A0A077YWZ8_TRITR Loading...

Large ribosomal subunit protein eL22

AlphaFold DB , UniProt , Accession A0A077YWZ8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 135 aa.

						>A0A077YWZ8_TRITR|A0A077YWZ8
MAIKGRRFYTGPSKTGKGLKKKKVTQKFFIECSHPVEDGIMNAGDFENFLRERIKVNGKTGNLGNNILIELQKTRLCVTADVPFSKRYLKYLTKKYLKKQALRDWLRVVALDKDTYELRYFQISGDESGVSSEED
					

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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	49.9	Very low	57.8	Low	249 Å²	249	168.5 Å²	168.5	100%	1.227	85%	0.854	S	S	*	*				0	105.9	0	-85.4	163.7	166.9	0	0	108.5
2	A	50.1	Low	58.2	Low	107 Å²	107	164.8 Å²	164.8	88%	0.884	85%	0.85	S	S	*	*			trans	-104.4	114	-174.7	0	0	0	0	0	110.8	K4	A2-K4 PolarHBondContact O-N 3.18Å
3	I	61.3	Low	57.8	Low	170 Å²	170	160.1 Å²	160.1	87%	0.872	84%	0.84	S	S	*	*			trans	-80.2	106.3	175.9	-64.5	166.3	0	0	0	107.9	G5	I3-G5 PolarHBondContact O-N 3.23Å
4	K	58.1	Low	57.8	Low	208 Å²	208	163.1 Å²	163.1	90%	0.904	84%	0.842	S	S	*	*			trans	-76.4	100	178.9	-139.6	169.9	-172.7	172.7	0	108.7	A2 R6	A2-K4 PolarHBondContact O-N 3.18Å; K4-R6 PolarHBondContact O-N 3.07Å
5	G	55.8	Low	57.1	Low	65 Å²	65	160.4 Å²	160.4	67%	0.67	84%	0.837	S	S	*	*			trans	-56.5	126.8	178.8	0	0	0	0	0	112.7	I3 R7	I3-G5 PolarHBondContact O-N 3.23Å; G5-R7 PolarHBondContact O-N 3.37Å
6	R	62.8	Low	56.9	Low	238 Å²	238	154.9 Å²	154.9	90%	0.898	83%	0.831	S	S	*	*			trans	-67.5	106.1	169.2	-88.4	179	-90.8	-168.7	-5.6	108.7	K4 F8	K4-R6 PolarHBondContact O-N 3.07Å; R6-F8 PolarHBondContact O-N 3.05Å
7	R	57.5	Low	56.4	Low	219 Å²	219	157.4 Å²	157.4	83%	0.826	83%	0.833	S	S	*	*			trans	-63.6	116.8	166.1	-85.1	-178.9	-92.3	153.7	-7.5	108.8	G5 Y9	G5-R7 PolarHBondContact O-N 3.37Å; R7-Y9 PolarHBondContact O-N 3.41Å
8	F	59.2	Low	56	Low	190 Å²	190	152.9 Å²	152.9	83%	0.833	83%	0.83	S	S	*	*			trans	-63.1	121.4	163.1	-76.2	-91.9	0	0	0	108.4	R6 T10	R6-F8 PolarHBondContact O-N 3.05Å; F8-T10 PolarHBondContact O-N 3.17Å
9	Y	53.5	Low	56.2	Low	216 Å²	216	153.6 Å²	153.6	85%	0.847	83%	0.832	S	S	*	*			trans	-77.2	96.5	169.2	-81	-93.9	0	0	0	108.7	R7 G11	R7-Y9 PolarHBondContact O-N 3.41Å; Y9-G11 PolarHBondContact O-N 3.19Å
10	T	60	Low	56.5	Low	132 Å²	132	156.3 Å²	156.3	81%	0.81	84%	0.836	S	S	*	*			trans	-80	101.1	162.5	55.8	0	0	0	0	107.9	F8	F8-T10 PolarHBondContact O-N 3.17Å
11	G	68.1	Low	56.8	Low	60 Å²	60	158.6 Å²	158.6	62%	0.619	84%	0.838	S	S	*	*			trans	-64.5	157.5	173.4	0	0	0	0	0	111.9	Y9 S13	Y9-G11 PolarHBondContact O-N 3.19Å; G11-S13 PolarHBondContact O-N 3.38Å; G11-S13 VanDerWaalsContact O-N 3.17Å
12	P	62.3	Low	57.8	Low	124 Å²	124	155.9 Å²	155.9	81%	0.805	82%	0.82	S	S	*	*			trans	-64.2	119	-176.4	26.4	-32.3	0	0	0	110.5	K14	P12-K14 PolarHBondContact O-N 3.29Å; P12-K14 VanDerWaalsContact O-N 3.08Å
13	S	53.3	Low	58.8	Low	103 Å²	103	157 Å²	157	72%	0.72	80%	0.804	S	S	*	*			trans	-62.8	105.4	166.2	178	0	0	0	0	108.3	G11 T15	G11-S13 PolarHBondContact O-N 3.38Å; G11-S13 VanDerWaalsContact O-N 3.17Å; S13-T15 VanDerWaalsContact C-N 3.27Å; S13-T15 PolarHBondContact O-N 3.37Å
14	K	56.9	Low	59.8	Low	202 Å²	202	153.7 Å²	153.7	88%	0.878	79%	0.792	S	S	*	*			trans	-69	88.6	169.3	-74	-175.2	179	177.6	0	108.5	P12 G16	P12-K14 PolarHBondContact O-N 3.29Å; P12-K14 VanDerWaalsContact O-N 3.08Å; K14-G16 PolarHBondContact O-N 3.18Å
15	T	48	Very low	61.3	Low	123 Å²	123	147.1 Å²	147.1	76%	0.755	77%	0.77	S	S	*	*			trans	-68.3	81.7	162.6	49.4	0	0	0	0	108.8	S13 K17	S13-T15 VanDerWaalsContact C-N 3.27Å; S13-T15 PolarHBondContact O-N 3.37Å; T15-K17 PolarHBondContact O-N 3.34Å
16	G	53.4	Low	63.2	Low	73 Å²	73	147.1 Å²	147.1	75%	0.753	75%	0.752	S	S	*	*			trans	-69	105.1	169.8	0	0	0	0	0	109.8	K14 G18	K14-G16 PolarHBondContact O-N 3.18Å; G16-G18 PolarHBondContact O-N 3.3Å; G16-G18 VanDerWaalsContact O-N 3.07Å
17	K	48.9	Very low	64.7	Low	197 Å²	197	141.2 Å²	141.2	86%	0.857	73%	0.733	S	S	*	*			trans	-53.9	108.7	169.8	-70.9	175.3	174.6	176.4	0	110.1	T15 L19	T15-K17 PolarHBondContact O-N 3.34Å; K17-L19 PolarHBondContact O-N 3.17Å
18	G	48.7	Very low	66.6	Low	76 Å²	76	131.5 Å²	131.5	78%	0.784	70%	0.697	S	S	*	*			trans	54.9	31.5	138.5	0	0	0	0	0	120.9	G16 K20	G16-G18 PolarHBondContact O-N 3.3Å; G16-G18 VanDerWaalsContact O-N 3.07Å; G18-K20 PolarHBondContact O-N 3.08Å
19	L	60	Low	68.4	Low	166 Å²	166	124.4 Å²	124.4	87%	0.869	67%	0.665	S	S	*	*			trans	-74.6	107.3	160.5	-87.6	83.3	0	0	0	108.2	K17 K21	K17-L19 PolarHBondContact O-N 3.17Å; L19-K21 PolarHBondContact O-N 2.9Å
20	K	61.7	Low	70.5	Confident	207 Å²	207	114.1 Å²	114.1	90%	0.9	63%	0.625	S	S	*	*			trans	-46.6	112.8	168.6	-73.4	179.1	176.8	177.8	0	107.7	G18 K22	G18-K20 PolarHBondContact O-N 3.08Å; K20-K22 PolarHBondContact O-N 3.22Å
21	K	64.2	Low	72.2	Confident	205 Å²	205	109.5 Å²	109.5	89%	0.891	59%	0.594	S	S	*	*			trans	-51.1	116.8	177.5	-79.7	-178.2	177	176.1	0	107.6	L19 K23	L19-K21 PolarHBondContact O-N 2.9Å; K21-K23 PolarHBondContact O-N 2.9Å; K21-K23 VanDerWaalsContact O-N 3.11Å
22	K	69.3	Low	73.5	Confident	193 Å²	193	106.7 Å²	106.7	84%	0.839	57%	0.566	S	S	*	*			trans	-55.7	120.7	175.9	-166.5	175.9	-176.8	178.8	0	106.8	K20 V24	K20-K22 PolarHBondContact O-N 3.22Å; K22-V24 PolarHBondContact O-N 3.32Å
23	K	72.2	Confident	75	Confident	129 Å²	129	102 Å²	102	56%	0.561	54%	0.535	S	S	*	.			trans	-58.8	112.3	177	-168.8	174.7	175.4	-163.6	0	107	K21 T25 D81	K21-K23 PolarHBondContact O-N 2.9Å; K21-K23 VanDerWaalsContact O-N 3.11Å; K23-T25 PolarHBondContact O-N 2.92Å; K23-D81 WeakPolarHBondContact CE-OD2 3.39Å; K23-D81 VanDerWaalsContact NZ-CG 3.28Å; K23-D81 IonicContact NZ-OD2 2.62Å; K23-D81 PolarHBondContact NZ-OD2 3.46Å
24	V	81.9	Confident	76.8	Confident	102 Å²	102	101 Å²	101	62%	0.618	52%	0.519	S	S	*	.			trans	-84.8	100.5	-179	179.7	0	0	0	0	106.9	K22 Q26	K22-V24 PolarHBondContact O-N 3.32Å; V24-Q26 HydrophobicContact CG1-CG 4.19Å
25	T	90.5	Very high	78.6	Confident	70 Å²	70	91.3 Å²	91.3	43%	0.429	48%	0.477	S	S	.	.			trans	-82.2	122.6	171.5	-55.9	0	0	0	0	108.9	K23 T79 A80 D81	K23-T25 PolarHBondContact O-N 2.92Å; T25-T79 HydrophobicContact CG2-CG2 3.36Å; T25-A80 CarbonylContact C-O 3.58Å; T25-A80 WeakPolarHBondContact CA-O 3.31Å; T25-D81 WeakPolarHBondContact CB-OD1 3.34Å; T25-D81 WeakPolarHBondContact CG2-OD1 3.37Å; T25-D81 PolarHBondContact OG1-OD1 3.08Å
26	Q	93.7	Very high	80.8	Confident	65 Å²	65	87.3 Å²	87.3	30%	0.304	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.7	177.2	-62.3	176.4	-34.5	0	0	109	V24 F28 T79 A80 F84	V24-Q26 HydrophobicContact CG1-CG 4.19Å; Q26-F28 HydrophobicContact CB-CE2 3.75Å; Q26-F28 HydrophobicContact CB-CZ 4.03Å; Q26-T79 CarbonylContact O-C 3.56Å; Q26-T79 WeakPolarHBondContact O-CA 3.48Å; Q26-A80 PolarHBondContact N-O 2.99Å; Q26-A80 PolarHBondContact O-N 2.85Å; Q26-F84 PolarHBondContact OE1-O 2.96Å
27	K	95.7	Very high	82.7	Confident	114 Å²	114	90.3 Å²	90.3	50%	0.496	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.6	176.5	-66	-169.6	175.5	-172.5	0	109.3	F29 V78 T79	K27-F29 HydrophobicContact CB-CE2 4.33Å; K27-F29 HydrophobicContact CB-CZ 4.31Å; K27-V78 WeakPolarHBondContact CA-O 3.42Å; K27-T79 HydrophobicContact CG-CG2 4.07Å
28	F	97.2	Very high	84.8	Confident	14 Å²	14	85.6 Å²	85.6	6%	0.061	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.4	177.3	-60.4	-69.3	0	0	0	110	Q26 V78 F84 K86 L89 D114	Q26-F28 HydrophobicContact CB-CE2 3.75Å; Q26-F28 HydrophobicContact CB-CZ 4.03Å; F28-V78 PolarHBondContact N-O 2.85Å; F28-V78 PolarHBondContact O-N 2.87Å; F28-F84 AromaticContact CD2-CD1 3.62Å; F28-F84 HydrophobicContact CD2-CD1 3.62Å; F28-F84 HydrophobicContact CD2-CE1 4.08Å; F28-F84 HydrophobicContact CE2-CB 4.38Å; F28-F84 AromaticContact CE2-CD1 3.62Å; F28-F84 HydrophobicContact CE2-CD1 3.62Å; F28-F84 HydrophobicContact CE2-CE1 4.47Å; F28-F84 HydrophobicContact CE2-CG 4.49Å; F28-K86 HydrophobicContact CD1-CB 3.74Å; F28-K86 HydrophobicContact CD1-CD 4.42Å; F28-K86 HydrophobicContact CD1-CG 4.14Å; F28-K86 HydrophobicContact CE1-CB 3.64Å; F28-K86 HydrophobicContact CE1-CG 4.47Å; F28-K86 HydrophobicContact CZ-CB 4.36Å; F28-L89 HydrophobicContact CB-CD1 3.39Å; F28-L89 HydrophobicContact CD2-CD1 4.4Å; F28-L89 HydrophobicContact CG-CD1 4.04Å; F28-D114 WeakPolarHBondContact CA-O 3.31Å; F28-D114 HydrophobicContact CD1-CB 4.28Å
29	F	97.3	Very high	86.9	Confident	41 Å²	41	85 Å²	85	18%	0.18	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.7	-176.6	-56.9	-80.4	0	0	0	111.4	K27 R75 L76 C77 D114 T115 Y116	K27-F29 HydrophobicContact CB-CE2 4.33Å; K27-F29 HydrophobicContact CB-CZ 4.31Å; F29-R75 HydrophobicContact CD1-CG 4.49Å; F29-R75 VanDerWaalsContact CD1-NH2 3.35Å; F29-R75 VanDerWaalsContact CD2-NH2 3.32Å; F29-L76 CarbonylContact C-O 3.6Å; F29-L76 VanDerWaalsContact CA-O 3.31Å; F29-L76 WeakPolarHBondContact CA-O 3.4Å; F29-C77 HydrophobicContact CD1-CB 4.07Å; F29-C77 HydrophobicContact CE1-CB 4.03Å; F29-C77 VanDerWaalsContact CE1-SG 3.58Å; F29-D114 PolarHBondContact N-O 2.62Å; F29-T115 HydrophobicContact CB-CG2 4Å; F29-T115 CarbonylContact O-C 3.54Å; F29-T115 WeakPolarHBondContact O-CA 3.45Å; F29-Y116 PolarHBondContact O-N 3.11Å
30	I	97.2	Very high	88.4	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	113.7	170.2	-54.3	163.3	0	0	0	107.2	F46 L50 L76 L89 T93 Y116	I30-F46 HydrophobicContact CD1-CE1 4.12Å; I30-F46 HydrophobicContact CD1-CZ 4.07Å; I30-F46 HydrophobicContact CG2-CE1 4.35Å; I30-L50 HydrophobicContact CD1-CD1 4.33Å; I30-L76 HydrophobicContact CB-CB 4.36Å; I30-L76 PolarHBondContact N-O 3.45Å; I30-L76 PolarHBondContact O-N 2.96Å; I30-L89 HydrophobicContact CD1-CB 4.29Å; I30-L89 HydrophobicContact CD1-CD1 4.45Å; I30-L89 HydrophobicContact CD1-CD2 4.39Å; I30-T93 HydrophobicContact CD1-CG2 3.63Å; I30-T93 HydrophobicContact CG1-CG2 4.42Å; I30-T93 HydrophobicContact CG2-CG2 4.33Å; I30-Y116 CarbonylContact C-O 3.58Å; I30-Y116 WeakPolarHBondContact CA-O 3.12Å
31	E	96.2	Very high	89.9	Confident	35 Å²	35	71 Å²	71	16%	0.164	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	119.1	173	-65.7	-69.6	175.9	0	0	109.2	R75 T115 Y116 E117 L118	E31-R75 WeakPolarHBondContact OE1-CD 3.49Å; E31-R75 WeakPolarHBondContact OE1-CG 3.42Å; E31-R75 IonicContact OE1-CZ 3.28Å; E31-R75 VanDerWaalsContact OE1-CZ 3.28Å; E31-R75 IonicContact OE1-NE 3.34Å; E31-R75 PolarHBondContact OE1-NE 3.35Å; E31-R75 IonicContact OE1-NH1 2.73Å; E31-R75 PolarHBondContact OE1-NH1 2.9Å; E31-T115 HydrophobicContact CG-CG2 3.98Å; E31-Y116 PolarHBondContact N-O 2.99Å; E31-E117 HydrophobicContact CB-CB 4.44Å; E31-E117 HydrophobicContact CB-CG 4.26Å; E31-L118 PolarHBondContact O-N 2.57Å
32	C	95	Very high	91.3	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.014	34%	0.344	C	S	.	.			trans	-119.5	22.1	179.3	-57.6	0	0	0	0	112	H34 P35 V36 M41 T74 L118	C32-H34 PolarHBondContact O-N 2.99Å; C32-P35 HydrophobicContact CB-CG 4.37Å; C32-P35 VanDerWaalsContact O-CD 3.27Å; C32-P35 WeakPolarHBondContact O-CD 3.34Å; C32-P35 WeakPolarHBondContact O-CG 3.49Å; C32-V36 HydrophobicContact CB-CG2 3.89Å; C32-V36 VanDerWaalsContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CB 3.25Å; C32-V36 WeakPolarHBondContact O-CG2 3.44Å; C32-V36 PolarHBondContact O-N 3.38Å; C32-V36 VanDerWaalsContact O-N 3.17Å; C32-M41 HydrophobicContact CB-SD 4.4Å; C32-T74 WeakPolarHBondContact CA-O 3.36Å; C32-T74 WeakPolarHBondContact CB-O 3.34Å; C32-T74 PolarHBondContact N-O 3.29Å; C32-L118 HydrophobicContact CB-CD1 4.18Å
33	S	93.6	Very high	92.5	Very high	24 Å²	24	57.5 Å²	57.5	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-49.5	-62.3	-176.9	48.3	0	0	0	0	112.9	V36 E37	S33-V36 PolarHBondContact O-N 3.47Å; S33-E37 WeakPolarHBondContact O-CB 3.31Å; S33-E37 VanDerWaalsContact O-CG 3.3Å; S33-E37 WeakPolarHBondContact O-CG 3.47Å; S33-E37 PolarHBondContact O-N 2.91Å
34	H	91.3	Very high	93.6	Very high	82 Å²	82	52.3 Å²	52.3	38%	0.38	29%	0.29	S	S	.	.	H	α-helix	trans	-52.8	-56.8	-176.1	-57.1	-56.2	0	0	0	113.8	C32 V36 E37 D38 E117 Y120	C32-H34 PolarHBondContact O-N 2.99Å; H34-V36 VanDerWaalsContact C-N 3.29Å; H34-V36 PolarHBondContact O-N 3.04Å; H34-E37 PolarHBondContact O-N 3.2Å; H34-D38 WeakPolarHBondContact O-CB 3.35Å; H34-D38 VanDerWaalsContact O-CG 3.27Å; H34-D38 PolarHBondContact O-N 3.43Å; H34-E117 IonicContact CD2-OE1 3.92Å; H34-E117 IonicContact NE2-OE1 3.76Å; H34-Y120 HydrophobicContact CB-CE2 4.1Å
35	P	94.4	Very high	94.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-71.1	-21.6	-177.3	30.4	-38.9	0	0	0	114.3	C32 G39 I40 M41 L106 L118	C32-P35 HydrophobicContact CB-CG 4.37Å; C32-P35 VanDerWaalsContact O-CD 3.27Å; C32-P35 WeakPolarHBondContact O-CD 3.34Å; C32-P35 WeakPolarHBondContact O-CG 3.49Å; P35-G39 PolarHBondContact O-N 2.84Å; P35-I40 HydrophobicContact CB-CD1 3.75Å; P35-I40 HydrophobicContact CB-CG1 3.68Å; P35-I40 WeakPolarHBondContact O-CG1 3.42Å; P35-I40 PolarHBondContact O-N 3.04Å; P35-I40 VanDerWaalsContact O-N 3.13Å; P35-M41 HydrophobicContact CB-CB 3.87Å; P35-M41 HydrophobicContact CG-CB 4.43Å; P35-M41 HydrophobicContact CG-CE 4.46Å; P35-M41 HydrophobicContact CG-SD 4.39Å; P35-M41 PolarHBondContact O-N 3.34Å; P35-L106 HydrophobicContact CB-CD1 3.69Å; P35-L106 HydrophobicContact CB-CD2 4.26Å; P35-L106 HydrophobicContact CG-CD1 4.21Å; P35-L118 HydrophobicContact CG-CB 4.1Å; P35-L118 HydrophobicContact CG-CD1 3.91Å
36	V	94.2	Very high	94.5	Very high	38 Å²	38	47 Å²	47	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-81	-40.9	177.1	174.6	0	0	0	0	110.6	C32 S33 H34 D38 G39 A43 T74	C32-V36 HydrophobicContact CB-CG2 3.89Å; C32-V36 VanDerWaalsContact O-CB 3.3Å; C32-V36 WeakPolarHBondContact O-CB 3.25Å; C32-V36 WeakPolarHBondContact O-CG2 3.44Å; C32-V36 PolarHBondContact O-N 3.38Å; C32-V36 VanDerWaalsContact O-N 3.17Å; S33-V36 PolarHBondContact O-N 3.47Å; H34-V36 VanDerWaalsContact C-N 3.29Å; H34-V36 PolarHBondContact O-N 3.04Å; V36-D38 VanDerWaalsContact C-N 3.35Å; V36-G39 PolarHBondContact O-N 2.83Å; V36-G39 VanDerWaalsContact O-N 3.15Å; V36-A43 HydrophobicContact CG1-CB 4.47Å; V36-A43 HydrophobicContact CG2-CB 3.93Å; V36-T74 HydrophobicContact CB-CG2 4.24Å; V36-T74 HydrophobicContact CG1-CG2 4.05Å
37	E	93.4	Very high	94.6	Very high	137 Å²	137	45 Å²	45	64%	0.64	25%	0.247	S	C	*	.	H	α-helix	trans	-64.1	-39.5	175.6	-72.9	166.7	-164.2	0	0	111.7	S33 H34 G39	S33-E37 WeakPolarHBondContact O-CB 3.31Å; S33-E37 VanDerWaalsContact O-CG 3.3Å; S33-E37 WeakPolarHBondContact O-CG 3.47Å; S33-E37 PolarHBondContact O-N 2.91Å; H34-E37 PolarHBondContact O-N 3.2Å; E37-G39 PolarHBondContact O-N 2.68Å
38	D	93.3	Very high	94.6	Very high	98 Å²	98	43.3 Å²	43.3	52%	0.524	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.9	175.3	-64.2	-27.3	0	0	0	113.4	H34 V36 I40 Y120	H34-D38 WeakPolarHBondContact O-CB 3.35Å; H34-D38 VanDerWaalsContact O-CG 3.27Å; H34-D38 PolarHBondContact O-N 3.43Å; V36-D38 VanDerWaalsContact C-N 3.35Å; D38-I40 HydrophobicContact CB-CG1 4.43Å; D38-I40 PolarHBondContact O-N 3.29Å; D38-Y120 VanDerWaalsContact OD2-CE2 3.28Å; D38-Y120 WeakPolarHBondContact OD2-CE2 3.28Å; D38-Y120 VanDerWaalsContact OD2-CZ 3.3Å; D38-Y120 PolarHBondContact OD2-OH 3.42Å
39	G	92	Very high	94.6	Very high	63 Å²	63	42.9 Å²	42.9	65%	0.649	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	4.4	178.7	0	0	0	0	0	115.7	P35 V36 E37	P35-G39 PolarHBondContact O-N 2.84Å; V36-G39 PolarHBondContact O-N 2.83Å; V36-G39 VanDerWaalsContact O-N 3.15Å; E37-G39 PolarHBondContact O-N 2.68Å
40	I	92.9	Very high	94.6	Very high	69 Å²	69	41 Å²	41	35%	0.354	23%	0.232	S	C	.	.	S	Bend	trans	-77.8	-20	179.5	61.2	160.8	0	0	0	113.2	P35 D38 L102 L106 Y120	P35-I40 HydrophobicContact CB-CD1 3.75Å; P35-I40 HydrophobicContact CB-CG1 3.68Å; P35-I40 WeakPolarHBondContact O-CG1 3.42Å; P35-I40 PolarHBondContact O-N 3.04Å; P35-I40 VanDerWaalsContact O-N 3.13Å; D38-I40 HydrophobicContact CB-CG1 4.43Å; D38-I40 PolarHBondContact O-N 3.29Å; I40-L102 HydrophobicContact CB-CD2 4.38Å; I40-L102 HydrophobicContact CD1-CD2 4.44Å; I40-L106 HydrophobicContact CD1-CD1 3.94Å; I40-L106 HydrophobicContact CD1-CD2 4.32Å; I40-L106 HydrophobicContact CD1-CG 4.26Å; I40-Y120 HydrophobicContact CD1-CE1 3.94Å; I40-Y120 WeakPolarHBondContact CD1-OH 3.25Å
41	M	92.7	Very high	94.5	Very high	9 Å²	9	45.7 Å²	45.7	4%	0.044	25%	0.25	C	S	.	.	S	Bend	trans	-128	130.2	178.1	-180	178.9	-64.6	0	0	111.2	C32 P35 F46 Y96 L97 L102 L106 L118	C32-M41 HydrophobicContact CB-SD 4.4Å; P35-M41 HydrophobicContact CB-CB 3.87Å; P35-M41 HydrophobicContact CG-CB 4.43Å; P35-M41 HydrophobicContact CG-CE 4.46Å; P35-M41 HydrophobicContact CG-SD 4.39Å; P35-M41 PolarHBondContact O-N 3.34Å; M41-F46 HydrophobicContact SD-CD1 4.48Å; M41-Y96 HydrophobicContact CE-CD1 4.35Å; M41-Y96 HydrophobicContact CE-CE1 4.03Å; M41-Y96 HydrophobicContact CG-CE1 4.13Å; M41-Y96 HydrophobicContact SD-CE1 4.15Å; M41-L97 HydrophobicContact CE-CD2 3.39Å; M41-L102 HydrophobicContact CB-CD1 4.29Å; M41-L102 HydrophobicContact CE-CD1 3.89Å; M41-L106 HydrophobicContact CE-CD1 4.04Å; M41-L118 HydrophobicContact CE-CD1 3.42Å; M41-L118 VanDerWaalsContact CE-CD1 3.42Å; M41-L118 HydrophobicContact SD-CD1 3.74Å
42	N	93.9	Very high	94.5	Very high	108 Å²	108	50.1 Å²	50.1	58%	0.578	27%	0.271	S	S	*	.			trans	-88.1	117	167.7	-172	-26.6	0	0	0	110.6	G44 D45 F46 Y96	N42-G44 VanDerWaalsContact C-N 3.32Å; N42-G44 PolarHBondContact O-N 3.01Å; N42-G44 PolarHBondContact OD1-N 3.09Å; N42-D45 HydrophobicContact CB-CB 4.1Å; N42-D45 PolarHBondContact O-N 2.88Å; N42-D45 PolarHBondContact OD1-N 3.39Å; N42-F46 PolarHBondContact O-N 3Å; N42-F46 VanDerWaalsContact O-N 3.17Å; N42-Y96 PolarHBondContact O-OH 3.07Å
43	A	94.6	Very high	94.5	Very high	7 Å²	7	55.1 Å²	55.1	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-32.1	179.6	0	0	0	0	0	113.2	V36 F46 E47 L71	V36-A43 HydrophobicContact CG1-CB 4.47Å; V36-A43 HydrophobicContact CG2-CB 3.93Å; A43-F46 PolarHBondContact O-N 3.34Å; A43-E47 PolarHBondContact O-N 3.34Å; A43-L71 HydrophobicContact CB-CD1 3.72Å; A43-L71 HydrophobicContact CB-CD2 3.95Å; A43-L71 HydrophobicContact CB-CG 4.49Å
44	G	95.1	Very high	94.7	Very high	20 Å²	20	54 Å²	54	21%	0.206	28%	0.282	C	S	.	.	H	α-helix	trans	-72	-39.4	177.7	0	0	0	0	0	113.1	N42 F46 E47 N48	N42-G44 VanDerWaalsContact C-N 3.32Å; N42-G44 PolarHBondContact O-N 3.01Å; N42-G44 PolarHBondContact OD1-N 3.09Å; G44-F46 VanDerWaalsContact C-N 3.28Å; G44-F46 PolarHBondContact O-N 3.02Å; G44-E47 PolarHBondContact O-N 2.94Å; G44-N48 PolarHBondContact O-N 3.18Å; G44-N48 PolarHBondContact O-ND2 2.81Å
45	D	95.3	Very high	94.9	Very high	58 Å²	58	55.3 Å²	55.3	31%	0.31	29%	0.286	S	S	.	.	H	α-helix	trans	-62.4	-40.5	171.6	-176.3	48.6	0	0	0	110.5	N42 N48 F49 Y96 Q100	N42-D45 HydrophobicContact CB-CB 4.1Å; N42-D45 PolarHBondContact O-N 2.88Å; N42-D45 PolarHBondContact OD1-N 3.39Å; D45-N48 PolarHBondContact O-N 3.47Å; D45-F49 WeakPolarHBondContact O-CB 3.48Å; D45-F49 PolarHBondContact O-N 3.38Å; D45-Y96 VanDerWaalsContact OD2-CE2 3.28Å; D45-Y96 WeakPolarHBondContact OD2-CE2 3.25Å; D45-Y96 PolarHBondContact OD2-OH 3.14Å; D45-Q100 PolarHBondContact OD2-NE2 3.3Å
46	F	96.2	Very high	94.8	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.009	29%	0.288	C	S	.	.	H	α-helix	trans	-66.6	-40.1	177.5	-175	-134.9	0	0	0	112.8	I30 M41 N42 A43 G44 F49 L50 L76 T93 Y96	I30-F46 HydrophobicContact CD1-CE1 4.12Å; I30-F46 HydrophobicContact CD1-CZ 4.07Å; I30-F46 HydrophobicContact CG2-CE1 4.35Å; M41-F46 HydrophobicContact SD-CD1 4.48Å; N42-F46 PolarHBondContact O-N 3Å; N42-F46 VanDerWaalsContact O-N 3.17Å; A43-F46 PolarHBondContact O-N 3.34Å; G44-F46 VanDerWaalsContact C-N 3.28Å; G44-F46 PolarHBondContact O-N 3.02Å; F46-F49 HydrophobicContact CD2-CD1 4.39Å; F46-F49 HydrophobicContact CE2-CD1 4.37Å; F46-F49 PolarHBondContact O-N 3.04Å; F46-L50 HydrophobicContact CD2-CG 4.35Å; F46-L50 HydrophobicContact CE1-CD1 4.04Å; F46-L50 HydrophobicContact CE2-CD1 4.13Å; F46-L50 HydrophobicContact CE2-CD2 3.9Å; F46-L50 HydrophobicContact CE2-CG 3.84Å; F46-L50 HydrophobicContact CZ-CD1 3.71Å; F46-L50 HydrophobicContact CZ-CD2 4.02Å; F46-L50 HydrophobicContact CZ-CG 3.93Å; F46-L50 WeakPolarHBondContact O-CG 3.46Å; F46-L50 PolarHBondContact O-N 2.8Å; F46-L76 HydrophobicContact CD1-CD1 3.09Å; F46-L76 HydrophobicContact CE1-CD1 3.32Å; F46-L76 HydrophobicContact CG-CD1 4.06Å; F46-L76 HydrophobicContact CZ-CD1 4.43Å; F46-T93 HydrophobicContact CE1-CG2 4.25Å; F46-T93 HydrophobicContact CE2-CG2 4.23Å; F46-T93 HydrophobicContact CZ-CG2 3.45Å; F46-T93 VanDerWaalsContact CZ-CG2 3.45Å; F46-Y96 HydrophobicContact CB-CD1 4.28Å; F46-Y96 HydrophobicContact CB-CE1 3.72Å; F46-Y96 HydrophobicContact CB-CE2 4.21Å; F46-Y96 AromaticContact CD2-CD1 3.34Å; F46-Y96 HydrophobicContact CD2-CD1 3.34Å; F46-Y96 AromaticContact CD2-CD2 3.85Å; F46-Y96 HydrophobicContact CD2-CD2 3.85Å; F46-Y96 AromaticContact CD2-CE1 3.71Å; F46-Y96 HydrophobicContact CD2-CE1 3.71Å; F46-Y96 HydrophobicContact CD2-CE2 4.17Å; F46-Y96 AromaticContact CD2-CG 3.4Å; F46-Y96 HydrophobicContact CD2-CG 3.4Å; F46-Y96 VanDerWaalsContact CD2-CG 3.4Å; F46-Y96 AromaticContact CE2-CD1 3.97Å; F46-Y96 HydrophobicContact CE2-CD1 3.97Å; F46-Y96 AromaticContact CE2-CG 3.93Å; F46-Y96 HydrophobicContact CE2-CG 3.93Å; F46-Y96 AromaticContact CG-CD1 3.95Å; F46-Y96 HydrophobicContact CG-CD1 3.95Å; F46-Y96 AromaticContact CG-CE1 3.88Å; F46-Y96 HydrophobicContact CG-CE1 3.88Å; F46-Y96 HydrophobicContact CG-CG 4.38Å; F46-Y96 PolarHBondContact N-OH 3.07Å
47	E	95.9	Very high	94.7	Very high	25 Å²	25	60.1 Å²	60.1	12%	0.117	31%	0.311	C	S	.	.	H	α-helix	trans	-58.3	-49.2	172.8	-173.3	-175	-175.6	0	0	111.7	A43 G44 F49 L50 R51 I69 L71 L76	A43-E47 PolarHBondContact O-N 3.34Å; G44-E47 PolarHBondContact O-N 2.94Å; E47-F49 PolarHBondContact O-N 2.86Å; E47-L50 PolarHBondContact O-N 2.8Å; E47-R51 PolarHBondContact O-N 3.36Å; E47-R51 IonicContact OE1-CZ 3.18Å; E47-R51 IonicContact OE1-NH1 3.43Å; E47-R51 PolarHBondContact OE1-NH1 2.94Å; E47-R51 IonicContact OE1-NH2 2.62Å; E47-R51 PolarHBondContact OE1-NH2 2.9Å; E47-I69 HydrophobicContact CG-CG2 4.03Å; E47-L71 WeakPolarHBondContact OE2-CB 3.2Å; E47-L76 HydrophobicContact CB-CD2 3.96Å; E47-L76 HydrophobicContact CG-CD2 4.04Å
48	N	95.7	Very high	94.6	Very high	77 Å²	77	56.3 Å²	56.3	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-42.7	178.4	-72.1	-25	0	0	0	111.6	G44 D45 L50 R51 E52	G44-N48 PolarHBondContact O-N 3.18Å; G44-N48 PolarHBondContact O-ND2 2.81Å; D45-N48 PolarHBondContact O-N 3.47Å; N48-L50 VanDerWaalsContact C-N 3.29Å; N48-L50 PolarHBondContact O-N 2.62Å; N48-R51 WeakPolarHBondContact O-CB 3.3Å; N48-R51 PolarHBondContact O-N 3.43Å; N48-R51 VanDerWaalsContact O-N 3.14Å; N48-E52 PolarHBondContact O-N 3.5Å
49	F	96.9	Very high	94.6	Very high	6 Å²	6	59 Å²	59	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-57	-43	174.2	175.2	-89.4	0	0	0	112	D45 F46 E47 E52 R53 L92 K95 Y96 K99	D45-F49 WeakPolarHBondContact O-CB 3.48Å; D45-F49 PolarHBondContact O-N 3.38Å; F46-F49 HydrophobicContact CD2-CD1 4.39Å; F46-F49 HydrophobicContact CE2-CD1 4.37Å; F46-F49 PolarHBondContact O-N 3.04Å; E47-F49 PolarHBondContact O-N 2.86Å; F49-E52 PolarHBondContact O-N 3.01Å; F49-R53 HydrophobicContact CD1-CG 4.36Å; F49-R53 HydrophobicContact CD2-CG 4.04Å; F49-R53 HydrophobicContact CE1-CB 4.29Å; F49-R53 HydrophobicContact CE1-CG 4.07Å; F49-R53 HydrophobicContact CE2-CG 3.76Å; F49-R53 HydrophobicContact CG-CG 4.34Å; F49-R53 HydrophobicContact CZ-CB 4.4Å; F49-R53 HydrophobicContact CZ-CG 3.79Å; F49-R53 VanDerWaalsContact O-CB 3.25Å; F49-R53 WeakPolarHBondContact O-CB 3.45Å; F49-R53 VanDerWaalsContact O-CG 3.25Å; F49-R53 WeakPolarHBondContact O-CG 3.31Å; F49-R53 PolarHBondContact O-N 2.97Å; F49-L92 HydrophobicContact CE1-CB 4.48Å; F49-L92 WeakPolarHBondContact CE1-O 3.4Å; F49-K95 HydrophobicContact CZ-CB 4.2Å; F49-K95 HydrophobicContact CZ-CD 4.29Å; F49-K95 HydrophobicContact CZ-CG 4.1Å; F49-Y96 HydrophobicContact CB-CD2 3.79Å; F49-Y96 HydrophobicContact CB-CE2 4.11Å; F49-Y96 AromaticContact CD1-CD2 3.9Å; F49-Y96 HydrophobicContact CD1-CD2 3.9Å; F49-Y96 HydrophobicContact CD1-CG 4.21Å; F49-Y96 AromaticContact CD2-CD2 3.86Å; F49-Y96 HydrophobicContact CD2-CD2 3.86Å; F49-Y96 HydrophobicContact CE1-CD2 4.46Å; F49-Y96 HydrophobicContact CE2-CD2 4.39Å; F49-Y96 AromaticContact CG-CD2 3.57Å; F49-Y96 HydrophobicContact CG-CD2 3.57Å; F49-Y96 HydrophobicContact CG-CE2 4.36Å; F49-Y96 HydrophobicContact CG-CG 4.33Å; F49-K99 HydrophobicContact CE2-CD 4.35Å
50	L	96.5	Very high	94.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-42	177	-69.6	178.3	0	0	0	111.5	I30 F46 E47 N48 E52 R53 I54 I69 L76 L92	I30-L50 HydrophobicContact CD1-CD1 4.33Å; F46-L50 HydrophobicContact CD2-CG 4.35Å; F46-L50 HydrophobicContact CE1-CD1 4.04Å; F46-L50 HydrophobicContact CE2-CD1 4.13Å; F46-L50 HydrophobicContact CE2-CD2 3.9Å; F46-L50 HydrophobicContact CE2-CG 3.84Å; F46-L50 HydrophobicContact CZ-CD1 3.71Å; F46-L50 HydrophobicContact CZ-CD2 4.02Å; F46-L50 HydrophobicContact CZ-CG 3.93Å; F46-L50 WeakPolarHBondContact O-CG 3.46Å; F46-L50 PolarHBondContact O-N 2.8Å; E47-L50 PolarHBondContact O-N 2.8Å; N48-L50 VanDerWaalsContact C-N 3.29Å; N48-L50 PolarHBondContact O-N 2.62Å; L50-E52 VanDerWaalsContact C-N 3.31Å; L50-E52 PolarHBondContact O-N 3.19Å; L50-R53 PolarHBondContact O-N 3.43Å; L50-I54 HydrophobicContact CB-CD1 4.28Å; L50-I54 VanDerWaalsContact O-CB 3.3Å; L50-I54 WeakPolarHBondContact O-CB 3.41Å; L50-I54 WeakPolarHBondContact O-CG1 3.43Å; L50-I54 PolarHBondContact O-N 3.19Å; L50-I69 HydrophobicContact CB-CD1 3.95Å; L50-L76 HydrophobicContact CD1-CD1 4.25Å; L50-L92 HydrophobicContact CD2-CB 3.77Å; L50-L92 HydrophobicContact CD2-CD1 4.01Å
51	R	95.1	Very high	94.6	Very high	100 Å²	100	59.5 Å²	59.5	38%	0.377	32%	0.323	S	S	.	.	H	α-helix	trans	-57	-44.1	176.6	-73.8	-178.8	173.8	138.5	4	112.1	E47 N48 L63 I69	E47-R51 PolarHBondContact O-N 3.36Å; E47-R51 IonicContact OE1-CZ 3.18Å; E47-R51 IonicContact OE1-NH1 3.43Å; E47-R51 PolarHBondContact OE1-NH1 2.94Å; E47-R51 IonicContact OE1-NH2 2.62Å; E47-R51 PolarHBondContact OE1-NH2 2.9Å; N48-R51 WeakPolarHBondContact O-CB 3.3Å; N48-R51 PolarHBondContact O-N 3.43Å; N48-R51 VanDerWaalsContact O-N 3.14Å; R51-L63 HydrophobicContact CB-CD1 4.23Å; R51-L63 HydrophobicContact CG-CD1 4.38Å; R51-L63 WeakPolarHBondContact O-CD1 3.47Å; R51-I69 HydrophobicContact CB-CD1 4.4Å; R51-I69 HydrophobicContact CG-CD1 3.78Å; R51-I69 PolarHBondContact NH2-O 3.18Å
52	E	96	Very high	94.5	Very high	128 Å²	128	62.6 Å²	62.6	60%	0.598	34%	0.339	S	S	*	.	H	α-helix	trans	-73.8	-37	-179.1	-69	177.4	-177.9	0	0	113.3	N48 F49 L50 T60	N48-E52 PolarHBondContact O-N 3.5Å; F49-E52 PolarHBondContact O-N 3.01Å; L50-E52 VanDerWaalsContact C-N 3.31Å; L50-E52 PolarHBondContact O-N 3.19Å; E52-T60 WeakPolarHBondContact O-CB 3.43Å; E52-T60 WeakPolarHBondContact O-CG2 3.37Å
53	R	96.4	Very high	94.2	Very high	107 Å²	107	58.8 Å²	58.8	40%	0.404	32%	0.319	S	S	.	.	H	α-helix	trans	-96	-19	-168.6	-64.7	-60.1	-160.7	154.1	2	114.4	F49 L50 K55 Y88 L92	F49-R53 HydrophobicContact CD1-CG 4.36Å; F49-R53 HydrophobicContact CD2-CG 4.04Å; F49-R53 HydrophobicContact CE1-CB 4.29Å; F49-R53 HydrophobicContact CE1-CG 4.07Å; F49-R53 HydrophobicContact CE2-CG 3.76Å; F49-R53 HydrophobicContact CG-CG 4.34Å; F49-R53 HydrophobicContact CZ-CB 4.4Å; F49-R53 HydrophobicContact CZ-CG 3.79Å; F49-R53 VanDerWaalsContact O-CB 3.25Å; F49-R53 WeakPolarHBondContact O-CB 3.45Å; F49-R53 VanDerWaalsContact O-CG 3.25Å; F49-R53 WeakPolarHBondContact O-CG 3.31Å; F49-R53 PolarHBondContact O-N 2.97Å; L50-R53 PolarHBondContact O-N 3.43Å; R53-K55 PolarHBondContact O-N 3.46Å; R53-Y88 PolarHBondContact O-OH 3.34Å; R53-Y88 VanDerWaalsContact O-OH 3.09Å; R53-L92 HydrophobicContact CB-CD2 3.86Å
54	I	96.6	Very high	93.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.345	C	S	.	.			trans	-63.1	134.7	174.2	-76.2	175.8	0	0	0	109.4	L50 L63 I67 I69 F84 Y88 L92	L50-I54 HydrophobicContact CB-CD1 4.28Å; L50-I54 VanDerWaalsContact O-CB 3.3Å; L50-I54 WeakPolarHBondContact O-CB 3.41Å; L50-I54 WeakPolarHBondContact O-CG1 3.43Å; L50-I54 PolarHBondContact O-N 3.19Å; I54-L63 HydrophobicContact CB-CD2 3.84Å; I54-L63 HydrophobicContact CG2-CD2 3.49Å; I54-L63 VanDerWaalsContact CG2-CD2 3.49Å; I54-I67 HydrophobicContact CD1-CG2 4.4Å; I54-I67 HydrophobicContact CG2-CD1 3.4Å; I54-I67 HydrophobicContact CG2-CG2 4.5Å; I54-I69 HydrophobicContact CD1-CD1 3.65Å; I54-I69 HydrophobicContact CD1-CG1 4.39Å; I54-F84 HydrophobicContact CD1-CE2 4.46Å; I54-F84 HydrophobicContact CD1-CZ 4.17Å; I54-F84 HydrophobicContact CG2-CE2 4.08Å; I54-Y88 HydrophobicContact CG1-CE1 4.41Å; I54-Y88 HydrophobicContact CG2-CE1 4.42Å; I54-L92 HydrophobicContact CB-CD1 4.49Å; I54-L92 HydrophobicContact CD1-CD1 4.4Å; I54-L92 HydrophobicContact CG1-CD1 3.43Å; I54-L92 VanDerWaalsContact CG1-CD1 3.43Å
55	K	95.1	Very high	93.4	Very high	109 Å²	109	67.7 Å²	67.7	47%	0.474	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.1	-179.9	-71.8	-177.1	171	-164.3	0	109.3	R53 K59 T60 Y88	R53-K55 PolarHBondContact O-N 3.46Å; K55-K59 VanDerWaalsContact CA-O 3.25Å; K55-K59 WeakPolarHBondContact CA-O 3.41Å; K55-T60 HydrophobicContact CD-CG2 4.41Å; K55-T60 HydrophobicContact CG-CG2 3.6Å; K55-Y88 PolarHBondContact N-OH 2.92Å
56	V	93.5	Very high	93.2	Very high	5 Å²	5	67.3 Å²	67.3	3%	0.03	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.7	170	-176.6	0	0	0	0	106.9	G58 K59 N62 L63 I67	V56-G58 PolarHBondContact O-N 2.96Å; V56-K59 PolarHBondContact N-O 3.23Å; V56-K59 PolarHBondContact O-N 3.09Å; V56-N62 HydrophobicContact CB-CB 4.5Å; V56-N62 VanDerWaalsContact CB-O 3.31Å; V56-N62 WeakPolarHBondContact CB-O 3.41Å; V56-N62 WeakPolarHBondContact CG2-O 3.44Å; V56-L63 HydrophobicContact CG2-CD2 4.42Å; V56-I67 HydrophobicContact CG2-CD1 3.44Å; V56-I67 VanDerWaalsContact CG2-CD1 3.44Å; V56-I67 HydrophobicContact CG2-CG1 4.08Å
57	N	90.6	Very high	93.1	Very high	135 Å²	135	67.8 Å²	67.8	72%	0.722	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	39.4	-174.9	-56.5	-25.5	0	0	0	113.3	K59	N57-K59 VanDerWaalsContact C-N 3.31Å; N57-K59 PolarHBondContact O-N 3.31Å
58	G	92.2	Very high	93	Very high	56 Å²	56	70.9 Å²	70.9	58%	0.577	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-10	175.9	0	0	0	0	0	116	V56	V56-G58 PolarHBondContact O-N 2.96Å
59	K	94.2	Very high	93	Very high	154 Å²	154	67.8 Å²	67.8	67%	0.67	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.2	-178.1	-62.7	-177.1	-179.7	-178.5	0	112	K55 V56 N57	K55-K59 VanDerWaalsContact CA-O 3.25Å; K55-K59 WeakPolarHBondContact CA-O 3.41Å; V56-K59 PolarHBondContact N-O 3.23Å; V56-K59 PolarHBondContact O-N 3.09Å; N57-K59 VanDerWaalsContact C-N 3.31Å; N57-K59 PolarHBondContact O-N 3.31Å
60	T	94.4	Very high	93	Very high	74 Å²	74	71.6 Å²	71.6	45%	0.454	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	160.8	167.4	46.7	0	0	0	0	110.2	E52 K55 N62	E52-T60 WeakPolarHBondContact O-CB 3.43Å; E52-T60 WeakPolarHBondContact O-CG2 3.37Å; K55-T60 HydrophobicContact CD-CG2 4.41Å; K55-T60 HydrophobicContact CG-CG2 3.6Å; T60-N62 PolarHBondContact O-N 3.1Å
61	G	90	Very high	93	Very high	69 Å²	69	74.4 Å²	74.4	71%	0.711	41%	0.408	S	S	*	.	S	Bend	trans	73.8	1.9	179.7	0	0	0	0	0	115.1
62	N	89.7	Confident	92.9	Very high	74 Å²	74	74.6 Å²	74.6	40%	0.396	41%	0.413	S	S	.	.			trans	-104	41.1	-179.6	-167.8	41.7	0	0	0	112.2	V56 T60	V56-N62 HydrophobicContact CB-CB 4.5Å; V56-N62 VanDerWaalsContact CB-O 3.31Å; V56-N62 WeakPolarHBondContact CB-O 3.41Å; V56-N62 WeakPolarHBondContact CG2-O 3.44Å; T60-N62 PolarHBondContact O-N 3.1Å
63	L	88.6	Confident	92.6	Very high	29 Å²	29	77.4 Å²	77.4	15%	0.152	42%	0.424	C	S	.	.			trans	-68	-40.9	-179.4	-57.9	-178.9	0	0	0	111.3	R51 I54 V56 N65 N66 I67	R51-L63 HydrophobicContact CB-CD1 4.23Å; R51-L63 HydrophobicContact CG-CD1 4.38Å; R51-L63 WeakPolarHBondContact O-CD1 3.47Å; I54-L63 HydrophobicContact CB-CD2 3.84Å; I54-L63 HydrophobicContact CG2-CD2 3.49Å; I54-L63 VanDerWaalsContact CG2-CD2 3.49Å; V56-L63 HydrophobicContact CG2-CD2 4.42Å; L63-N65 PolarHBondContact O-N 2.87Å; L63-N66 VanDerWaalsContact O-CB 3.31Å; L63-N66 WeakPolarHBondContact O-CB 3.38Å; L63-N66 PolarHBondContact O-N 3.02Å; L63-I67 HydrophobicContact CD2-CB 4.25Å; L63-I67 HydrophobicContact CD2-CD1 4.46Å; L63-I67 PolarHBondContact O-N 3.22Å
64	G	84.6	Confident	92.4	Very high	59 Å²	59	74.1 Å²	74.1	61%	0.608	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	-136.1	-178.6	0	0	0	0	0	112	N66	G64-N66 VanDerWaalsContact C-N 3.29Å
65	N	88.2	Confident	92.3	Very high	154 Å²	154	77.5 Å²	77.5	82%	0.824	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	13.7	171.9	-60.8	-16.7	0	0	0	112.5	L63	L63-N65 PolarHBondContact O-N 2.87Å
66	N	91.1	Very high	92.3	Very high	51 Å²	51	72.4 Å²	72.4	27%	0.273	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-32.1	-173.2	-64	-35.8	0	0	0	112.3	L63 G64 A80 D81 V82	L63-N66 VanDerWaalsContact O-CB 3.31Å; L63-N66 WeakPolarHBondContact O-CB 3.38Å; L63-N66 PolarHBondContact O-N 3.02Å; G64-N66 VanDerWaalsContact C-N 3.29Å; N66-A80 WeakPolarHBondContact O-CA 3.49Å; N66-D81 PolarHBondContact O-N 3.39Å; N66-V82 HydrophobicContact CB-CB 4.49Å; N66-V82 HydrophobicContact CB-CG2 3.63Å
67	I	94.2	Very high	92.5	Very high	11 Å²	11	72.4 Å²	72.4	6%	0.056	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	122.9	-178.9	-58.9	-179.3	0	0	0	108.8	I54 V56 L63 I69 V78 T79 A80 F84	I54-I67 HydrophobicContact CD1-CG2 4.4Å; I54-I67 HydrophobicContact CG2-CD1 3.4Å; I54-I67 HydrophobicContact CG2-CG2 4.5Å; V56-I67 HydrophobicContact CG2-CD1 3.44Å; V56-I67 VanDerWaalsContact CG2-CD1 3.44Å; V56-I67 HydrophobicContact CG2-CG1 4.08Å; L63-I67 HydrophobicContact CD2-CB 4.25Å; L63-I67 HydrophobicContact CD2-CD1 4.46Å; L63-I67 PolarHBondContact O-N 3.22Å; I67-I69 HydrophobicContact CG2-CG1 4.14Å; I67-V78 HydrophobicContact CG2-CG1 3.94Å; I67-T79 CarbonylContact C-O 3.57Å; I67-T79 WeakPolarHBondContact CA-O 3.48Å; I67-A80 HydrophobicContact CG1-CB 4.26Å; I67-F84 HydrophobicContact CD1-CD2 3.81Å; I67-F84 HydrophobicContact CD1-CE2 3.85Å
68	L	94.5	Very high	92.8	Very high	91 Å²	91	66 Å²	66	48%	0.476	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.2	174.5	-177.1	92.6	0	0	0	108.3	E70 V78 T79	L68-E70 HydrophobicContact CD2-CG 3.85Å; L68-E70 VanDerWaalsContact CD2-OE1 3.31Å; L68-E70 WeakPolarHBondContact CD2-OE1 3.43Å; L68-E70 HydrophobicContact CG-CG 4.04Å; L68-V78 WeakPolarHBondContact O-CA 3.31Å; L68-T79 PolarHBondContact N-O 3.46Å; L68-T79 PolarHBondContact O-N 2.79Å
69	I	95.7	Very high	92.9	Very high	11 Å²	11	64.1 Å²	64.1	6%	0.056	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.6	177.7	-50	176.8	0	0	0	107.1	E47 L50 R51 I54 I67 L76 C77 V78	E47-I69 HydrophobicContact CG-CG2 4.03Å; L50-I69 HydrophobicContact CB-CD1 3.95Å; R51-I69 HydrophobicContact CB-CD1 4.4Å; R51-I69 HydrophobicContact CG-CD1 3.78Å; R51-I69 PolarHBondContact NH2-O 3.18Å; I54-I69 HydrophobicContact CD1-CD1 3.65Å; I54-I69 HydrophobicContact CD1-CG1 4.39Å; I67-I69 HydrophobicContact CG2-CG1 4.14Å; I69-L76 HydrophobicContact CG2-CD2 4.31Å; I69-C77 WeakPolarHBondContact CA-O 3.28Å; I69-V78 HydrophobicContact CG2-CG2 4.4Å
70	E	95.7	Very high	93	Very high	86 Å²	86	56.8 Å²	56.8	40%	0.402	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.7	-178.7	-62.8	179.8	155.9	0	0	110.4	L68 C77	L68-E70 HydrophobicContact CD2-CG 3.85Å; L68-E70 VanDerWaalsContact CD2-OE1 3.31Å; L68-E70 WeakPolarHBondContact CD2-OE1 3.43Å; L68-E70 HydrophobicContact CG-CG 4.04Å; E70-C77 HydrophobicContact CB-CB 4.38Å; E70-C77 PolarHBondContact N-O 3.42Å; E70-C77 PolarHBondContact O-N 2.92Å
71	L	95.8	Very high	92.9	Very high	59 Å²	59	55.2 Å²	55.2	31%	0.309	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.1	172.6	179.4	64.6	0	0	0	110.8	A43 E47 L76	A43-L71 HydrophobicContact CB-CD1 3.72Å; A43-L71 HydrophobicContact CB-CD2 3.95Å; A43-L71 HydrophobicContact CB-CG 4.49Å; E47-L71 WeakPolarHBondContact OE2-CB 3.2Å; L71-L76 HydrophobicContact CB-CD2 3.94Å; L71-L76 HydrophobicContact CD1-CD2 3.75Å; L71-L76 HydrophobicContact CD1-CG 3.8Å; L71-L76 HydrophobicContact CG-CD2 4.45Å
72	Q	93.7	Very high	92.9	Very high	105 Å²	105	53.8 Å²	53.8	49%	0.491	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	76.6	173.8	-63.2	-177.3	-5.7	0	0	109.6	T74 R75	Q72-T74 VanDerWaalsContact C-N 3.27Å; Q72-T74 PolarHBondContact O-N 3.42Å; Q72-R75 WeakPolarHBondContact CA-O 3.36Å; Q72-R75 HydrophobicContact CB-CB 4.43Å; Q72-R75 PolarHBondContact N-O 3.17Å; Q72-R75 PolarHBondContact O-N 3.48Å
73	K	89.3	Confident	93	Very high	187 Å²	187	56.2 Å²	56.2	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	-74.9	-175.8	-61	179.8	178	-178.8	0	114
74	T	92.3	Very high	93.2	Very high	37 Å²	37	55.8 Å²	55.8	23%	0.227	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-10.5	-178.1	53.1	0	0	0	0	112.8	C32 V36 Q72	C32-T74 WeakPolarHBondContact CA-O 3.36Å; C32-T74 WeakPolarHBondContact CB-O 3.34Å; C32-T74 PolarHBondContact N-O 3.29Å; V36-T74 HydrophobicContact CB-CG2 4.24Å; V36-T74 HydrophobicContact CG1-CG2 4.05Å; Q72-T74 VanDerWaalsContact C-N 3.27Å; Q72-T74 PolarHBondContact O-N 3.42Å
75	R	94.6	Very high	93.6	Very high	72 Å²	72	56 Å²	56	27%	0.272	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.8	-179.7	-173.4	-176.9	179.7	142.2	-13	110.6	F29 E31 Q72	F29-R75 HydrophobicContact CD1-CG 4.49Å; F29-R75 VanDerWaalsContact CD1-NH2 3.35Å; F29-R75 VanDerWaalsContact CD2-NH2 3.32Å; E31-R75 WeakPolarHBondContact OE1-CD 3.49Å; E31-R75 WeakPolarHBondContact OE1-CG 3.42Å; E31-R75 IonicContact OE1-CZ 3.28Å; E31-R75 VanDerWaalsContact OE1-CZ 3.28Å; E31-R75 IonicContact OE1-NE 3.34Å; E31-R75 PolarHBondContact OE1-NE 3.35Å; E31-R75 IonicContact OE1-NH1 2.73Å; E31-R75 PolarHBondContact OE1-NH1 2.9Å; Q72-R75 WeakPolarHBondContact CA-O 3.36Å; Q72-R75 HydrophobicContact CB-CB 4.43Å; Q72-R75 PolarHBondContact N-O 3.17Å; Q72-R75 PolarHBondContact O-N 3.48Å
76	L	96.6	Very high	94	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.9	172.4	-82.6	161.7	0	0	0	110.8	F29 I30 F46 E47 L50 I69 L71	F29-L76 CarbonylContact C-O 3.6Å; F29-L76 VanDerWaalsContact CA-O 3.31Å; F29-L76 WeakPolarHBondContact CA-O 3.4Å; I30-L76 HydrophobicContact CB-CB 4.36Å; I30-L76 PolarHBondContact N-O 3.45Å; I30-L76 PolarHBondContact O-N 2.96Å; F46-L76 HydrophobicContact CD1-CD1 3.09Å; F46-L76 HydrophobicContact CE1-CD1 3.32Å; F46-L76 HydrophobicContact CG-CD1 4.06Å; F46-L76 HydrophobicContact CZ-CD1 4.43Å; E47-L76 HydrophobicContact CB-CD2 3.96Å; E47-L76 HydrophobicContact CG-CD2 4.04Å; L50-L76 HydrophobicContact CD1-CD1 4.25Å; I69-L76 HydrophobicContact CG2-CD2 4.31Å; L71-L76 HydrophobicContact CB-CD2 3.94Å; L71-L76 HydrophobicContact CD1-CD2 3.75Å; L71-L76 HydrophobicContact CD1-CG 3.8Å; L71-L76 HydrophobicContact CG-CD2 4.45Å
77	C	96.6	Very high	94.3	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.034	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124.5	176.2	-177.9	0	0	0	0	109.6	F29 I69 E70	F29-C77 HydrophobicContact CD1-CB 4.07Å; F29-C77 HydrophobicContact CE1-CB 4.03Å; F29-C77 VanDerWaalsContact CE1-SG 3.58Å; I69-C77 WeakPolarHBondContact CA-O 3.28Å; E70-C77 HydrophobicContact CB-CB 4.38Å; E70-C77 PolarHBondContact N-O 3.42Å; E70-C77 PolarHBondContact O-N 2.92Å
78	V	96.4	Very high	94.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	109.8	172.9	-178.9	0	0	0	0	108.2	K27 F28 I67 L68 I69 F84 L89	K27-V78 WeakPolarHBondContact CA-O 3.42Å; F28-V78 PolarHBondContact N-O 2.85Å; F28-V78 PolarHBondContact O-N 2.87Å; I67-V78 HydrophobicContact CG2-CG1 3.94Å; L68-V78 WeakPolarHBondContact O-CA 3.31Å; I69-V78 HydrophobicContact CG2-CG2 4.4Å; V78-F84 HydrophobicContact CG1-CE1 3.93Å; V78-F84 HydrophobicContact CG1-CZ 4.12Å; V78-L89 HydrophobicContact CB-CD1 4.3Å; V78-L89 HydrophobicContact CB-CD2 4.44Å; V78-L89 HydrophobicContact CG1-CD2 4.45Å; V78-L89 HydrophobicContact CG2-CD1 4.35Å; V78-L89 HydrophobicContact CG2-CD2 3.95Å
79	T	95.7	Very high	94.5	Very high	18 Å²	18	54.4 Å²	54.4	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.4	174.5	-59.8	0	0	0	0	108.7	T25 Q26 K27 I67 L68	T25-T79 HydrophobicContact CG2-CG2 3.36Å; Q26-T79 CarbonylContact O-C 3.56Å; Q26-T79 WeakPolarHBondContact O-CA 3.48Å; K27-T79 HydrophobicContact CG-CG2 4.07Å; I67-T79 CarbonylContact C-O 3.57Å; I67-T79 WeakPolarHBondContact CA-O 3.48Å; L68-T79 PolarHBondContact N-O 3.46Å; L68-T79 PolarHBondContact O-N 2.79Å
80	A	95	Very high	94.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130	-177.5	0	0	0	0	0	111.3	T25 Q26 N66 I67 F84	T25-A80 CarbonylContact C-O 3.58Å; T25-A80 WeakPolarHBondContact CA-O 3.31Å; Q26-A80 PolarHBondContact N-O 2.99Å; Q26-A80 PolarHBondContact O-N 2.85Å; N66-A80 WeakPolarHBondContact O-CA 3.49Å; I67-A80 HydrophobicContact CG1-CB 4.26Å; A80-F84 HydrophobicContact CB-CB 3.41Å; A80-F84 VanDerWaalsContact CB-CB 3.41Å; A80-F84 HydrophobicContact CB-CD1 4.15Å; A80-F84 HydrophobicContact CB-CD2 4.39Å; A80-F84 HydrophobicContact CB-CG 3.77Å
81	D	92.2	Very high	94.7	Very high	40 Å²	40	59.2 Å²	59.2	21%	0.214	28%	0.282	C	S	.	.	S	Bend	trans	-99.1	-10.1	179.9	-85.3	-19.1	0	0	0	113.4	K23 T25 N66	K23-D81 WeakPolarHBondContact CE-OD2 3.39Å; K23-D81 VanDerWaalsContact NZ-CG 3.28Å; K23-D81 IonicContact NZ-OD2 2.62Å; K23-D81 PolarHBondContact NZ-OD2 3.46Å; T25-D81 WeakPolarHBondContact CB-OD1 3.34Å; T25-D81 WeakPolarHBondContact CG2-OD1 3.37Å; T25-D81 PolarHBondContact OG1-OD1 3.08Å; N66-D81 PolarHBondContact O-N 3.39Å
82	V	91.2	Very high	94.8	Very high	39 Å²	39	56.5 Å²	56.5	24%	0.236	27%	0.267	C	S	.	.	S	Bend	trans	-109.5	154.1	177.4	174.3	0	0	0	0	107.3	N66 F84	N66-V82 HydrophobicContact CB-CB 4.49Å; N66-V82 HydrophobicContact CB-CG2 3.63Å; V82-F84 WeakPolarHBondContact O-CB 3.37Å; V82-F84 PolarHBondContact O-N 3.26Å
83	P	91.1	Very high	94.9	Very high	126 Å²	126	51.6 Å²	51.6	82%	0.818	25%	0.245	S	C	*	.			trans	-49.4	110.4	177	-30.2	36.8	0	0	0	112.2
84	F	93.3	Very high	95.3	Very high	20 Å²	20	46.3 Å²	46.3	9%	0.088	22%	0.222	C	C	.	.			trans	-131.8	139.6	-176.1	-168.1	-97.5	0	0	0	108.6	Q26 F28 I54 I67 V78 A80 V82 Y88 L89	Q26-F84 PolarHBondContact OE1-O 2.96Å; F28-F84 AromaticContact CD2-CD1 3.62Å; F28-F84 HydrophobicContact CD2-CD1 3.62Å; F28-F84 HydrophobicContact CD2-CE1 4.08Å; F28-F84 HydrophobicContact CE2-CB 4.38Å; F28-F84 AromaticContact CE2-CD1 3.62Å; F28-F84 HydrophobicContact CE2-CD1 3.62Å; F28-F84 HydrophobicContact CE2-CE1 4.47Å; F28-F84 HydrophobicContact CE2-CG 4.49Å; I54-F84 HydrophobicContact CD1-CE2 4.46Å; I54-F84 HydrophobicContact CD1-CZ 4.17Å; I54-F84 HydrophobicContact CG2-CE2 4.08Å; I67-F84 HydrophobicContact CD1-CD2 3.81Å; I67-F84 HydrophobicContact CD1-CE2 3.85Å; V78-F84 HydrophobicContact CG1-CE1 3.93Å; V78-F84 HydrophobicContact CG1-CZ 4.12Å; A80-F84 HydrophobicContact CB-CB 3.41Å; A80-F84 VanDerWaalsContact CB-CB 3.41Å; A80-F84 HydrophobicContact CB-CD1 4.15Å; A80-F84 HydrophobicContact CB-CD2 4.39Å; A80-F84 HydrophobicContact CB-CG 3.77Å; V82-F84 WeakPolarHBondContact O-CB 3.37Å; V82-F84 PolarHBondContact O-N 3.26Å; F84-Y88 HydrophobicContact CD2-CD1 4.3Å; F84-Y88 AromaticContact CE2-CD1 3.52Å; F84-Y88 HydrophobicContact CE2-CD1 3.52Å; F84-Y88 HydrophobicContact CE2-CE1 4.04Å; F84-Y88 AromaticContact CZ-CD1 3.83Å; F84-Y88 HydrophobicContact CZ-CD1 3.83Å; F84-L89 HydrophobicContact CE1-CD1 3.99Å; F84-L89 HydrophobicContact CE1-CD2 3.79Å; F84-L89 HydrophobicContact CE1-CG 3.63Å; F84-L89 HydrophobicContact CZ-CD2 3.73Å; F84-L89 HydrophobicContact CZ-CG 4.02Å
85	S	93.4	Very high	95.6	Very high	62 Å²	62	48.1 Å²	48.1	43%	0.434	23%	0.226	S	C	.	.			trans	-110.9	136.2	-177.1	70.7	0	0	0	0	110.3	R87 Y88	S85-R87 PolarHBondContact O-N 3.47Å; S85-Y88 VanDerWaalsContact O-CB 3.31Å; S85-Y88 WeakPolarHBondContact O-CB 3.48Å; S85-Y88 PolarHBondContact O-N 3.24Å; S85-Y88 PolarHBondContact OG-N 3.44Å
86	K	95.5	Very high	95.7	Very high	26 Å²	26	44.9 Å²	44.9	11%	0.113	21%	0.214	C	C	.	.	H	α-helix	trans	-50.8	-42.2	168.8	-176.6	174.6	-178.7	-164.5	0	111.4	F28 Y88 L89 K90 D112 K113 T115 Y116	F28-K86 HydrophobicContact CD1-CB 3.74Å; F28-K86 HydrophobicContact CD1-CD 4.42Å; F28-K86 HydrophobicContact CD1-CG 4.14Å; F28-K86 HydrophobicContact CE1-CB 3.64Å; F28-K86 HydrophobicContact CE1-CG 4.47Å; F28-K86 HydrophobicContact CZ-CB 4.36Å; K86-Y88 PolarHBondContact O-N 2.79Å; K86-Y88 VanDerWaalsContact O-N 3.09Å; K86-L89 WeakPolarHBondContact O-CA 2.96Å; K86-L89 WeakPolarHBondContact O-CB 3.49Å; K86-L89 PolarHBondContact O-N 3.19Å; K86-K90 PolarHBondContact O-N 2.99Å; K86-D112 PolarHBondContact NZ-O 3.5Å; K86-K113 WeakPolarHBondContact CD-O 3.29Å; K86-K113 WeakPolarHBondContact CE-O 3.26Å; K86-K113 PolarHBondContact NZ-O 2.83Å; K86-T115 WeakPolarHBondContact CE-O 3.28Å; K86-T115 PolarHBondContact NZ-O 2.88Å; K86-Y116 HydrophobicContact CB-CE2 4.44Å; K86-Y116 HydrophobicContact CD-CD2 4.41Å; K86-Y116 HydrophobicContact CD-CE1 4.49Å; K86-Y116 HydrophobicContact CD-CE2 3.95Å; K86-Y116 VanDerWaalsContact CE-CZ 3.49Å; K86-Y116 HydrophobicContact CG-CD2 3.9Å; K86-Y116 HydrophobicContact CG-CE2 3.22Å; K86-Y116 VanDerWaalsContact O-CE2 3.28Å; K86-Y116 WeakPolarHBondContact O-CE2 3.23Å
87	R	97.3	Very high	95.7	Very high	199 Å²	199	44.9 Å²	44.9	75%	0.751	21%	0.214	S	C	*	.	H	α-helix	trans	-53.3	-33.9	177.1	-174.6	-178	-65.8	-97.6	0.7	113.1	S85 L89 K90 Y91	S85-R87 PolarHBondContact O-N 3.47Å; R87-L89 VanDerWaalsContact C-N 3.34Å; R87-K90 WeakPolarHBondContact O-CB 3.34Å; R87-K90 PolarHBondContact O-N 3.13Å; R87-Y91 PolarHBondContact O-N 2.98Å; R87-Y91 VanDerWaalsContact O-N 3.1Å
88	Y	96.8	Very high	95.7	Very high	50 Å²	50	51.8 Å²	51.8	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-38	177.1	-172.9	-136.8	0	0	0	112	R53 I54 K55 F84 S85 K86 K90 Y91 L92	R53-Y88 PolarHBondContact O-OH 3.34Å; R53-Y88 VanDerWaalsContact O-OH 3.09Å; I54-Y88 HydrophobicContact CG1-CE1 4.41Å; I54-Y88 HydrophobicContact CG2-CE1 4.42Å; K55-Y88 PolarHBondContact N-OH 2.92Å; F84-Y88 HydrophobicContact CD2-CD1 4.3Å; F84-Y88 AromaticContact CE2-CD1 3.52Å; F84-Y88 HydrophobicContact CE2-CD1 3.52Å; F84-Y88 HydrophobicContact CE2-CE1 4.04Å; F84-Y88 AromaticContact CZ-CD1 3.83Å; F84-Y88 HydrophobicContact CZ-CD1 3.83Å; S85-Y88 VanDerWaalsContact O-CB 3.31Å; S85-Y88 WeakPolarHBondContact O-CB 3.48Å; S85-Y88 PolarHBondContact O-N 3.24Å; S85-Y88 PolarHBondContact OG-N 3.44Å; K86-Y88 PolarHBondContact O-N 2.79Å; K86-Y88 VanDerWaalsContact O-N 3.09Å; Y88-K90 VanDerWaalsContact C-N 3.34Å; Y88-K90 PolarHBondContact O-N 2.87Å; Y88-Y91 AromaticContact CD2-CD1 3.98Å; Y88-Y91 HydrophobicContact CD2-CD1 3.98Å; Y88-Y91 AromaticContact CE2-CD1 3.82Å; Y88-Y91 HydrophobicContact CE2-CD1 3.82Å; Y88-Y91 HydrophobicContact CE2-CE1 4.23Å; Y88-Y91 WeakPolarHBondContact O-CB 3.31Å; Y88-Y91 PolarHBondContact O-N 3.2Å; Y88-L92 HydrophobicContact CD1-CD1 4.24Å; Y88-L92 HydrophobicContact CD2-CG 4.4Å; Y88-L92 HydrophobicContact CE1-CD1 3.85Å; Y88-L92 HydrophobicContact CE2-CD1 4.24Å; Y88-L92 HydrophobicContact CE2-CD2 4.21Å; Y88-L92 HydrophobicContact CE2-CG 4.07Å; Y88-L92 WeakPolarHBondContact O-CG 3.4Å; Y88-L92 PolarHBondContact O-N 3.27Å
89	L	96.6	Very high	95.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-41.5	171.6	-66	175.3	0	0	0	111.9	F28 I30 V78 F84 K86 R87 Y91 L92 T93 Y116	F28-L89 HydrophobicContact CB-CD1 3.39Å; F28-L89 HydrophobicContact CD2-CD1 4.4Å; F28-L89 HydrophobicContact CG-CD1 4.04Å; I30-L89 HydrophobicContact CD1-CB 4.29Å; I30-L89 HydrophobicContact CD1-CD1 4.45Å; I30-L89 HydrophobicContact CD1-CD2 4.39Å; V78-L89 HydrophobicContact CB-CD1 4.3Å; V78-L89 HydrophobicContact CB-CD2 4.44Å; V78-L89 HydrophobicContact CG1-CD2 4.45Å; V78-L89 HydrophobicContact CG2-CD1 4.35Å; V78-L89 HydrophobicContact CG2-CD2 3.95Å; F84-L89 HydrophobicContact CE1-CD1 3.99Å; F84-L89 HydrophobicContact CE1-CD2 3.79Å; F84-L89 HydrophobicContact CE1-CG 3.63Å; F84-L89 HydrophobicContact CZ-CD2 3.73Å; F84-L89 HydrophobicContact CZ-CG 4.02Å; K86-L89 WeakPolarHBondContact O-CA 2.96Å; K86-L89 WeakPolarHBondContact O-CB 3.49Å; K86-L89 PolarHBondContact O-N 3.19Å; R87-L89 VanDerWaalsContact C-N 3.34Å; L89-Y91 VanDerWaalsContact C-N 3.27Å; L89-Y91 PolarHBondContact O-N 3.08Å; L89-L92 PolarHBondContact O-N 3.37Å; L89-T93 WeakPolarHBondContact O-CB 3.12Å; L89-T93 VanDerWaalsContact O-CG2 3.23Å; L89-T93 WeakPolarHBondContact O-CG2 3.33Å; L89-T93 PolarHBondContact O-N 2.88Å; L89-T93 PolarHBondContact O-OG1 2.84Å; L89-T93 VanDerWaalsContact O-OG1 3.08Å; L89-Y116 HydrophobicContact CB-CD2 4.46Å; L89-Y116 HydrophobicContact CB-CE2 4.43Å
90	K	97.5	Very high	95.7	Very high	74 Å²	74	61 Å²	61	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-38.1	175	-173.6	173.5	-176.5	172.2	0	112.7	K86 R87 Y88 T93 K94 V108 Y116	K86-K90 PolarHBondContact O-N 2.99Å; R87-K90 WeakPolarHBondContact O-CB 3.34Å; R87-K90 PolarHBondContact O-N 3.13Å; Y88-K90 VanDerWaalsContact C-N 3.34Å; Y88-K90 PolarHBondContact O-N 2.87Å; K90-T93 WeakPolarHBondContact CA-OG1 3.49Å; K90-T93 PolarHBondContact O-OG1 3.01Å; K90-K94 WeakPolarHBondContact O-CB 3.19Å; K90-K94 WeakPolarHBondContact O-CG 3.39Å; K90-K94 PolarHBondContact O-N 2.76Å; K90-V108 HydrophobicContact CG-CB 4.44Å; K90-V108 HydrophobicContact CG-CG1 4.13Å; K90-Y116 HydrophobicContact CB-CE1 4.39Å; K90-Y116 HydrophobicContact CB-CE2 3.71Å; K90-Y116 HydrophobicContact CD-CE1 4.19Å
91	Y	98	Very high	95.7	Very high	123 Å²	123	63.8 Å²	63.8	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-65.2	-48.6	175.5	163	-97.2	0	0	0	110.9	R87 Y88 L89 K94 K95	R87-Y91 PolarHBondContact O-N 2.98Å; R87-Y91 VanDerWaalsContact O-N 3.1Å; Y88-Y91 AromaticContact CD2-CD1 3.98Å; Y88-Y91 HydrophobicContact CD2-CD1 3.98Å; Y88-Y91 AromaticContact CE2-CD1 3.82Å; Y88-Y91 HydrophobicContact CE2-CD1 3.82Å; Y88-Y91 HydrophobicContact CE2-CE1 4.23Å; Y88-Y91 WeakPolarHBondContact O-CB 3.31Å; Y88-Y91 PolarHBondContact O-N 3.2Å; L89-Y91 VanDerWaalsContact C-N 3.27Å; L89-Y91 PolarHBondContact O-N 3.08Å; Y91-K94 PolarHBondContact O-N 2.83Å; Y91-K95 HydrophobicContact CE1-CD 4.25Å; Y91-K95 WeakPolarHBondContact O-CB 3.36Å; Y91-K95 PolarHBondContact O-N 3.34Å; Y91-K95 PolarHBondContact OH-NZ 3.08Å
92	L	97.6	Very high	95.9	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-42.7	-178.8	-68.6	176.8	0	0	0	112.4	F49 L50 R53 I54 Y88 L89 K94 K95 Y96	F49-L92 HydrophobicContact CE1-CB 4.48Å; F49-L92 WeakPolarHBondContact CE1-O 3.4Å; L50-L92 HydrophobicContact CD2-CB 3.77Å; L50-L92 HydrophobicContact CD2-CD1 4.01Å; R53-L92 HydrophobicContact CB-CD2 3.86Å; I54-L92 HydrophobicContact CB-CD1 4.49Å; I54-L92 HydrophobicContact CD1-CD1 4.4Å; I54-L92 HydrophobicContact CG1-CD1 3.43Å; I54-L92 VanDerWaalsContact CG1-CD1 3.43Å; Y88-L92 HydrophobicContact CD1-CD1 4.24Å; Y88-L92 HydrophobicContact CD2-CG 4.4Å; Y88-L92 HydrophobicContact CE1-CD1 3.85Å; Y88-L92 HydrophobicContact CE2-CD1 4.24Å; Y88-L92 HydrophobicContact CE2-CD2 4.21Å; Y88-L92 HydrophobicContact CE2-CG 4.07Å; Y88-L92 WeakPolarHBondContact O-CG 3.4Å; Y88-L92 PolarHBondContact O-N 3.27Å; L89-L92 PolarHBondContact O-N 3.37Å; L92-K94 PolarHBondContact O-N 3.48Å; L92-K95 WeakPolarHBondContact O-CB 3.1Å; L92-K95 PolarHBondContact O-N 2.98Å; L92-Y96 PolarHBondContact O-N 2.92Å
93	T	97.1	Very high	96	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-47.9	175.7	55	0	0	0	0	110.9	I30 F46 L89 K90 K95 Y96 L97 V108	I30-T93 HydrophobicContact CD1-CG2 3.63Å; I30-T93 HydrophobicContact CG1-CG2 4.42Å; I30-T93 HydrophobicContact CG2-CG2 4.33Å; F46-T93 HydrophobicContact CE1-CG2 4.25Å; F46-T93 HydrophobicContact CE2-CG2 4.23Å; F46-T93 HydrophobicContact CZ-CG2 3.45Å; F46-T93 VanDerWaalsContact CZ-CG2 3.45Å; L89-T93 WeakPolarHBondContact O-CB 3.12Å; L89-T93 VanDerWaalsContact O-CG2 3.23Å; L89-T93 WeakPolarHBondContact O-CG2 3.33Å; L89-T93 PolarHBondContact O-N 2.88Å; L89-T93 PolarHBondContact O-OG1 2.84Å; L89-T93 VanDerWaalsContact O-OG1 3.08Å; K90-T93 WeakPolarHBondContact CA-OG1 3.49Å; K90-T93 PolarHBondContact O-OG1 3.01Å; T93-K95 VanDerWaalsContact C-N 3.29Å; T93-K95 PolarHBondContact O-N 3.32Å; T93-Y96 WeakPolarHBondContact O-CB 3.27Å; T93-Y96 PolarHBondContact O-N 3.33Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.89Å; T93-V108 WeakPolarHBondContact OG1-CG2 3.22Å
94	K	97.5	Very high	96	Very high	77 Å²	77	64.3 Å²	64.3	34%	0.335	30%	0.295	S	S	.	.	H	α-helix	trans	-60.4	-38.3	175.6	-77.8	-174.9	172.6	-166.6	0	112.7	K90 Y91 L92 L97 K98 V108	K90-K94 WeakPolarHBondContact O-CB 3.19Å; K90-K94 WeakPolarHBondContact O-CG 3.39Å; K90-K94 PolarHBondContact O-N 2.76Å; Y91-K94 PolarHBondContact O-N 2.83Å; L92-K94 PolarHBondContact O-N 3.48Å; K94-L97 PolarHBondContact O-N 3.04Å; K94-K98 PolarHBondContact O-N 3.34Å; K94-V108 HydrophobicContact CG-CG2 4.05Å
95	K	97.9	Very high	95.9	Very high	74 Å²	74	69.9 Å²	69.9	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-42.3	177	-170.1	176.5	-172.2	169.9	0	111.4	F49 Y91 L92 T93 K98 K99	F49-K95 HydrophobicContact CZ-CB 4.2Å; F49-K95 HydrophobicContact CZ-CD 4.29Å; F49-K95 HydrophobicContact CZ-CG 4.1Å; Y91-K95 HydrophobicContact CE1-CD 4.25Å; Y91-K95 WeakPolarHBondContact O-CB 3.36Å; Y91-K95 PolarHBondContact O-N 3.34Å; Y91-K95 PolarHBondContact OH-NZ 3.08Å; L92-K95 WeakPolarHBondContact O-CB 3.1Å; L92-K95 PolarHBondContact O-N 2.98Å; T93-K95 VanDerWaalsContact C-N 3.29Å; T93-K95 PolarHBondContact O-N 3.32Å; K95-K98 PolarHBondContact O-N 3.05Å; K95-K99 PolarHBondContact O-N 2.6Å; K95-K99 VanDerWaalsContact O-N 3.08Å
96	Y	97.5	Very high	96	Very high	4 Å²	4	66.9 Å²	66.9	2%	0.016	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-49.8	173.6	178.5	-105.1	0	0	0	111.8	M41 N42 D45 F46 F49 L92 T93 K98 K99 Q100	M41-Y96 HydrophobicContact CE-CD1 4.35Å; M41-Y96 HydrophobicContact CE-CE1 4.03Å; M41-Y96 HydrophobicContact CG-CE1 4.13Å; M41-Y96 HydrophobicContact SD-CE1 4.15Å; N42-Y96 PolarHBondContact O-OH 3.07Å; D45-Y96 VanDerWaalsContact OD2-CE2 3.28Å; D45-Y96 WeakPolarHBondContact OD2-CE2 3.25Å; D45-Y96 PolarHBondContact OD2-OH 3.14Å; F46-Y96 HydrophobicContact CB-CD1 4.28Å; F46-Y96 HydrophobicContact CB-CE1 3.72Å; F46-Y96 HydrophobicContact CB-CE2 4.21Å; F46-Y96 AromaticContact CD2-CD1 3.34Å; F46-Y96 HydrophobicContact CD2-CD1 3.34Å; F46-Y96 AromaticContact CD2-CD2 3.85Å; F46-Y96 HydrophobicContact CD2-CD2 3.85Å; F46-Y96 AromaticContact CD2-CE1 3.71Å; F46-Y96 HydrophobicContact CD2-CE1 3.71Å; F46-Y96 HydrophobicContact CD2-CE2 4.17Å; F46-Y96 AromaticContact CD2-CG 3.4Å; F46-Y96 HydrophobicContact CD2-CG 3.4Å; F46-Y96 VanDerWaalsContact CD2-CG 3.4Å; F46-Y96 AromaticContact CE2-CD1 3.97Å; F46-Y96 HydrophobicContact CE2-CD1 3.97Å; F46-Y96 AromaticContact CE2-CG 3.93Å; F46-Y96 HydrophobicContact CE2-CG 3.93Å; F46-Y96 AromaticContact CG-CD1 3.95Å; F46-Y96 HydrophobicContact CG-CD1 3.95Å; F46-Y96 AromaticContact CG-CE1 3.88Å; F46-Y96 HydrophobicContact CG-CE1 3.88Å; F46-Y96 HydrophobicContact CG-CG 4.38Å; F46-Y96 PolarHBondContact N-OH 3.07Å; F49-Y96 HydrophobicContact CB-CD2 3.79Å; F49-Y96 HydrophobicContact CB-CE2 4.11Å; F49-Y96 AromaticContact CD1-CD2 3.9Å; F49-Y96 HydrophobicContact CD1-CD2 3.9Å; F49-Y96 HydrophobicContact CD1-CG 4.21Å; F49-Y96 AromaticContact CD2-CD2 3.86Å; F49-Y96 HydrophobicContact CD2-CD2 3.86Å; F49-Y96 HydrophobicContact CE1-CD2 4.46Å; F49-Y96 HydrophobicContact CE2-CD2 4.39Å; F49-Y96 AromaticContact CG-CD2 3.57Å; F49-Y96 HydrophobicContact CG-CD2 3.57Å; F49-Y96 HydrophobicContact CG-CE2 4.36Å; F49-Y96 HydrophobicContact CG-CG 4.33Å; L92-Y96 PolarHBondContact O-N 2.92Å; T93-Y96 WeakPolarHBondContact O-CB 3.27Å; T93-Y96 PolarHBondContact O-N 3.33Å; Y96-K98 PolarHBondContact O-N 3.43Å; Y96-K99 WeakPolarHBondContact O-CA 3.4Å; Y96-K99 WeakPolarHBondContact O-CB 3.3Å; Y96-K99 PolarHBondContact O-N 3.31Å; Y96-Q100 HydrophobicContact CD2-CG 4.35Å; Y96-Q100 HydrophobicContact CE1-CG 4.1Å; Y96-Q100 HydrophobicContact CE2-CG 3.89Å; Y96-Q100 PolarHBondContact O-N 3.25Å
97	L	96.5	Very high	96	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-57	-38.3	177.2	-68.4	175.8	0	0	0	111.8	M41 T93 K94 A101 L102 R103 L106 V108 L118	M41-L97 HydrophobicContact CE-CD2 3.39Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.89Å; K94-L97 PolarHBondContact O-N 3.04Å; L97-A101 CarbonylContact O-C 3.57Å; L97-A101 PolarHBondContact O-N 3.15Å; L97-A101 VanDerWaalsContact O-N 3.13Å; L97-L102 HydrophobicContact CB-CB 4.4Å; L97-L102 HydrophobicContact CD2-CB 3.7Å; L97-L102 HydrophobicContact CD2-CD1 4.01Å; L97-L102 PolarHBondContact O-N 2.82Å; L97-R103 HydrophobicContact CB-CG 4.01Å; L97-L106 HydrophobicContact CD1-CB 4.32Å; L97-L106 HydrophobicContact CD2-CB 4.27Å; L97-L106 HydrophobicContact CD2-CD1 3.87Å; L97-V108 HydrophobicContact CD1-CG2 3.85Å; L97-L118 HydrophobicContact CD1-CD2 4.2Å
98	K	96.8	Very high	95.9	Very high	150 Å²	150	60.6 Å²	60.6	65%	0.652	27%	0.271	S	S	*	.	H	α-helix	trans	-68.9	-37.9	175.6	-176	58.3	179.1	174.8	0	112.2	K94 K95 Y96 Q100 A101 R103	K94-K98 PolarHBondContact O-N 3.34Å; K95-K98 PolarHBondContact O-N 3.05Å; Y96-K98 PolarHBondContact O-N 3.43Å; K98-Q100 VanDerWaalsContact C-N 3.33Å; K98-A101 PolarHBondContact O-N 2.76Å; K98-R103 HydrophobicContact CB-CG 3.98Å; K98-R103 HydrophobicContact CD-CG 4.28Å
99	K	96.2	Very high	95.9	Very high	134 Å²	134	60.3 Å²	60.3	58%	0.583	27%	0.274	S	S	*	.	H	α-helix	trans	-62.3	-41	176.5	-173.9	-170.6	173.8	-161.3	0	111.4	F49 K95 Y96 A101	F49-K99 HydrophobicContact CE2-CD 4.35Å; K95-K99 PolarHBondContact O-N 2.6Å; K95-K99 VanDerWaalsContact O-N 3.08Å; Y96-K99 WeakPolarHBondContact O-CA 3.4Å; Y96-K99 WeakPolarHBondContact O-CB 3.3Å; Y96-K99 PolarHBondContact O-N 3.31Å; K99-A101 VanDerWaalsContact C-N 3.3Å
100	Q	95.7	Very high	95.9	Very high	78 Å²	78	63.1 Å²	63.1	36%	0.364	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	9.9	178.8	-58.6	-60.7	-6.1	0	0	113.5	D45 Y96 K98 L102	D45-Q100 PolarHBondContact OD2-NE2 3.3Å; Y96-Q100 HydrophobicContact CD2-CG 4.35Å; Y96-Q100 HydrophobicContact CE1-CG 4.1Å; Y96-Q100 HydrophobicContact CE2-CG 3.89Å; Y96-Q100 PolarHBondContact O-N 3.25Å; K98-Q100 VanDerWaalsContact C-N 3.33Å; Q100-L102 HydrophobicContact CB-CD1 4Å; Q100-L102 HydrophobicContact CB-CG 3.97Å; Q100-L102 PolarHBondContact O-N 3.13Å; Q100-L102 VanDerWaalsContact O-N 3.08Å
101	A	94.9	Very high	95.8	Very high	59 Å²	59	64 Å²	64	49%	0.488	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	20.8	-175.8	0	0	0	0	0	115.8	L97 K98 K99 R103 W105	L97-A101 CarbonylContact O-C 3.57Å; L97-A101 PolarHBondContact O-N 3.15Å; L97-A101 VanDerWaalsContact O-N 3.13Å; K98-A101 PolarHBondContact O-N 2.76Å; K99-A101 VanDerWaalsContact C-N 3.3Å; A101-R103 VanDerWaalsContact C-N 3.29Å; A101-R103 PolarHBondContact O-N 3.49Å; A101-W105 WeakPolarHBondContact O-CZ3 3.35Å
102	L	94.8	Very high	95.7	Very high	11 Å²	11	63 Å²	63	6%	0.058	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	7.5	-177.7	-64.3	174.9	0	0	0	114.7	I40 M41 L97 Q100 D104 W105 L106	I40-L102 HydrophobicContact CB-CD2 4.38Å; I40-L102 HydrophobicContact CD1-CD2 4.44Å; M41-L102 HydrophobicContact CB-CD1 4.29Å; M41-L102 HydrophobicContact CE-CD1 3.89Å; L97-L102 HydrophobicContact CB-CB 4.4Å; L97-L102 HydrophobicContact CD2-CB 3.7Å; L97-L102 HydrophobicContact CD2-CD1 4.01Å; L97-L102 PolarHBondContact O-N 2.82Å; Q100-L102 HydrophobicContact CB-CD1 4Å; Q100-L102 HydrophobicContact CB-CG 3.97Å; Q100-L102 PolarHBondContact O-N 3.13Å; Q100-L102 VanDerWaalsContact O-N 3.08Å; L102-D104 PolarHBondContact O-N 2.99Å; L102-W105 HydrophobicContact CB-CE3 4.47Å; L102-W105 HydrophobicContact CD2-CE3 3.76Å; L102-W105 HydrophobicContact CD2-CZ3 3.86Å; L102-L106 HydrophobicContact CB-CD1 4.26Å; L102-L106 HydrophobicContact CD1-CD1 4.34Å; L102-L106 PolarHBondContact O-N 3.31Å; L102-L106 VanDerWaalsContact O-N 3.07Å
103	R	93.2	Very high	95.6	Very high	86 Å²	86	71.5 Å²	71.5	33%	0.325	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-17.7	-172.4	-77.2	-77	-78.4	129	5.2	113.9	L97 K98 A101 F121	L97-R103 HydrophobicContact CB-CG 4.01Å; K98-R103 HydrophobicContact CB-CG 3.98Å; K98-R103 HydrophobicContact CD-CG 4.28Å; A101-R103 VanDerWaalsContact C-N 3.29Å; A101-R103 PolarHBondContact O-N 3.49Å; R103-F121 WeakPolarHBondContact O-CE2 3.45Å
104	D	91.2	Very high	95.5	Very high	119 Å²	119	74.6 Å²	74.6	64%	0.636	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-26.2	-175.8	-57.1	-17.7	0	0	0	110.9	L102 F121	L102-D104 PolarHBondContact O-N 2.99Å; D104-F121 WeakPolarHBondContact O-CD2 3.3Å; D104-F121 WeakPolarHBondContact O-CE2 3.37Å
105	W	92.1	Very high	95.5	Very high	136 Å²	136	71.3 Å²	71.3	52%	0.515	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-35.7	177.6	-52.1	-67.3	0	0	0	112.6	A101 L102 Y120 F121	A101-W105 WeakPolarHBondContact O-CZ3 3.35Å; L102-W105 HydrophobicContact CB-CE3 4.47Å; L102-W105 HydrophobicContact CD2-CE3 3.76Å; L102-W105 HydrophobicContact CD2-CZ3 3.86Å; W105-Y120 HydrophobicContact CB-CD1 4.15Å; W105-Y120 HydrophobicContact CB-CE1 4.13Å; W105-Y120 CarbonylContact O-C 3.59Å; W105-Y120 VanDerWaalsContact O-CA 3.26Å; W105-Y120 WeakPolarHBondContact O-CA 3.37Å; W105-Y120 WeakPolarHBondContact O-CD1 3.46Å; W105-F121 VanDerWaalsContact C-CD2 3.49Å; W105-F121 VanDerWaalsContact O-CD2 3.29Å; W105-F121 WeakPolarHBondContact O-CD2 3.49Å; W105-F121 PolarHBondContact O-N 3.2Å
106	L	94.9	Very high	95.5	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.1	-168.9	-60.2	175.4	0	0	0	114	P35 I40 M41 L97 L102 Y120	P35-L106 HydrophobicContact CB-CD1 3.69Å; P35-L106 HydrophobicContact CB-CD2 4.26Å; P35-L106 HydrophobicContact CG-CD1 4.21Å; I40-L106 HydrophobicContact CD1-CD1 3.94Å; I40-L106 HydrophobicContact CD1-CD2 4.32Å; I40-L106 HydrophobicContact CD1-CG 4.26Å; M41-L106 HydrophobicContact CE-CD1 4.04Å; L97-L106 HydrophobicContact CD1-CB 4.32Å; L97-L106 HydrophobicContact CD2-CB 4.27Å; L97-L106 HydrophobicContact CD2-CD1 3.87Å; L102-L106 HydrophobicContact CB-CD1 4.26Å; L102-L106 HydrophobicContact CD1-CD1 4.34Å; L102-L106 PolarHBondContact O-N 3.31Å; L102-L106 VanDerWaalsContact O-N 3.07Å; L106-Y120 HydrophobicContact CD2-CD1 3.74Å; L106-Y120 HydrophobicContact CD2-CE1 3.67Å; L106-Y120 HydrophobicContact CD2-CE2 4.46Å; L106-Y120 HydrophobicContact CD2-CG 4.17Å
107	R	94.8	Very high	95.4	Very high	82 Å²	82	70.1 Å²	70.1	31%	0.309	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.5	168.8	57.9	174.1	-177.8	-172.4	1.4	111.9	V109 R119 F121	R107-V109 HydrophobicContact CG-CG2 3.91Å; R107-R119 HydrophobicContact CG-CB 4.29Å; R107-R119 VanDerWaalsContact CG-O 3.25Å; R107-R119 WeakPolarHBondContact CG-O 3.09Å; R107-R119 PolarHBondContact N-O 3.17Å; R107-R119 PolarHBondContact O-N 3.07Å; R107-F121 HydrophobicContact CB-CE1 3.99Å; R107-F121 HydrophobicContact CB-CE2 4.37Å; R107-F121 HydrophobicContact CB-CZ 3.85Å; R107-F121 HydrophobicContact CG-CD1 4.48Å; R107-F121 HydrophobicContact CG-CE1 4.28Å; R107-F121 HydrophobicContact CG-CZ 4.5Å
108	V	96.8	Very high	95.4	Very high	10 Å²	10	70.2 Å²	70.2	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	111.7	175.7	-172.5	0	0	0	0	109.2	K90 T93 K94 L97 Y116 L118	K90-V108 HydrophobicContact CG-CB 4.44Å; K90-V108 HydrophobicContact CG-CG1 4.13Å; T93-V108 WeakPolarHBondContact OG1-CG2 3.22Å; K94-V108 HydrophobicContact CG-CG2 4.05Å; L97-V108 HydrophobicContact CD1-CG2 3.85Å; V108-Y116 HydrophobicContact CG1-CD1 3.98Å; V108-Y116 HydrophobicContact CG1-CG 3.98Å; V108-L118 HydrophobicContact CB-CD2 4.37Å; V108-L118 HydrophobicContact CG2-CD2 3.7Å
109	V	96.3	Very high	95.3	Very high	44 Å²	44	67.8 Å²	67.8	27%	0.267	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142.2	-176.7	-176.5	0	0	0	0	109.6	R107 Y116 E117 R119	R107-V109 HydrophobicContact CG-CG2 3.91Å; V109-Y116 CarbonylContact O-C 3.57Å; V109-Y116 WeakPolarHBondContact O-CA 3.25Å; V109-Y116 WeakPolarHBondContact O-CD1 3.17Å; V109-E117 PolarHBondContact N-O 2.91Å; V109-E117 PolarHBondContact O-N 3.05Å; V109-R119 HydrophobicContact CB-CG 4.45Å; V109-R119 HydrophobicContact CG2-CB 4.28Å; V109-R119 HydrophobicContact CG2-CG 4.34Å
110	A	97.2	Very high	95.2	Very high	59 Å²	59	65.1 Å²	65.1	49%	0.488	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.1	173.1	0	0	0	0	0	109	Y116	A110-Y116 HydrophobicContact CB-CD1 4.06Å; A110-Y116 HydrophobicContact CB-CE1 3.9Å
111	L	95.6	Very high	94.9	Very high	94 Å²	94	65.3 Å²	65.3	49%	0.492	32%	0.317	S	S	.	.			trans	-84.8	-63.4	172	-177.8	67	0	0	0	109	T115 E117	L111-T115 HydrophobicContact CB-CG2 4.23Å; L111-T115 HydrophobicContact CD2-CG2 4.13Å; L111-T115 PolarHBondContact N-O 2.73Å; L111-E117 HydrophobicContact CB-CB 4.42Å
112	D	95.2	Very high	94.3	Very high	102 Å²	102	69.7 Å²	69.7	55%	0.545	33%	0.328	S	S	.	.	S	Bend	trans	-116.9	-174.8	178	-65.3	-48.7	0	0	0	111.8	K86 D114 T115	K86-D112 PolarHBondContact NZ-O 3.5Å; D112-D114 VanDerWaalsContact C-N 3.26Å; D112-D114 PolarHBondContact O-N 2.96Å; D112-T115 PolarHBondContact N-O 2.81Å
113	K	94.8	Very high	93.2	Very high	179 Å²	179	76.1 Å²	76.1	78%	0.778	36%	0.36	S	S	*	.	S	Bend	trans	-54.1	-43.3	172.2	-171.6	-178.5	176.6	-171.4	0	112.1	K86	K86-K113 WeakPolarHBondContact CD-O 3.29Å; K86-K113 WeakPolarHBondContact CE-O 3.26Å; K86-K113 PolarHBondContact NZ-O 2.83Å
114	D	95.6	Very high	91.8	Very high	68 Å²	68	76.4 Å²	76.4	36%	0.364	38%	0.376	S	S	.	.	S	Bend	trans	-107.2	-5.8	-172.5	-59.5	-36.5	0	0	0	114.1	F28 F29 D112	F28-D114 WeakPolarHBondContact CA-O 3.31Å; F28-D114 HydrophobicContact CD1-CB 4.28Å; F29-D114 PolarHBondContact N-O 2.62Å; D112-D114 VanDerWaalsContact C-N 3.26Å; D112-D114 PolarHBondContact O-N 2.96Å
115	T	97.3	Very high	90.1	Very high	8 Å²	8	74 Å²	74	5%	0.049	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.4	-173	-50.1	0	0	0	0	112.5	F29 E31 K86 L111 D112	F29-T115 HydrophobicContact CB-CG2 4Å; F29-T115 CarbonylContact O-C 3.54Å; F29-T115 WeakPolarHBondContact O-CA 3.45Å; E31-T115 HydrophobicContact CG-CG2 3.98Å; K86-T115 WeakPolarHBondContact CE-O 3.28Å; K86-T115 PolarHBondContact NZ-O 2.88Å; L111-T115 HydrophobicContact CB-CG2 4.23Å; L111-T115 HydrophobicContact CD2-CG2 4.13Å; L111-T115 PolarHBondContact N-O 2.73Å; D112-T115 PolarHBondContact N-O 2.81Å
116	Y	98	Very high	88.3	Confident	21 Å²	21	73.9 Å²	73.9	8%	0.082	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	156.8	162.3	-75.3	-59	0	0	0	110.5	F29 I30 E31 K86 L89 K90 V108 V109 A110	F29-Y116 PolarHBondContact O-N 3.11Å; I30-Y116 CarbonylContact C-O 3.58Å; I30-Y116 WeakPolarHBondContact CA-O 3.12Å; E31-Y116 PolarHBondContact N-O 2.99Å; K86-Y116 HydrophobicContact CB-CE2 4.44Å; K86-Y116 HydrophobicContact CD-CD2 4.41Å; K86-Y116 HydrophobicContact CD-CE1 4.49Å; K86-Y116 HydrophobicContact CD-CE2 3.95Å; K86-Y116 VanDerWaalsContact CE-CZ 3.49Å; K86-Y116 HydrophobicContact CG-CD2 3.9Å; K86-Y116 HydrophobicContact CG-CE2 3.22Å; K86-Y116 VanDerWaalsContact O-CE2 3.28Å; K86-Y116 WeakPolarHBondContact O-CE2 3.23Å; L89-Y116 HydrophobicContact CB-CD2 4.46Å; L89-Y116 HydrophobicContact CB-CE2 4.43Å; K90-Y116 HydrophobicContact CB-CE1 4.39Å; K90-Y116 HydrophobicContact CB-CE2 3.71Å; K90-Y116 HydrophobicContact CD-CE1 4.19Å; V108-Y116 HydrophobicContact CG1-CD1 3.98Å; V108-Y116 HydrophobicContact CG1-CG 3.98Å; V109-Y116 CarbonylContact O-C 3.57Å; V109-Y116 WeakPolarHBondContact O-CA 3.25Å; V109-Y116 WeakPolarHBondContact O-CD1 3.17Å; A110-Y116 HydrophobicContact CB-CD1 4.06Å; A110-Y116 HydrophobicContact CB-CE1 3.9Å
117	E	96.4	Very high	86.3	Confident	32 Å²	32	83.1 Å²	83.1	15%	0.15	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	142.2	174.3	-171.4	-167.2	160.4	0	0	109	E31 H34 V109 L111 R119	E31-E117 HydrophobicContact CB-CB 4.44Å; E31-E117 HydrophobicContact CB-CG 4.26Å; H34-E117 IonicContact CD2-OE1 3.92Å; H34-E117 IonicContact NE2-OE1 3.76Å; V109-E117 PolarHBondContact N-O 2.91Å; V109-E117 PolarHBondContact O-N 3.05Å; L111-E117 HydrophobicContact CB-CB 4.42Å; E117-R119 HydrophobicContact CB-CG 4.46Å; E117-R119 HydrophobicContact CG-CG 4Å; E117-R119 WeakPolarHBondContact OE1-CG 3.44Å
118	L	95.8	Very high	84.3	Confident	3 Å²	3	84.5 Å²	84.5	2%	0.016	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	114.1	168.4	-62.4	-176.8	0	0	0	109.3	E31 C32 P35 M41 L97 V108	E31-L118 PolarHBondContact O-N 2.57Å; C32-L118 HydrophobicContact CB-CD1 4.18Å; P35-L118 HydrophobicContact CG-CB 4.1Å; P35-L118 HydrophobicContact CG-CD1 3.91Å; M41-L118 HydrophobicContact CE-CD1 3.42Å; M41-L118 VanDerWaalsContact CE-CD1 3.42Å; M41-L118 HydrophobicContact SD-CD1 3.74Å; L97-L118 HydrophobicContact CD1-CD2 4.2Å; V108-L118 HydrophobicContact CB-CD2 4.37Å; V108-L118 HydrophobicContact CG2-CD2 3.7Å
119	R	94	Very high	82.1	Confident	99 Å²	99	87.4 Å²	87.4	37%	0.374	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	145	-179.7	-64.2	-171.9	67	-171	0.7	110.7	R107 V109 E117	R107-R119 HydrophobicContact CG-CB 4.29Å; R107-R119 VanDerWaalsContact CG-O 3.25Å; R107-R119 WeakPolarHBondContact CG-O 3.09Å; R107-R119 PolarHBondContact N-O 3.17Å; R107-R119 PolarHBondContact O-N 3.07Å; V109-R119 HydrophobicContact CB-CG 4.45Å; V109-R119 HydrophobicContact CG2-CB 4.28Å; V109-R119 HydrophobicContact CG2-CG 4.34Å; E117-R119 HydrophobicContact CB-CG 4.46Å; E117-R119 HydrophobicContact CG-CG 4Å; E117-R119 WeakPolarHBondContact OE1-CG 3.44Å
120	Y	93.9	Very high	80	Confident	77 Å²	77	91.3 Å²	91.3	30%	0.302	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	154.1	168.1	-73.8	-75	0	0	0	111.6	H34 D38 I40 W105 L106	H34-Y120 HydrophobicContact CB-CE2 4.1Å; D38-Y120 VanDerWaalsContact OD2-CE2 3.28Å; D38-Y120 WeakPolarHBondContact OD2-CE2 3.28Å; D38-Y120 VanDerWaalsContact OD2-CZ 3.3Å; D38-Y120 PolarHBondContact OD2-OH 3.42Å; I40-Y120 HydrophobicContact CD1-CE1 3.94Å; I40-Y120 WeakPolarHBondContact CD1-OH 3.25Å; W105-Y120 HydrophobicContact CB-CD1 4.15Å; W105-Y120 HydrophobicContact CB-CE1 4.13Å; W105-Y120 CarbonylContact O-C 3.59Å; W105-Y120 VanDerWaalsContact O-CA 3.26Å; W105-Y120 WeakPolarHBondContact O-CA 3.37Å; W105-Y120 WeakPolarHBondContact O-CD1 3.46Å; L106-Y120 HydrophobicContact CD2-CD1 3.74Å; L106-Y120 HydrophobicContact CD2-CE1 3.67Å; L106-Y120 HydrophobicContact CD2-CE2 4.46Å; L106-Y120 HydrophobicContact CD2-CG 4.17Å
121	F	90.6	Very high	77.7	Confident	82 Å²	82	94 Å²	94	36%	0.36	53%	0.525	S	S	.	.			trans	-68.8	137	160.5	-66.7	-79.9	0	0	0	109.3	R103 D104 W105 R107 I123	R103-F121 WeakPolarHBondContact O-CE2 3.45Å; D104-F121 WeakPolarHBondContact O-CD2 3.3Å; D104-F121 WeakPolarHBondContact O-CE2 3.37Å; W105-F121 VanDerWaalsContact C-CD2 3.49Å; W105-F121 VanDerWaalsContact O-CD2 3.29Å; W105-F121 WeakPolarHBondContact O-CD2 3.49Å; W105-F121 PolarHBondContact O-N 3.2Å; R107-F121 HydrophobicContact CB-CE1 3.99Å; R107-F121 HydrophobicContact CB-CE2 4.37Å; R107-F121 HydrophobicContact CB-CZ 3.85Å; R107-F121 HydrophobicContact CG-CD1 4.48Å; R107-F121 HydrophobicContact CG-CE1 4.28Å; R107-F121 HydrophobicContact CG-CZ 4.5Å; F121-I123 PolarHBondContact O-N 3.27Å
122	Q	81.9	Confident	75.8	Confident	152 Å²	152	94.2 Å²	94.2	71%	0.71	53%	0.534	S	S	*	.			trans	-81	100.8	165.4	-70.8	168.9	-44.5	0	0	105.7	S124	Q122-S124 VanDerWaalsContact C-N 3.26Å; Q122-S124 PolarHBondContact O-N 3.5Å; Q122-S124 VanDerWaalsContact O-N 3.12Å
123	I	71.4	Confident	73.8	Confident	145 Å²	145	98.5 Å²	98.5	74%	0.744	55%	0.551	S	S	*	*			trans	-81.6	85.8	170.8	-54.5	172.3	0	0	0	105.5	F121 G125	F121-I123 PolarHBondContact O-N 3.27Å; I123-G125 PolarHBondContact O-N 3.04Å
124	S	63.7	Low	72.4	Confident	93 Å²	93	98.2 Å²	98.2	65%	0.65	55%	0.553	S	S	*	*			trans	-64.9	126	154.5	-63.3	0	0	0	0	105.6	Q122 D126	Q122-S124 VanDerWaalsContact C-N 3.26Å; Q122-S124 PolarHBondContact O-N 3.5Å; Q122-S124 VanDerWaalsContact O-N 3.12Å; S124-D126 PolarHBondContact O-N 3.12Å
125	G	55.2	Low	70.7	Confident	69 Å²	69	106.6 Å²	106.6	71%	0.711	60%	0.597	S	S	*	*			trans	-67	40.4	-166.3	0	0	0	0	0	116.7	I123 E127	I123-G125 PolarHBondContact O-N 3.04Å; G125-E127 PolarHBondContact O-N 3.33Å; G125-E127 VanDerWaalsContact O-N 3.11Å
126	D	54.9	Low	69.3	Low	133 Å²	133	111.6 Å²	111.6	71%	0.711	63%	0.625	S	S	*	*			trans	-88.4	82.5	178.3	-64.5	-17.9	0	0	0	109.8	S124 S128	S124-D126 PolarHBondContact O-N 3.12Å; D126-S128 VanDerWaalsContact C-N 3.35Å; D126-S128 PolarHBondContact O-N 2.9Å; D126-S128 PolarHBondContact O-OG 3.11Å
127	E	53.6	Low	67.8	Low	194 Å²	194	116.3 Å²	116.3	91%	0.907	65%	0.653	S	S	*	*			trans	-35.9	94.6	150.6	-172.6	179.8	133.8	0	0	110.7	G125	G125-E127 PolarHBondContact O-N 3.33Å; G125-E127 VanDerWaalsContact O-N 3.11Å
128	S	51.6	Low	66.2	Low	110 Å²	110	121 Å²	121	77%	0.769	68%	0.681	S	S	*	*			trans	-142.4	85.4	176.5	47.5	0	0	0	0	109.3	D126	D126-S128 VanDerWaalsContact C-N 3.35Å; D126-S128 PolarHBondContact O-N 2.9Å; D126-S128 PolarHBondContact O-OG 3.11Å
129	G	52.1	Low	64.5	Low	72 Å²	72	127.9 Å²	127.9	74%	0.742	72%	0.72	S	S	*	*			trans	176.4	15.7	176.8	0	0	0	0	0	118.8
130	V	50.8	Low	62.7	Low	126 Å²	126	129.8 Å²	129.8	76%	0.764	74%	0.742	S	S	*	*			trans	-116.5	77.9	169.9	-165.4	0	0	0	0	109.3	S132	V130-S132 VanDerWaalsContact C-N 3.33Å; V130-S132 PolarHBondContact O-N 2.73Å
131	S	50	Low	60.6	Low	115 Å²	115	133.3 Å²	133.3	80%	0.804	77%	0.772	S	S	*	*			trans	-83.6	84.1	159.8	53.7	0	0	0	0	107.8
132	S	55.2	Low	58.4	Low	98 Å²	98	136.9 Å²	136.9	69%	0.685	80%	0.801	S	S	*	*			trans	-88.4	95.1	161	-70.2	0	0	0	0	107.2	V130	V130-S132 VanDerWaalsContact C-N 3.33Å; V130-S132 PolarHBondContact O-N 2.73Å
133	E	53.3	Low	56.6	Low	192 Å²	192	135.8 Å²	135.8	90%	0.897	81%	0.808	S	S	*	*			trans	-91.6	101.6	159.6	-80.6	172.5	153	0	0	106.8
134	E	64.2	Low	55.4	Low	174 Å²	174	135 Å²	135	81%	0.813	81%	0.813	S	S	*	*			trans	-128.7	130.8	163.3	-72.4	-173.7	148.3	0	0	107.5
135	D	60.1	Low	54.6	Low	244 Å²	244	138.8 Å²	138.8	100%	1.305	83%	0.828	S	S	*	*			trans	79.7	0	179.3	-58.6	-47.6	0	0	0	120

Retrieved 135 of 135 residues in 427.5 ms (Link to these results)

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