 HydrophobicContact CG-CG 4.42Å; L87-Y91 PolarHBondContact O-N 3.12Å; T88-Y91 WeakPolarHBondContact O-CB 3.36Å; T88-Y91 PolarHBondContact O-N 3.35Å; T88-Y91 VanDerWaalsContact O-N 3.12Å; Y91-K93 VanDerWaalsContact C-N 3.27Å; Y91-K93 PolarHBondContact O-N 3.4Å; Y91-K94 PolarHBondContact O-N 3.31Å; Y91-K94 VanDerWaalsContact O-N 3.07Å; Y91-N95 WeakPolarHBondContact CD2-ND2 3.38Å; Y91-N95 WeakPolarHBondContact CE1-ND2 3.32Å; Y91-N95 WeakPolarHBondContact CE2-ND2 3.36Å; Y91-N95 PolarHBondContact O-N 2.66Å; Y91-N95 VanDerWaalsContact O-N 3.1Å; Y91-N95 PolarHBondContact O-ND2 2.56Å
92	L	97.4	Very high	96.7	Very high	3 Å²	3	74.5 Å²	74.5	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-39	178	-64.2	178.7	0	0	0	111.9	L36 T88 N95 N96 L97 R98 L101 V103 L113	L36-L92 HydrophobicContact CD1-CD2 4.32Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 3.18Å; L92-N95 PolarHBondContact O-N 2.96Å; L92-N96 PolarHBondContact O-N 3.38Å; L92-L97 HydrophobicContact CB-CB 4.31Å; L92-L97 HydrophobicContact CD2-CB 3.79Å; L92-L97 HydrophobicContact CD2-CD1 3.99Å; L92-L97 PolarHBondContact O-N 3.49Å; L92-R98 HydrophobicContact CB-CG 4.07Å; L92-L101 HydrophobicContact CD1-CB 4.23Å; L92-L101 HydrophobicContact CD2-CB 4.41Å; L92-L101 HydrophobicContact CD2-CD1 4.05Å; L92-V103 HydrophobicContact CD1-CG2 3.97Å; L92-L113 HydrophobicContact CD1-CD2 4.04Å; L92-L113 HydrophobicContact CD2-CD1 4.4Å
93	K	97	Very high	96.7	Very high	123 Å²	123	65.2 Å²	65.2	54%	0.535	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-38.1	175.7	-174.1	55.8	178.5	173.8	0	112.6	K89 K90 Y91 N95 N96 R98	K89-K93 PolarHBondContact O-N 3.25Å; K90-K93 PolarHBondContact O-N 2.98Å; Y91-K93 VanDerWaalsContact C-N 3.27Å; Y91-K93 PolarHBondContact O-N 3.4Å; K93-N95 PolarHBondContact O-N 2.84Å; K93-N96 PolarHBondContact O-N 3.31Å; K93-N96 PolarHBondContact O-OD1 3.04Å; K93-R98 HydrophobicContact CB-CG 4.28Å
94	K	97	Very high	96.6	Very high	155 Å²	155	64.6 Å²	64.6	67%	0.674	29%	0.288	S	S	*	.	H	α-helix	trans	-63.7	-32.2	179.1	-172.3	-175.6	175.6	-168.8	0	111.9	K90 Y91	K90-K94 PolarHBondContact O-N 2.95Å; Y91-K94 PolarHBondContact O-N 3.31Å; Y91-K94 VanDerWaalsContact O-N 3.07Å
95	N	96.1	Very high	96.7	Very high	63 Å²	63	67.2 Å²	67.2	34%	0.337	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	15.2	-178.6	-57.3	-76.8	0	0	0	113	Y91 L92 K93 L97	Y91-N95 WeakPolarHBondContact CD2-ND2 3.38Å; Y91-N95 WeakPolarHBondContact CE1-ND2 3.32Å; Y91-N95 WeakPolarHBondContact CE2-ND2 3.36Å; Y91-N95 PolarHBondContact O-N 2.66Å; Y91-N95 VanDerWaalsContact O-N 3.1Å; Y91-N95 PolarHBondContact O-ND2 2.56Å; L92-N95 PolarHBondContact O-N 2.96Å; K93-N95 PolarHBondContact O-N 2.84Å; N95-L97 HydrophobicContact CB-CD1 4.19Å; N95-L97 HydrophobicContact CB-CG 4.14Å; N95-L97 PolarHBondContact O-N 3.03Å; N95-L97 VanDerWaalsContact O-N 3.16Å
96	N	95.1	Very high	96.6	Very high	116 Å²	116	66.4 Å²	66.4	62%	0.62	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	28.6	-178.8	-67.6	12	0	0	0	115.8	L92 K93	L92-N96 PolarHBondContact O-N 3.38Å; K93-N96 PolarHBondContact O-N 3.31Å; K93-N96 PolarHBondContact O-OD1 3.04Å
97	L	95.3	Very high	96.5	Very high	11 Å²	11	65.6 Å²	65.6	6%	0.058	32%	0.316	C	S	.	.			trans	-92.8	8.5	-179.1	-62.7	176.2	0	0	0	113.8	L36 L92 N95 D99 W100 L101	L36-L97 HydrophobicContact CD1-CD1 4.34Å; L92-L97 HydrophobicContact CB-CB 4.31Å; L92-L97 HydrophobicContact CD2-CB 3.79Å; L92-L97 HydrophobicContact CD2-CD1 3.99Å; L92-L97 PolarHBondContact O-N 3.49Å; N95-L97 HydrophobicContact CB-CD1 4.19Å; N95-L97 HydrophobicContact CB-CG 4.14Å; N95-L97 PolarHBondContact O-N 3.03Å; N95-L97 VanDerWaalsContact O-N 3.16Å; L97-D99 VanDerWaalsContact C-N 3.33Å; L97-D99 PolarHBondContact O-N 3.33Å; L97-W100 HydrophobicContact CD2-CE3 3.69Å; L97-W100 HydrophobicContact CD2-CZ3 3.74Å; L97-L101 HydrophobicContact CB-CD1 4.3Å; L97-L101 HydrophobicContact CD1-CD1 4.42Å; L97-L101 PolarHBondContact O-N 2.71Å
98	R	94.9	Very high	96.3	Very high	110 Å²	110	74.5 Å²	74.5	42%	0.415	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-23.5	-172.9	-88.5	-149.9	-177.7	167.7	7.7	114.5	K89 L92 K93 W100 F116	K89-R98 PolarHBondContact O-NE 3.09Å; K89-R98 PolarHBondContact O-NH2 3.08Å; L92-R98 HydrophobicContact CB-CG 4.07Å; K93-R98 HydrophobicContact CB-CG 4.28Å; R98-W100 VanDerWaalsContact C-N 3.32Å; R98-F116 WeakPolarHBondContact O-CE2 3.32Å
99	D	91.9	Very high	96.3	Very high	125 Å²	125	79.8 Å²	79.8	67%	0.668	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-22.5	-176.5	-52.6	-32.1	0	0	0	110.3	L97 F116	L97-D99 VanDerWaalsContact C-N 3.33Å; L97-D99 PolarHBondContact O-N 3.33Å; D99-F116 VanDerWaalsContact O-CD2 3.26Å; D99-F116 WeakPolarHBondContact O-CD2 3.26Å
100	W	92.3	Very high	96.3	Very high	143 Å²	143	76.7 Å²	76.7	54%	0.542	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-38	178.4	-52.7	-38.5	0	0	0	112.8	L97 R98 Y115 F116	L97-W100 HydrophobicContact CD2-CE3 3.69Å; L97-W100 HydrophobicContact CD2-CZ3 3.74Å; R98-W100 VanDerWaalsContact C-N 3.32Å; W100-Y115 HydrophobicContact CB-CD1 4.34Å; W100-Y115 HydrophobicContact CB-CE1 4.37Å; W100-Y115 VanDerWaalsContact O-CA 3.25Å; W100-Y115 WeakPolarHBondContact O-CA 3.39Å; W100-Y115 WeakPolarHBondContact O-CD1 3.37Å; W100-F116 PolarHBondContact O-N 3.25Å; W100-F116 VanDerWaalsContact O-N 3.13Å
101	L	95.9	Very high	96.3	Very high	4 Å²	4	74.3 Å²	74.3	2%	0.021	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.2	-168.7	-60.3	174.3	0	0	0	113.6	P30 I35 L92 L97 L113 R114 Y115	P30-L101 HydrophobicContact CB-CD1 3.68Å; P30-L101 HydrophobicContact CB-CD2 4.22Å; P30-L101 HydrophobicContact CG-CD1 4.19Å; I35-L101 HydrophobicContact CD1-CD1 3.86Å; I35-L101 HydrophobicContact CD1-CD2 4.25Å; I35-L101 HydrophobicContact CD1-CG 4.23Å; L92-L101 HydrophobicContact CD1-CB 4.23Å; L92-L101 HydrophobicContact CD2-CB 4.41Å; L92-L101 HydrophobicContact CD2-CD1 4.05Å; L97-L101 HydrophobicContact CB-CD1 4.3Å; L97-L101 HydrophobicContact CD1-CD1 4.42Å; L97-L101 PolarHBondContact O-N 2.71Å; L101-L113 HydrophobicContact CD1-CD1 4.4Å; L101-R114 WeakPolarHBondContact CA-O 3.23Å; L101-Y115 HydrophobicContact CD2-CD1 3.73Å; L101-Y115 HydrophobicContact CD2-CE1 3.58Å; L101-Y115 HydrophobicContact CD2-CE2 4.46Å; L101-Y115 HydrophobicContact CD2-CG 4.21Å; L101-Y115 HydrophobicContact CG-CE1 4.48Å
102	R	96.4	Very high	96.2	Very high	98 Å²	98	75.5 Å²	75.5	37%	0.37	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.5	170.4	56.6	174.3	-177	178.2	2.6	112.4	V104 L113 R114 F116	R102-V104 HydrophobicContact CG-CG2 3.94Å; R102-L113 WeakPolarHBondContact O-CA 3.33Å; R102-R114 HydrophobicContact CG-CB 4.27Å; R102-R114 VanDerWaalsContact CG-O 3.26Å; R102-R114 WeakPolarHBondContact CG-O 3.35Å; R102-R114 PolarHBondContact N-O 3.47Å; R102-R114 PolarHBondContact O-N 3.1Å; R102-F116 HydrophobicContact CB-CE1 4.09Å; R102-F116 HydrophobicContact CB-CE2 4.04Å; R102-F116 HydrophobicContact CB-CZ 3.7Å; R102-F116 HydrophobicContact CG-CE1 4.27Å; R102-F116 HydrophobicContact CG-CZ 4.29Å
103	V	97.8	Very high	96.2	Very high	7 Å²	7	75.4 Å²	75.4	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.1	175.1	-168.5	0	0	0	0	110.1	K85 T88 K89 L92 Y111 L113	K85-V103 WeakPolarHBondContact CE-O 3.42Å; K85-V103 HydrophobicContact CG-CB 4.24Å; K85-V103 HydrophobicContact CG-CG1 4.01Å; K85-V103 PolarHBondContact NZ-O 3.39Å; T88-V103 HydrophobicContact CG2-CG2 3.76Å; K89-V103 HydrophobicContact CG-CG2 3.91Å; L92-V103 HydrophobicContact CD1-CG2 3.97Å; V103-Y111 HydrophobicContact CG1-CD1 3.93Å; V103-Y111 HydrophobicContact CG1-CD2 4.5Å; V103-Y111 HydrophobicContact CG1-CG 3.92Å; V103-L113 HydrophobicContact CB-CD2 4.3Å; V103-L113 HydrophobicContact CG2-CD2 3.67Å
104	V	97.2	Very high	96.1	Very high	39 Å²	39	74.2 Å²	74.2	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.3	-176.7	-178	0	0	0	0	110	R102 S106 Y111 E112 R114	R102-V104 HydrophobicContact CG-CG2 3.94Å; V104-S106 PolarHBondContact O-N 3Å; V104-Y111 CarbonylContact O-C 3.57Å; V104-Y111 WeakPolarHBondContact O-CA 3.24Å; V104-Y111 WeakPolarHBondContact O-CD1 3.35Å; V104-E112 PolarHBondContact N-O 3.48Å; V104-E112 PolarHBondContact O-N 3.07Å; V104-R114 HydrophobicContact CB-CG 4.49Å; V104-R114 HydrophobicContact CG2-CB 4.39Å; V104-R114 HydrophobicContact CG2-CG 4.38Å
105	A	97.9	Very high	96	Very high	55 Å²	55	71 Å²	71	46%	0.455	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	116.4	173.4	0	0	0	0	0	108.6	Y111	A105-Y111 HydrophobicContact CB-CD1 3.94Å; A105-Y111 HydrophobicContact CB-CE1 3.75Å
106	S	96.6	Very high	95.8	Very high	48 Å²	48	72.5 Å²	72.5	34%	0.336	34%	0.343	S	S	.	.	S	Bend	trans	-80.8	-49.5	170.6	47.6	0	0	0	0	110.4	V104 T110	V104-S106 PolarHBondContact O-N 3Å; S106-T110 PolarHBondContact N-O 3.21Å; S106-T110 VanDerWaalsContact OG-CB 3.29Å; S106-T110 WeakPolarHBondContact OG-CB 3.19Å; S106-T110 VanDerWaalsContact OG-CG2 3.29Å; S106-T110 WeakPolarHBondContact OG-CG2 3.34Å; S106-T110 PolarHBondContact OG-O 3.47Å
107	D	95.9	Very high	95.2	Very high	105 Å²	105	75.1 Å²	75.1	56%	0.561	35%	0.351	S	S	*	.	S	Bend	trans	-127.1	-179.3	179.8	-59.4	-52.8	0	0	0	112	K81 E109 T110	K81-D107 PolarHBondContact NZ-O 3.16Å; D107-E109 PolarHBondContact O-N 2.83Å; D107-T110 PolarHBondContact N-O 2.65Å; D107-T110 PolarHBondContact OD2-OG1 2.93Å
108	K	95.7	Very high	94.2	Very high	190 Å²	190	81.3 Å²	81.3	83%	0.826	38%	0.383	S	S	*	.	S	Bend	trans	-57.9	-35.9	172.8	-170.1	175.5	179.2	-179.5	0	112.5	K81	K81-K108 WeakPolarHBondContact CD-O 3.17Å; K81-K108 PolarHBondContact NZ-O 2.84Å
109	E	96.3	Very high	92.6	Very high	111 Å²	111	79.6 Å²	79.6	52%	0.519	39%	0.388	S	S	.	.	S	Bend	trans	-107	-10.1	-175.2	-63.3	-177.3	169.3	0	0	113.6	F23 T24 D107	F23-E109 WeakPolarHBondContact CA-O 3.18Å; F23-E109 HydrophobicContact CD1-CB 4.3Å; F23-E109 WeakPolarHBondContact CD1-O 3.31Å; T24-E109 PolarHBondContact N-O 3.18Å; T24-E109 VanDerWaalsContact N-O 3.13Å; D107-E109 PolarHBondContact O-N 2.83Å
110	T	97.9	Very high	91	Very high	27 Å²	27	82.1 Å²	82.1	17%	0.166	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.2	-169.7	-46.3	0	0	0	0	112.1	T24 K81 S106 D107	T24-T110 HydrophobicContact CG2-CG2 4.38Å; T24-T110 CarbonylContact O-C 3.56Å; T24-T110 WeakPolarHBondContact O-CA 3.18Å; K81-T110 VanDerWaalsContact CE-O 3.28Å; K81-T110 WeakPolarHBondContact CE-O 3.49Å; K81-T110 PolarHBondContact NZ-O 3.4Å; S106-T110 PolarHBondContact N-O 3.21Å; S106-T110 VanDerWaalsContact OG-CB 3.29Å; S106-T110 WeakPolarHBondContact OG-CB 3.19Å; S106-T110 VanDerWaalsContact OG-CG2 3.29Å; S106-T110 WeakPolarHBondContact OG-CG2 3.34Å; S106-T110 PolarHBondContact OG-O 3.47Å; D107-T110 PolarHBondContact N-O 2.65Å; D107-T110 PolarHBondContact OD2-OG1 2.93Å
111	Y	98.6	Very high	89.3	Confident	21 Å²	21	81.6 Å²	81.6	8%	0.082	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155.5	163	-78.3	-59.4	0	0	0	110	T24 L25 D26 K81 K85 V103 V104 A105	T24-Y111 PolarHBondContact O-N 3.31Å; L25-Y111 CarbonylContact C-O 3.5Å; L25-Y111 WeakPolarHBondContact CA-O 3.1Å; L25-Y111 VanDerWaalsContact CD2-CB 3.49Å; L25-Y111 HydrophobicContact CD2-CD2 4.47Å; L25-Y111 HydrophobicContact CD2-CG 4.41Å; D26-Y111 PolarHBondContact N-O 2.98Å; K81-Y111 HydrophobicContact CB-CE2 4.38Å; K81-Y111 HydrophobicContact CD-CD2 4.35Å; K81-Y111 HydrophobicContact CD-CE2 3.88Å; K81-Y111 VanDerWaalsContact CE-CE2 3.43Å; K81-Y111 HydrophobicContact CG-CD2 3.86Å; K81-Y111 HydrophobicContact CG-CE2 3.16Å; K81-Y111 VanDerWaalsContact O-CE2 3.28Å; K81-Y111 WeakPolarHBondContact O-CE2 3.41Å; K85-Y111 HydrophobicContact CB-CD2 4.38Å; K85-Y111 HydrophobicContact CB-CE1 4.36Å; K85-Y111 HydrophobicContact CB-CE2 3.61Å; K85-Y111 HydrophobicContact CD-CE1 3.88Å; K85-Y111 HydrophobicContact CG-CE1 4.44Å; K85-Y111 HydrophobicContact CG-CE2 4.48Å; V103-Y111 HydrophobicContact CG1-CD1 3.93Å; V103-Y111 HydrophobicContact CG1-CD2 4.5Å; V103-Y111 HydrophobicContact CG1-CG 3.92Å; V104-Y111 CarbonylContact O-C 3.57Å; V104-Y111 WeakPolarHBondContact O-CA 3.24Å; V104-Y111 WeakPolarHBondContact O-CD1 3.35Å; A105-Y111 HydrophobicContact CB-CD1 3.94Å; A105-Y111 HydrophobicContact CB-CE1 3.75Å
112	E	97.5	Very high	87.2	Confident	31 Å²	31	88.5 Å²	88.5	15%	0.145	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.2	177.9	-174.2	-174.2	177.5	0	0	109.2	D26 H29 V104 R114	D26-E112 HydrophobicContact CB-CB 4.36Å; D26-E112 HydrophobicContact CB-CG 4.25Å; D26-E112 WeakPolarHBondContact O-CA 3.41Å; H29-E112 IonicContact CD2-OE1 2.65Å; H29-E112 IonicContact NE2-OE1 2.8Å; V104-E112 PolarHBondContact N-O 3.48Å; V104-E112 PolarHBondContact O-N 3.07Å; E112-R114 HydrophobicContact CG-CG 4.11Å; E112-R114 IonicContact OE1-NE 3.59Å; E112-R114 IonicContact OE2-CZ 3.25Å; E112-R114 VanDerWaalsContact OE2-CZ 3.25Å; E112-R114 IonicContact OE2-NE 3.72Å; E112-R114 PolarHBondContact OE2-NE 3.36Å; E112-R114 IonicContact OE2-NH2 2.78Å; E112-R114 PolarHBondContact OE2-NH2 3.28Å
113	L	96.7	Very high	85.1	Confident	1 Å²	1	92.6 Å²	92.6	1%	0.005	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	118	166.5	-66.1	-173.1	0	0	0	109.7	D26 L27 P30 L36 T88 L92 L101 R102 V103	D26-L113 PolarHBondContact O-N 3.39Å; L27-L113 HydrophobicContact CD2-CD1 3.42Å; L27-L113 VanDerWaalsContact CD2-CD1 3.42Å; L27-L113 HydrophobicContact CD2-CG 3.79Å; P30-L113 HydrophobicContact CG-CB 3.97Å; P30-L113 HydrophobicContact CG-CD1 3.79Å; L36-L113 HydrophobicContact CD1-CD1 3.83Å; T88-L113 HydrophobicContact CG2-CD2 3.92Å; L92-L113 HydrophobicContact CD1-CD2 4.04Å; L92-L113 HydrophobicContact CD2-CD1 4.4Å; L101-L113 HydrophobicContact CD1-CD1 4.4Å; R102-L113 WeakPolarHBondContact O-CA 3.33Å; V103-L113 HydrophobicContact CB-CD2 4.3Å; V103-L113 HydrophobicContact CG2-CD2 3.67Å
114	R	95.6	Very high	82.9	Confident	99 Å²	99	100.6 Å²	100.6	37%	0.374	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.2	177.5	-63.1	-170.5	-179.3	-170.5	-2.3	110.6	L101 R102 V104 E112	L101-R114 WeakPolarHBondContact CA-O 3.23Å; R102-R114 HydrophobicContact CG-CB 4.27Å; R102-R114 VanDerWaalsContact CG-O 3.26Å; R102-R114 WeakPolarHBondContact CG-O 3.35Å; R102-R114 PolarHBondContact N-O 3.47Å; R102-R114 PolarHBondContact O-N 3.1Å; V104-R114 HydrophobicContact CB-CG 4.49Å; V104-R114 HydrophobicContact CG2-CB 4.39Å; V104-R114 HydrophobicContact CG2-CG 4.38Å; E112-R114 HydrophobicContact CG-CG 4.11Å; E112-R114 IonicContact OE1-NE 3.59Å; E112-R114 IonicContact OE2-CZ 3.25Å; E112-R114 VanDerWaalsContact OE2-CZ 3.25Å; E112-R114 IonicContact OE2-NE 3.72Å; E112-R114 PolarHBondContact OE2-NE 3.36Å; E112-R114 IonicContact OE2-NH2 2.78Å; E112-R114 PolarHBondContact OE2-NH2 3.28Å
115	Y	94.7	Very high	80.5	Confident	86 Å²	86	103.7 Å²	103.7	34%	0.337	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	155.1	168.5	-70.8	-76.3	0	0	0	111.5	H29 D33 I35 W100 L101	H29-Y115 HydrophobicContact CB-CE2 4.02Å; D33-Y115 WeakPolarHBondContact OD2-CE2 3.48Å; D33-Y115 PolarHBondContact OD2-OH 3.27Å; I35-Y115 HydrophobicContact CD1-CE1 4.01Å; I35-Y115 VanDerWaalsContact CD1-OH 3.24Å; I35-Y115 WeakPolarHBondContact CD1-OH 3.45Å; W100-Y115 HydrophobicContact CB-CD1 4.34Å; W100-Y115 HydrophobicContact CB-CE1 4.37Å; W100-Y115 VanDerWaalsContact O-CA 3.25Å; W100-Y115 WeakPolarHBondContact O-CA 3.39Å; W100-Y115 WeakPolarHBondContact O-CD1 3.37Å; L101-Y115 HydrophobicContact CD2-CD1 3.73Å; L101-Y115 HydrophobicContact CD2-CE1 3.58Å; L101-Y115 HydrophobicContact CD2-CE2 4.46Å; L101-Y115 HydrophobicContact CD2-CG 4.21Å; L101-Y115 HydrophobicContact CG-CE1 4.48Å
116	F	91.9	Very high	78.2	Confident	96 Å²	96	110.4 Å²	110.4	42%	0.421	55%	0.546	S	S	.	.			trans	-73	137.3	158.9	-69.1	-81.1	0	0	0	108.9	R98 D99 W100 R102 I118	R98-F116 WeakPolarHBondContact O-CE2 3.32Å; D99-F116 VanDerWaalsContact O-CD2 3.26Å; D99-F116 WeakPolarHBondContact O-CD2 3.26Å; W100-F116 PolarHBondContact O-N 3.25Å; W100-F116 VanDerWaalsContact O-N 3.13Å; R102-F116 HydrophobicContact CB-CE1 4.09Å; R102-F116 HydrophobicContact CB-CE2 4.04Å; R102-F116 HydrophobicContact CB-CZ 3.7Å; R102-F116 HydrophobicContact CG-CE1 4.27Å; R102-F116 HydrophobicContact CG-CZ 4.29Å; F116-I118 PolarHBondContact O-N 3.03Å
117	Q	81.9	Confident	76	Confident	171 Å²	171	112.4 Å²	112.4	80%	0.799	57%	0.565	S	S	*	*			trans	-82.4	104.9	165.7	-69.6	171.8	-87.9	0	0	105.5	S119	Q117-S119 PolarHBondContact O-N 2.88Å
118	I	73.8	Confident	73.6	Confident	141 Å²	141	115 Å²	115	72%	0.723	58%	0.579	S	S	*	*			trans	-82.2	98	167.9	-55.2	172.2	0	0	0	104.3	F116 Q120	F116-I118 PolarHBondContact O-N 3.03Å; I118-Q120 PolarHBondContact O-N 3.07Å
119	S	62.4	Low	71	Confident	74 Å²	74	118.9 Å²	118.9	52%	0.517	60%	0.6	S	S	.	*			trans	-65.5	126.4	162.2	-61.1	0	0	0	0	106.2	Q117 D121	Q117-S119 PolarHBondContact O-N 2.88Å; S119-D121 PolarHBondContact O-N 3.39Å
120	Q	58.2	Low	69.7	Low	178 Å²	178	119.3 Å²	119.3	83%	0.832	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-62.5	-4.8	176.6	-92.1	-179.4	11.3	0	0	113.5	I118 D122	I118-Q120 PolarHBondContact O-N 3.07Å; Q120-D122 PolarHBondContact O-N 3.22Å
121	D	55.4	Low	68.3	Low	132 Å²	132	124.2 Å²	124.2	71%	0.706	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-75.9	-8.8	-175.8	-72.2	-68.3	0	0	0	115.7	S119	S119-D121 PolarHBondContact O-N 3.39Å
122	D	53.2	Low	66.6	Low	148 Å²	148	129.9 Å²	129.9	79%	0.791	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-90.2	0.7	-179.9	-83	-42.1	0	0	0	114	Q120	Q120-D122 PolarHBondContact O-N 3.22Å
123	E	51.7	Low	64.8	Low	185 Å²	185	135.7 Å²	135.7	86%	0.864	69%	0.688	S	S	*	*	S	Bend	trans	-97.6	-2.8	179.2	-113.3	175.4	114.8	0	0	114.4
124	E	51.1	Low	62.8	Low	175 Å²	175	144.1 Å²	144.1	82%	0.818	73%	0.731	S	S	*	*	S	Bend	trans	-100.6	2.7	-179.5	-160.5	164.3	-165.1	0	0	114.3
125	S	47	Very low	60.6	Low	104 Å²	104	147.1 Å²	147.1	73%	0.727	76%	0.755	S	S	*	*	S	Bend	trans	-104.7	6	-173.7	-61.3	0	0	0	0	116.7
126	E	50	Low	58.1	Low	196 Å²	196	151.5 Å²	151.5	92%	0.916	78%	0.784	S	S	*	*			trans	-112.1	36.6	176.1	-67.8	-163.5	146.7	0	0	113.5
127	A	50.4	Low	55.5	Low	90 Å²	90	155.8 Å²	155.8	74%	0.744	81%	0.812	S	S	*	*			trans	-118.2	57.7	169.6	0	0	0	0	0	111.6
128	D	46.1	Very low	53.3	Low	159 Å²	159	154.5 Å²	154.5	85%	0.85	81%	0.813	S	S	*	*			trans	-165.4	83.6	155.6	-143.9	-113.3	0	0	0	111.4
129	E	40.7	Very low	51.5	Low	272 Å²	272	155.7 Å²	155.7	100%	1.271	82%	0.822	S	S	*	*			trans	-173.8	0	133.1	-111.5	-174.2	152.2	0	0	111.9

Retrieved 129 of 129 residues in 163.1 ms (Link to these results)

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