A0A077ZNI3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZNI3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 177 aa.

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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	40.6	Very low	51.5	Low	233 Å²	233	125.9 Å²	125.9	100%	1.148	69%	0.693	S	S	*	*				0	121.5	0	-69.9	-161.9	163.5	0	0	108.1	M3	M1-M3 PolarHBondContact O-N 3.31Å
2	P	42.6	Very low	52.3	Low	127 Å²	127	122 Å²	122	83%	0.825	68%	0.678	S	S	*	*			trans	-67.2	121.6	170.8	26.7	-28.5	0	0	0	107.9	L4	P2-L4 PolarHBondContact O-N 2.94Å
3	M	46	Very low	53.1	Low	162 Å²	162	118.9 Å²	118.9	80%	0.798	66%	0.655	S	S	*	*			trans	-62.4	110.1	169	-75.4	-161.5	-160.9	0	0	107.3	M1 F5	M1-M3 PolarHBondContact O-N 3.31Å; M3-F5 VanDerWaalsContact C-N 3.28Å; M3-F5 PolarHBondContact O-N 3.04Å
4	L	45	Very low	53.8	Low	170 Å²	170	117 Å²	117	89%	0.89	65%	0.654	S	S	*	*			trans	-62.8	97.2	162.2	-106.5	130.2	0	0	0	106.1	P2 S6	P2-L4 PolarHBondContact O-N 2.94Å; L4-S6 PolarHBondContact O-N 2.71Å
5	F	45.2	Very low	54.4	Low	156 Å²	156	115.3 Å²	115.3	68%	0.684	64%	0.639	S	S	*	*			trans	-59.5	113.5	163.7	-72	-81.5	0	0	0	106	M3	M3-F5 VanDerWaalsContact C-N 3.28Å; M3-F5 PolarHBondContact O-N 3.04Å
6	S	54	Low	55.2	Low	91 Å²	91	112.8 Å²	112.8	64%	0.636	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-50.4	133.3	166	42.2	0	0	0	0	107.6	L4 D8	L4-S6 PolarHBondContact O-N 2.71Å; S6-D8 PolarHBondContact O-N 2.93Å
7	P	55.2	Low	56.2	Low	118 Å²	118	112.3 Å²	112.3	77%	0.766	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-53.5	119	-179.4	21.2	-31.2	0	0	0	108.1	V9	P7-V9 PolarHBondContact O-N 3.05Å
8	D	59.8	Low	56.9	Low	74 Å²	74	108.9 Å²	108.9	40%	0.396	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-55.3	117.9	176.4	-81.5	-30.1	0	0	0	106.8	S6 V10 P49 A51	S6-D8 PolarHBondContact O-N 2.93Å; D8-V10 PolarHBondContact O-N 2.99Å; D8-P49 HydrophobicContact CB-CB 4.35Å; D8-A51 VanDerWaalsContact OD1-CB 3.24Å; D8-A51 WeakPolarHBondContact OD1-CB 3.42Å
9	V	55.9	Low	57.6	Low	103 Å²	103	108.1 Å²	108.1	62%	0.624	60%	0.597	S	S	*	*			trans	-64.5	110.4	173.8	-179.9	0	0	0	0	106	P7 L50	P7-V9 PolarHBondContact O-N 3.05Å; V9-L50 HydrophobicContact CB-CD1 3.83Å; V9-L50 HydrophobicContact CG1-CD1 3.64Å; V9-L50 WeakPolarHBondContact O-CB 3.35Å; V9-L50 WeakPolarHBondContact O-CG 3.24Å; V9-L50 PolarHBondContact O-N 3.33Å
10	V	60.2	Low	58.2	Low	67 Å²	67	108.7 Å²	108.7	41%	0.406	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	133.8	176.6	-71.3	0	0	0	0	108.8	D8 P12 F47	D8-V10 PolarHBondContact O-N 2.99Å; V10-P12 WeakPolarHBondContact O-CD 3.07Å; V10-F47 HydrophobicContact CB-CB 4.39Å; V10-F47 HydrophobicContact CB-CD1 4.24Å; V10-F47 HydrophobicContact CG1-CB 4.37Å; V10-F47 HydrophobicContact CG2-CD1 4.16Å
11	N	62.7	Low	58.6	Low	84 Å²	84	108.3 Å²	108.3	45%	0.449	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.7	109.5	166.6	-174.9	13.1	0	0	0	108.4	Q13 I48	N11-Q13 PolarHBondContact O-N 3.13Å; N11-I48 PolarHBondContact N-O 2.92Å
12	P	60.8	Low	60.1	Low	79 Å²	79	99.5 Å²	99.5	51%	0.513	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.2	115.5	173.2	29.4	-31.5	0	0	0	109.6	V10 S46 F47	V10-P12 WeakPolarHBondContact O-CD 3.07Å; P12-S46 WeakPolarHBondContact CA-O 3.35Å; P12-F47 HydrophobicContact CB-CD1 4.31Å; P12-F47 HydrophobicContact CB-CE1 4.04Å
13	Q	63.2	Low	61.3	Low	82 Å²	82	97.7 Å²	97.7	38%	0.383	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.6	168.8	-69.7	-174.1	-24.5	0	0	109.2	N11 F45 S46	N11-Q13 PolarHBondContact O-N 3.13Å; Q13-F45 CarbonylContact O-C 3.53Å; Q13-F45 WeakPolarHBondContact O-CA 3.31Å; Q13-S46 PolarHBondContact N-O 2.87Å; Q13-S46 PolarHBondContact O-N 2.85Å
14	S	62.2	Low	62.4	Low	92 Å²	92	95.1 Å²	95.1	64%	0.643	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.7	166.8	54	0	0	0	0	108.8
15	H	63.4	Low	63.6	Low	92 Å²	92	93.2 Å²	93.2	43%	0.426	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-45.8	-178.3	-71.6	-53.9	0	0	0	112.3	A44 S46	H15-A44 HydrophobicContact CB-CB 4.42Å; H15-A44 PolarHBondContact N-O 3.5Å; H15-S46 PolarHBondContact CD2-N 3.15Å; H15-S46 PolarHBondContact CE1-OG 2.74Å; H15-S46 WeakPolarHBondContact NE2-CB 3.38Å; H15-S46 PolarHBondContact NE2-OG 2.87Å
16	T	67.3	Low	64.8	Low	75 Å²	75	90.4 Å²	90.4	46%	0.46	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	133.6	-173.8	-48	0	0	0	0	110.4	L18 T43 A44	T16-L18 HydrophobicContact CG2-CD1 4.45Å; T16-L18 HydrophobicContact CG2-CD2 3.74Å; T16-L18 HydrophobicContact CG2-CG 3.75Å; T16-T43 WeakPolarHBondContact O-CA 3.44Å; T16-A44 PolarHBondContact O-N 2.7Å
17	L	70.8	Confident	65.5	Low	104 Å²	104	89.4 Å²	89.4	55%	0.545	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122	161.7	176.7	63.8	0	0	0	107.8	I19 T42 T43	L17-I19 HydrophobicContact CD1-CG1 4.35Å; L17-I19 HydrophobicContact CD2-CD1 4.19Å; L17-I19 HydrophobicContact CD2-CG1 4.44Å; L17-I19 HydrophobicContact CG-CD1 4.41Å; L17-I19 HydrophobicContact CG-CG1 4.12Å; L17-T42 WeakPolarHBondContact CA-O 3.14Å; L17-T43 VanDerWaalsContact CD1-OG1 3.3Å; L17-T43 WeakPolarHBondContact CD1-OG1 3.03Å
18	L	69.1	Low	65.9	Low	52 Å²	52	86.6 Å²	86.6	27%	0.272	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.7	173.1	-62.4	174.4	0	0	0	109	T16 Y20 M41 T42	T16-L18 HydrophobicContact CG2-CD1 4.45Å; T16-L18 HydrophobicContact CG2-CD2 3.74Å; T16-L18 HydrophobicContact CG2-CG 3.75Å; L18-Y20 HydrophobicContact CB-CD2 4.3Å; L18-Y20 HydrophobicContact CB-CE2 3.64Å; L18-Y20 HydrophobicContact CD1-CE2 4.09Å; L18-Y20 HydrophobicContact CG-CE2 4.36Å; L18-M41 CarbonylContact O-C 3.58Å; L18-M41 WeakPolarHBondContact O-CA 3.45Å; L18-T42 PolarHBondContact N-O 3.34Å; L18-T42 PolarHBondContact O-N 2.99Å
19	I	70.4	Confident	66.5	Low	92 Å²	92	93.9 Å²	93.9	47%	0.472	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.7	176.1	-53.4	179.4	0	0	0	107.3	L17 L39 M41	L17-I19 HydrophobicContact CD1-CG1 4.35Å; L17-I19 HydrophobicContact CD2-CD1 4.19Å; L17-I19 HydrophobicContact CD2-CG1 4.44Å; L17-I19 HydrophobicContact CG-CD1 4.41Å; L17-I19 HydrophobicContact CG-CG1 4.12Å; I19-L39 HydrophobicContact CG2-CD1 3.59Å; I19-M41 HydrophobicContact CG1-CG 4.26Å; I19-M41 HydrophobicContact CG2-CG 4.3Å
20	Y	69	Low	66.9	Low	121 Å²	121	92.1 Å²	92.1	48%	0.475	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	96	175.4	-61.2	-79.4	0	0	0	109.2	L18 N40	L18-Y20 HydrophobicContact CB-CD2 4.3Å; L18-Y20 HydrophobicContact CB-CE2 3.64Å; L18-Y20 HydrophobicContact CD1-CE2 4.09Å; L18-Y20 HydrophobicContact CG-CE2 4.36Å; Y20-N40 PolarHBondContact N-O 3.49Å; Y20-N40 PolarHBondContact O-N 3.44Å
21	P	68.3	Low	67.1	Low	100 Å²	100	93.5 Å²	93.5	65%	0.649	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.7	166	31	-31.2	0	0	0	109	L39	P21-L39 HydrophobicContact CB-CD1 4.27Å
22	A	70.6	Confident	67	Low	49 Å²	49	92.5 Å²	92.5	41%	0.405	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.5	169.7	0	0	0	0	0	109.1	V38	A22-V38 HydrophobicContact CB-CB 4.31Å; A22-V38 PolarHBondContact N-O 3.4Å; A22-V38 PolarHBondContact O-N 3.32Å
23	V	68.2	Low	66.9	Low	88 Å²	88	95.4 Å²	95.4	53%	0.533	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.9	176.6	-176.6	0	0	0	0	107.4	L35 Y36 F37	V23-L35 HydrophobicContact CG1-CD1 3.39Å; V23-L35 HydrophobicContact CG1-CG 4.09Å; V23-Y36 CarbonylContact C-O 3.55Å; V23-Y36 WeakPolarHBondContact CA-O 3.44Å; V23-F37 HydrophobicContact CG1-CE1 4.36Å; V23-F37 HydrophobicContact CG2-CD1 3.76Å; V23-F37 HydrophobicContact CG2-CE1 3.8Å
24	L	69.8	Low	67	Low	109 Å²	109	91.5 Å²	91.5	57%	0.571	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.8	175.6	-174.9	89.6	0	0	0	108.2	Y36	L24-Y36 HydrophobicContact CD2-CD2 4.48Å; L24-Y36 PolarHBondContact N-O 3.19Å; L24-Y36 PolarHBondContact O-N 3.31Å
25	M	69.8	Low	67	Low	129 Å²	129	90 Å²	90	64%	0.635	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.4	170.5	-67.3	-178.8	72.1	0	0	108.7	F33 G34 L35	M25-F33 HydrophobicContact CE-CD1 4.48Å; M25-G34 WeakPolarHBondContact CA-O 3.48Å; M25-L35 HydrophobicContact CG-CD1 3.59Å; M25-L35 HydrophobicContact SD-CD1 4.47Å
26	K	70.3	Confident	67.1	Low	98 Å²	98	87.3 Å²	87.3	43%	0.426	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.1	171.8	-168.8	-173	173	-134.6	0	108.7	D28 F33 G34 Y36	K26-D28 WeakPolarHBondContact CE-OD1 3.48Å; K26-D28 IonicContact NZ-OD1 2.81Å; K26-D28 PolarHBondContact NZ-OD1 2.85Å; K26-F33 CarbonylContact O-C 3.55Å; K26-F33 WeakPolarHBondContact O-CA 3.13Å; K26-G34 PolarHBondContact N-O 3.06Å; K26-G34 PolarHBondContact O-N 3.02Å; K26-Y36 HydrophobicContact CB-CD2 4.24Å; K26-Y36 HydrophobicContact CB-CE2 3.66Å; K26-Y36 HydrophobicContact CD-CE2 4.2Å
27	A	68.2	Low	67	Low	69 Å²	69	88.3 Å²	88.3	57%	0.57	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.9	167.9	0	0	0	0	0	108.7	F33	A27-F33 HydrophobicContact CB-CD1 3.94Å; A27-F33 HydrophobicContact CB-CE1 3.83Å
28	D	64	Low	66.8	Low	60 Å²	60	85.1 Å²	85.1	32%	0.321	47%	0.473	S	S	.	.			trans	-90.2	155.6	168.6	-74.2	-41.5	0	0	0	110	K26 G30 A31 S32	K26-D28 WeakPolarHBondContact CE-OD1 3.48Å; K26-D28 IonicContact NZ-OD1 2.81Å; K26-D28 PolarHBondContact NZ-OD1 2.85Å; D28-G30 PolarHBondContact O-N 2.99Å; D28-A31 PolarHBondContact O-N 2.73Å; D28-S32 PolarHBondContact N-O 2.89Å
29	K	71.9	Confident	66.8	Low	227 Å²	227	85.5 Å²	85.5	99%	0.987	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	3	-170.9	-67	-176	177	-178.8	0	115.6
30	G	63.9	Low	66.6	Low	66 Å²	66	83 Å²	83	68%	0.68	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	23	-174.7	0	0	0	0	0	115.7	D28 S32	D28-G30 PolarHBondContact O-N 2.99Å; G30-S32 VanDerWaalsContact C-N 3.27Å; G30-S32 PolarHBondContact O-N 2.95Å
31	A	65.2	Low	66.5	Low	95 Å²	95	79 Å²	79	79%	0.785	45%	0.449	S	S	*	.	S	Bend	trans	70	11.2	-176.9	0	0	0	0	0	115.9	D28	D28-A31 PolarHBondContact O-N 2.73Å
32	S	60.2	Low	66.3	Low	63 Å²	63	76 Å²	76	44%	0.441	43%	0.429	S	S	.	.			trans	-90.1	137.7	167.2	55.6	0	0	0	0	110.9	D28 G30	D28-S32 PolarHBondContact N-O 2.89Å; G30-S32 VanDerWaalsContact C-N 3.27Å; G30-S32 PolarHBondContact O-N 2.95Å
33	F	59.9	Low	66.1	Low	140 Å²	140	75.5 Å²	75.5	61%	0.614	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.4	169.2	-61.8	-87.1	0	0	0	108.8	M25 K26 A27	M25-F33 HydrophobicContact CE-CD1 4.48Å; K26-F33 CarbonylContact O-C 3.55Å; K26-F33 WeakPolarHBondContact O-CA 3.13Å; A27-F33 HydrophobicContact CB-CD1 3.94Å; A27-F33 HydrophobicContact CB-CE1 3.83Å
34	G	64	Low	65.7	Low	1 Å²	1	72 Å²	72	1%	0.01	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.5	165.7	0	0	0	0	0	109.8	M25 K26	M25-G34 WeakPolarHBondContact CA-O 3.48Å; K26-G34 PolarHBondContact N-O 3.06Å; K26-G34 PolarHBondContact O-N 3.02Å
35	L	62.3	Low	65.5	Low	60 Å²	60	70 Å²	70	31%	0.314	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119.8	173.2	-166.6	68.3	0	0	0	108.8	V23 M25 F37 S68	V23-L35 HydrophobicContact CG1-CD1 3.39Å; V23-L35 HydrophobicContact CG1-CG 4.09Å; M25-L35 HydrophobicContact CG-CD1 3.59Å; M25-L35 HydrophobicContact SD-CD1 4.47Å; L35-F37 HydrophobicContact CD2-CE1 4.37Å; L35-F37 HydrophobicContact CD2-CE2 3.44Å; L35-F37 VanDerWaalsContact CD2-CE2 3.44Å; L35-F37 HydrophobicContact CD2-CZ 3.34Å; L35-F37 HydrophobicContact CG-CD2 4.44Å; L35-F37 HydrophobicContact CG-CE2 3.76Å; L35-F37 HydrophobicContact CG-CZ 3.94Å; L35-S68 PolarHBondContact N-OG 3.43Å; L35-S68 WeakPolarHBondContact O-CB 3.38Å; L35-S68 PolarHBondContact O-N 3.21Å; L35-S68 VanDerWaalsContact O-N 3.14Å; L35-S68 PolarHBondContact O-OG 2.88Å
36	Y	66	Low	65	Low	36 Å²	36	64 Å²	64	14%	0.141	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.5	178.5	-60.4	-95.6	0	0	0	109	V23 L24 K26 A67	V23-Y36 CarbonylContact C-O 3.55Å; V23-Y36 WeakPolarHBondContact CA-O 3.44Å; L24-Y36 HydrophobicContact CD2-CD2 4.48Å; L24-Y36 PolarHBondContact N-O 3.19Å; L24-Y36 PolarHBondContact O-N 3.31Å; K26-Y36 HydrophobicContact CB-CD2 4.24Å; K26-Y36 HydrophobicContact CB-CE2 3.66Å; K26-Y36 HydrophobicContact CD-CE2 4.2Å; Y36-A67 HydrophobicContact CD1-CB 3.53Å; Y36-A67 HydrophobicContact CE1-CB 3.49Å; Y36-A67 VanDerWaalsContact CE1-CB 3.49Å
37	F	65.6	Low	64.6	Low	96 Å²	96	62.4 Å²	62.4	42%	0.421	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.7	173	-65.6	-89.3	0	0	0	108.8	V23 L35 H66	V23-F37 HydrophobicContact CG1-CE1 4.36Å; V23-F37 HydrophobicContact CG2-CD1 3.76Å; V23-F37 HydrophobicContact CG2-CE1 3.8Å; L35-F37 HydrophobicContact CD2-CE1 4.37Å; L35-F37 HydrophobicContact CD2-CE2 3.44Å; L35-F37 VanDerWaalsContact CD2-CE2 3.44Å; L35-F37 HydrophobicContact CD2-CZ 3.34Å; L35-F37 HydrophobicContact CG-CD2 4.44Å; L35-F37 HydrophobicContact CG-CE2 3.76Å; L35-F37 HydrophobicContact CG-CZ 3.94Å; F37-H66 HydrophobicContact CB-CB 4.49Å; F37-H66 PolarHBondContact N-O 2.81Å; F37-H66 PolarHBondContact O-N 3.35Å
38	V	65.8	Low	64.1	Low	36 Å²	36	62 Å²	62	22%	0.218	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.2	171.9	-174.1	0	0	0	0	107.6	A22 I64 L65	A22-V38 HydrophobicContact CB-CB 4.31Å; A22-V38 PolarHBondContact N-O 3.4Å; A22-V38 PolarHBondContact O-N 3.32Å; V38-I64 WeakPolarHBondContact CA-O 3.3Å; V38-L65 HydrophobicContact CG2-CD1 3.65Å
39	L	68.3	Low	63.7	Low	60 Å²	60	60 Å²	60	31%	0.314	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.4	169.2	-171.4	67.7	0	0	0	108.8	I19 P21 M41 I64	I19-L39 HydrophobicContact CG2-CD1 3.59Å; P21-L39 HydrophobicContact CB-CD1 4.27Å; L39-M41 HydrophobicContact CD2-CE 4.12Å; L39-M41 HydrophobicContact CD2-CG 4.18Å; L39-M41 HydrophobicContact CD2-SD 4.1Å; L39-M41 HydrophobicContact CG-CG 4.08Å; L39-I64 HydrophobicContact CB-CB 4.41Å; L39-I64 PolarHBondContact N-O 3.43Å; L39-I64 PolarHBondContact O-N 2.97Å
40	N	66.4	Low	63.1	Low	40 Å²	40	54.9 Å²	54.9	21%	0.214	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	110.4	171.5	-65.9	-53.8	0	0	0	109.2	Y20 R63	Y20-N40 PolarHBondContact N-O 3.49Å; Y20-N40 PolarHBondContact O-N 3.44Å; N40-R63 WeakPolarHBondContact OD1-CD 3.36Å; N40-R63 WeakPolarHBondContact OD1-CG 3.39Å
41	M	68.2	Low	62.8	Low	37 Å²	37	55 Å²	55	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.9	170.8	-64.8	-171.7	-72.1	0	0	109.6	L18 I19 L39 W62 I64	L18-M41 CarbonylContact O-C 3.58Å; L18-M41 WeakPolarHBondContact O-CA 3.45Å; I19-M41 HydrophobicContact CG1-CG 4.26Å; I19-M41 HydrophobicContact CG2-CG 4.3Å; L39-M41 HydrophobicContact CD2-CE 4.12Å; L39-M41 HydrophobicContact CD2-CG 4.18Å; L39-M41 HydrophobicContact CD2-SD 4.1Å; L39-M41 HydrophobicContact CG-CG 4.08Å; M41-W62 HydrophobicContact CE-CD2 3.91Å; M41-W62 HydrophobicContact CE-CE3 3.46Å; M41-W62 VanDerWaalsContact CE-CE3 3.46Å; M41-W62 HydrophobicContact CE-CH2 4.49Å; M41-W62 HydrophobicContact CE-CZ3 3.79Å; M41-W62 PolarHBondContact N-O 2.65Å; M41-W62 CarbonylContact O-C 3.47Å; M41-W62 PolarHBondContact O-N 3.37Å; M41-I64 HydrophobicContact CE-CD1 4.16Å
42	T	64	Low	62.2	Low	37 Å²	37	57.5 Å²	57.5	23%	0.227	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.4	172.9	-53.9	0	0	0	0	109.1	L17 L18 F60	L17-T42 WeakPolarHBondContact CA-O 3.14Å; L18-T42 PolarHBondContact N-O 3.34Å; L18-T42 PolarHBondContact O-N 2.99Å; T42-F60 CarbonylContact C-O 3.56Å; T42-F60 WeakPolarHBondContact CA-O 3.36Å
43	T	65.2	Low	62	Low	39 Å²	39	63.1 Å²	63.1	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.4	177.6	-47.8	0	0	0	0	109.1	T16 L17 F45 F60	T16-T43 WeakPolarHBondContact O-CA 3.44Å; L17-T43 VanDerWaalsContact CD1-OG1 3.3Å; L17-T43 WeakPolarHBondContact CD1-OG1 3.03Å; T43-F45 HydrophobicContact CG2-CD2 4.16Å; T43-F45 HydrophobicContact CG2-CE1 4.29Å; T43-F45 HydrophobicContact CG2-CE2 3.39Å; T43-F45 HydrophobicContact CG2-CZ 3.47Å; T43-F45 VanDerWaalsContact CG2-CZ 3.47Å; T43-F60 PolarHBondContact N-O 2.83Å; T43-F60 PolarHBondContact O-N 2.79Å; T43-F60 VanDerWaalsContact O-O 3.12Å
44	A	61.8	Low	61.9	Low	14 Å²	14	60.4 Å²	60.4	12%	0.116	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.5	175.7	0	0	0	0	0	110.7	H15 T16 N59	H15-A44 HydrophobicContact CB-CB 4.42Å; H15-A44 PolarHBondContact N-O 3.5Å; T16-A44 PolarHBondContact O-N 2.7Å; A44-N59 WeakPolarHBondContact CB-OD1 3.49Å
45	F	65.1	Low	61.6	Low	66 Å²	66	62 Å²	62	29%	0.289	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.7	171.1	-59	-88.2	0	0	0	109.1	Q13 T43 F47 T57 V58 F60	Q13-F45 CarbonylContact O-C 3.53Å; Q13-F45 WeakPolarHBondContact O-CA 3.31Å; T43-F45 HydrophobicContact CG2-CD2 4.16Å; T43-F45 HydrophobicContact CG2-CE1 4.29Å; T43-F45 HydrophobicContact CG2-CE2 3.39Å; T43-F45 HydrophobicContact CG2-CZ 3.47Å; T43-F45 VanDerWaalsContact CG2-CZ 3.47Å; F45-F47 HydrophobicContact CB-CE2 4.22Å; F45-F47 HydrophobicContact CB-CZ 4.43Å; F45-T57 CarbonylContact O-C 3.48Å; F45-T57 WeakPolarHBondContact O-CA 3.46Å; F45-V58 PolarHBondContact N-O 2.79Å; F45-V58 PolarHBondContact O-N 2.87Å; F45-F60 AromaticContact CD2-CD2 3.58Å; F45-F60 HydrophobicContact CD2-CD2 3.58Å; F45-F60 AromaticContact CD2-CE2 3.7Å; F45-F60 HydrophobicContact CD2-CE2 3.7Å; F45-F60 AromaticContact CE2-CD2 3.85Å; F45-F60 HydrophobicContact CE2-CD2 3.85Å; F45-F60 HydrophobicContact CE2-CE2 4.17Å
46	S	57.9	Low	61.5	Low	4 Å²	4	60.4 Å²	60.4	3%	0.028	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	146.2	156.1	67.8	0	0	0	0	110.8	P12 Q13 H15 T56	P12-S46 WeakPolarHBondContact CA-O 3.35Å; Q13-S46 PolarHBondContact N-O 2.87Å; Q13-S46 PolarHBondContact O-N 2.85Å; H15-S46 PolarHBondContact CD2-N 3.15Å; H15-S46 PolarHBondContact CE1-OG 2.74Å; H15-S46 WeakPolarHBondContact NE2-CB 3.38Å; H15-S46 PolarHBondContact NE2-OG 2.87Å; S46-T56 WeakPolarHBondContact CA-O 3.29Å
47	F	63.1	Low	61.1	Low	65 Å²	65	60.3 Å²	60.3	29%	0.285	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.3	167	-58.6	-85.7	0	0	0	106.1	V10 P12 F45 P49 T56 V58	V10-F47 HydrophobicContact CB-CB 4.39Å; V10-F47 HydrophobicContact CB-CD1 4.24Å; V10-F47 HydrophobicContact CG1-CB 4.37Å; V10-F47 HydrophobicContact CG2-CD1 4.16Å; P12-F47 HydrophobicContact CB-CD1 4.31Å; P12-F47 HydrophobicContact CB-CE1 4.04Å; F45-F47 HydrophobicContact CB-CE2 4.22Å; F45-F47 HydrophobicContact CB-CZ 4.43Å; F47-P49 WeakPolarHBondContact O-CD 3.49Å; F47-T56 PolarHBondContact N-O 3.19Å; F47-T56 PolarHBondContact O-N 2.95Å; F47-V58 HydrophobicContact CD2-CB 4.44Å; F47-V58 HydrophobicContact CD2-CG2 3.8Å; F47-V58 HydrophobicContact CE2-CB 4.04Å; F47-V58 HydrophobicContact CE2-CG2 3.74Å
48	I	58.4	Low	60.8	Low	59 Å²	59	56.5 Å²	56.5	30%	0.303	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.6	167.9	-54.4	174	0	0	0	105.6	N11 L50	N11-I48 PolarHBondContact N-O 2.92Å; I48-L50 PolarHBondContact O-N 3.03Å
49	P	55.7	Low	60.3	Low	19 Å²	19	58.2 Å²	58.2	12%	0.123	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	124	168.5	-8.6	23.1	0	0	0	107.8	D8 F47 A51 R52 D54	D8-P49 HydrophobicContact CB-CB 4.35Å; F47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-A51 PolarHBondContact O-N 2.96Å; P49-R52 HydrophobicContact CB-CB 4.39Å; P49-R52 CarbonylContact O-C 3.57Å; P49-R52 PolarHBondContact O-N 3.24Å; P49-D54 WeakPolarHBondContact CD-O 3.43Å
50	L	57.2	Low	59.8	Low	119 Å²	119	59 Å²	59	62%	0.623	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.4	178.2	-79.2	166.7	0	0	0	112.5	V9 I48	V9-L50 HydrophobicContact CB-CD1 3.83Å; V9-L50 HydrophobicContact CG1-CD1 3.64Å; V9-L50 WeakPolarHBondContact O-CB 3.35Å; V9-L50 WeakPolarHBondContact O-CG 3.24Å; V9-L50 PolarHBondContact O-N 3.33Å; I48-L50 PolarHBondContact O-N 3.03Å
51	A	57.8	Low	59.3	Low	68 Å²	68	58.3 Å²	58.3	56%	0.562	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-22.8	-177.1	0	0	0	0	0	114.5	D8 P49	D8-A51 VanDerWaalsContact OD1-CB 3.24Å; D8-A51 WeakPolarHBondContact OD1-CB 3.42Å; P49-A51 PolarHBondContact O-N 2.96Å
52	R	53.7	Low	58.8	Low	148 Å²	148	62.2 Å²	62.2	56%	0.558	32%	0.318	S	S	*	.	S	Bend	trans	-133.8	108.1	-177.5	-65.8	-176.5	179.8	177.2	2.9	106.6	P49 D54	P49-R52 HydrophobicContact CB-CB 4.39Å; P49-R52 CarbonylContact O-C 3.57Å; P49-R52 PolarHBondContact O-N 3.24Å; R52-D54 PolarHBondContact O-N 3.32Å
53	H	55.9	Low	58.4	Low	181 Å²	181	66.1 Å²	66.1	84%	0.838	33%	0.328	S	S	*	.			trans	-59.1	14.5	179.1	-61.3	-76	0	0	0	115.1	S55	H53-S55 PolarHBondContact O-N 3.18Å
54	D	57.4	Low	58.4	Low	84 Å²	84	66.1 Å²	66.1	45%	0.449	33%	0.327	S	S	.	.			trans	-84.6	104.5	170.8	-64.5	-28.9	0	0	0	108.5	P49 R52	P49-D54 WeakPolarHBondContact CD-O 3.43Å; R52-D54 PolarHBondContact O-N 3.32Å
55	S	57.5	Low	58.3	Low	35 Å²	35	69.2 Å²	69.2	25%	0.245	34%	0.341	C	S	.	.			trans	-69.8	137.8	171.5	60	0	0	0	0	110.4	H53 D84	H53-S55 PolarHBondContact O-N 3.18Å; S55-D84 PolarHBondContact O-N 3.17Å; S55-D84 VanDerWaalsContact O-N 3.15Å
56	T	61.3	Low	57.9	Low	26 Å²	26	70.3 Å²	70.3	16%	0.16	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114.1	169.7	-60.3	0	0	0	0	108.4	S46 F47 V58 S81 R82 R83	S46-T56 WeakPolarHBondContact CA-O 3.29Å; F47-T56 PolarHBondContact N-O 3.19Å; F47-T56 PolarHBondContact O-N 2.95Å; T56-V58 HydrophobicContact CG2-CG2 4.25Å; T56-S81 WeakPolarHBondContact CG2-OG 3.24Å; T56-R82 WeakPolarHBondContact CA-O 3.42Å; T56-R83 HydrophobicContact CG2-CG 4.34Å
57	T	57	Low	57.9	Low	33 Å²	33	70.5 Å²	70.5	20%	0.202	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.7	173	-55.4	0	0	0	0	109.1	F45 S81 R82	F45-T57 CarbonylContact O-C 3.48Å; F45-T57 WeakPolarHBondContact O-CA 3.46Å; T57-S81 WeakPolarHBondContact O-CA 3.31Å; T57-R82 PolarHBondContact N-O 3.21Å; T57-R82 PolarHBondContact O-N 3.43Å
58	V	59.7	Low	57.7	Low	16 Å²	16	69.9 Å²	69.9	10%	0.097	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.6	175.2	-174.7	0	0	0	0	108.8	F45 F47 T56 F60 V79 G80	F45-V58 PolarHBondContact N-O 2.79Å; F45-V58 PolarHBondContact O-N 2.87Å; F47-V58 HydrophobicContact CD2-CB 4.44Å; F47-V58 HydrophobicContact CD2-CG2 3.8Å; F47-V58 HydrophobicContact CE2-CB 4.04Å; F47-V58 HydrophobicContact CE2-CG2 3.74Å; T56-V58 HydrophobicContact CG2-CG2 4.25Å; V58-F60 HydrophobicContact CB-CE2 4.08Å; V58-F60 HydrophobicContact CG1-CD2 3.98Å; V58-F60 HydrophobicContact CG1-CE1 4.49Å; V58-F60 HydrophobicContact CG1-CE2 3.39Å; V58-F60 HydrophobicContact CG1-CZ 3.68Å; V58-V79 HydrophobicContact CG1-CG1 3.53Å; V58-G80 CarbonylContact C-O 3.45Å; V58-G80 VanDerWaalsContact CA-O 3.31Å; V58-G80 WeakPolarHBondContact CA-O 3.41Å
59	N	55.8	Low	57.5	Low	73 Å²	73	71.6 Å²	71.6	39%	0.39	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.2	174.5	-65.9	-25.5	0	0	0	109.1	A44 V79 G80	A44-N59 WeakPolarHBondContact CB-OD1 3.49Å; N59-V79 WeakPolarHBondContact O-CA 3.38Å; N59-G80 PolarHBondContact N-O 2.94Å; N59-G80 PolarHBondContact O-N 2.89Å
60	F	57	Low	57.5	Low	76 Å²	76	79.1 Å²	79.1	33%	0.333	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.3	169.2	-64.4	-94.9	0	0	0	108.4	T42 T43 F45 V58 Q78 V79	T42-F60 CarbonylContact C-O 3.56Å; T42-F60 WeakPolarHBondContact CA-O 3.36Å; T43-F60 PolarHBondContact N-O 2.83Å; T43-F60 PolarHBondContact O-N 2.79Å; T43-F60 VanDerWaalsContact O-O 3.12Å; F45-F60 AromaticContact CD2-CD2 3.58Å; F45-F60 HydrophobicContact CD2-CD2 3.58Å; F45-F60 AromaticContact CD2-CE2 3.7Å; F45-F60 HydrophobicContact CD2-CE2 3.7Å; F45-F60 AromaticContact CE2-CD2 3.85Å; F45-F60 HydrophobicContact CE2-CD2 3.85Å; F45-F60 HydrophobicContact CE2-CE2 4.17Å; V58-F60 HydrophobicContact CB-CE2 4.08Å; V58-F60 HydrophobicContact CG1-CD2 3.98Å; V58-F60 HydrophobicContact CG1-CE1 4.49Å; V58-F60 HydrophobicContact CG1-CE2 3.39Å; V58-F60 HydrophobicContact CG1-CZ 3.68Å; F60-Q78 WeakPolarHBondContact CA-O 3.45Å; F60-V79 HydrophobicContact CD1-CG1 4.38Å; F60-V79 HydrophobicContact CD1-CG2 3.68Å; F60-V79 HydrophobicContact CE1-CG1 4.02Å; F60-V79 HydrophobicContact CE1-CG2 3.73Å; F60-V79 HydrophobicContact CZ-CG1 4.32Å
61	T	56.6	Low	57.3	Low	26 Å²	26	79.1 Å²	79.1	16%	0.16	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.9	170.6	-54.7	0	0	0	0	108.2	R63 V77 Q78	T61-R63 HydrophobicContact CG2-CG 4.18Å; T61-V77 CarbonylContact O-C 3.59Å; T61-V77 VanDerWaalsContact O-CA 3.29Å; T61-V77 WeakPolarHBondContact O-CA 3.45Å; T61-Q78 PolarHBondContact N-O 2.92Å; T61-Q78 PolarHBondContact O-N 2.82Å
62	W	57.4	Low	57.2	Low	118 Å²	118	84 Å²	84	45%	0.447	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.8	172.4	-174.1	7.4	0	0	0	109.3	M41 I64 R76	M41-W62 HydrophobicContact CE-CD2 3.91Å; M41-W62 HydrophobicContact CE-CE3 3.46Å; M41-W62 VanDerWaalsContact CE-CE3 3.46Å; M41-W62 HydrophobicContact CE-CH2 4.49Å; M41-W62 HydrophobicContact CE-CZ3 3.79Å; M41-W62 PolarHBondContact N-O 2.65Å; M41-W62 CarbonylContact O-C 3.47Å; M41-W62 PolarHBondContact O-N 3.37Å; W62-I64 HydrophobicContact CD2-CD1 4.4Å; W62-I64 HydrophobicContact CD2-CG1 4.41Å; W62-I64 HydrophobicContact CH2-CD1 4.34Å; W62-I64 HydrophobicContact CZ2-CD1 3.7Å; W62-I64 HydrophobicContact CZ2-CG1 4.12Å; W62-I64 VanDerWaalsContact NE1-CG1 3.34Å; W62-R76 WeakPolarHBondContact CA-O 3.49Å
63	R	56.3	Low	57.2	Low	119 Å²	119	79.6 Å²	79.6	45%	0.449	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.1	171.5	-52.6	-169.1	179.3	177.7	-2.4	109	N40 T61 S75 R76	N40-R63 WeakPolarHBondContact OD1-CD 3.36Å; N40-R63 WeakPolarHBondContact OD1-CG 3.39Å; T61-R63 HydrophobicContact CG2-CG 4.18Å; R63-S75 CarbonylContact O-C 3.56Å; R63-S75 VanDerWaalsContact O-CA 3.32Å; R63-S75 WeakPolarHBondContact O-CA 3.21Å; R63-R76 PolarHBondContact N-O 2.81Å; R63-R76 PolarHBondContact O-N 3.46Å
64	I	63.5	Low	57.2	Low	40 Å²	40	74.9 Å²	74.9	21%	0.205	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.7	169.9	-55.8	174.4	0	0	0	106.9	V38 L39 M41 W62 L73	V38-I64 WeakPolarHBondContact CA-O 3.3Å; L39-I64 HydrophobicContact CB-CB 4.41Å; L39-I64 PolarHBondContact N-O 3.43Å; L39-I64 PolarHBondContact O-N 2.97Å; M41-I64 HydrophobicContact CE-CD1 4.16Å; W62-I64 HydrophobicContact CD2-CD1 4.4Å; W62-I64 HydrophobicContact CD2-CG1 4.41Å; W62-I64 HydrophobicContact CH2-CD1 4.34Å; W62-I64 HydrophobicContact CZ2-CD1 3.7Å; W62-I64 HydrophobicContact CZ2-CG1 4.12Å; W62-I64 VanDerWaalsContact NE1-CG1 3.34Å; I64-L73 HydrophobicContact CG2-CD2 4.01Å
65	L	59.9	Low	57.3	Low	78 Å²	78	71.6 Å²	71.6	41%	0.408	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.1	167.6	178.7	67.5	0	0	0	108	V38 L73 H74	V38-L65 HydrophobicContact CG2-CD1 3.65Å; L65-L73 WeakPolarHBondContact O-CD2 3.32Å; L65-H74 HydrophobicContact CB-CB 4.41Å; L65-H74 PolarHBondContact N-O 2.85Å; L65-H74 PolarHBondContact O-N 3.49Å
66	H	58	Low	57.6	Low	89 Å²	89	74.9 Å²	74.9	41%	0.412	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.2	173	-176.5	-76.4	0	0	0	109.5	F37 L73	F37-H66 HydrophobicContact CB-CB 4.49Å; F37-H66 PolarHBondContact N-O 2.81Å; F37-H66 PolarHBondContact O-N 3.35Å; H66-L73 HydrophobicContact CB-CD2 3.65Å; H66-L73 VanDerWaalsContact CD2-CD2 3.41Å; H66-L73 WeakPolarHBondContact CD2-CD2 3.48Å
67	A	57.1	Low	57.5	Low	8 Å²	8	75.7 Å²	75.7	7%	0.066	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.4	172.4	0	0	0	0	0	108.8	Y36 N69 E71	Y36-A67 HydrophobicContact CD1-CB 3.53Å; Y36-A67 HydrophobicContact CE1-CB 3.49Å; Y36-A67 VanDerWaalsContact CE1-CB 3.49Å; A67-N69 PolarHBondContact O-N 3.48Å; A67-N69 VanDerWaalsContact O-N 3.1Å; A67-E71 HydrophobicContact CB-CB 3.57Å; A67-E71 HydrophobicContact CB-CG 4.5Å; A67-E71 WeakPolarHBondContact CB-OE2 3.48Å
68	S	58.4	Low	57.6	Low	53 Å²	53	76.9 Å²	76.9	37%	0.371	37%	0.371	S	S	.	.	S	Bend	trans	-64.2	-13.2	-176.3	63.2	0	0	0	0	115.1	L35	L35-S68 PolarHBondContact N-OG 3.43Å; L35-S68 WeakPolarHBondContact O-CB 3.38Å; L35-S68 PolarHBondContact O-N 3.21Å; L35-S68 VanDerWaalsContact O-N 3.14Å; L35-S68 PolarHBondContact O-OG 2.88Å
69	N	55.5	Low	57.4	Low	95 Å²	95	78.3 Å²	78.3	51%	0.508	38%	0.38	S	S	.	.	S	Bend	trans	-118	82.3	-170.3	-64.6	2.1	0	0	0	110.2	A67 E71	A67-N69 PolarHBondContact O-N 3.48Å; A67-N69 VanDerWaalsContact O-N 3.1Å; N69-E71 PolarHBondContact O-N 3.38Å
70	D	55.3	Low	57.5	Low	177 Å²	177	76 Å²	76	95%	0.947	37%	0.373	S	S	*	.	S	Bend	trans	48	16.2	168.6	-65.8	-28.8	0	0	0	117.2
71	E	51.4	Low	57.8	Low	119 Å²	119	74 Å²	74	56%	0.556	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-92.1	127.8	-177	-92.6	-178.6	-174.5	0	0	109.2	A67 N69 L73	A67-E71 HydrophobicContact CB-CB 3.57Å; A67-E71 HydrophobicContact CB-CG 4.5Å; A67-E71 WeakPolarHBondContact CB-OE2 3.48Å; N69-E71 PolarHBondContact O-N 3.38Å; E71-L73 PolarHBondContact O-N 3.27Å
72	K	56.4	Low	57.9	Low	171 Å²	171	79.3 Å²	79.3	74%	0.743	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-47.1	129	-177	-67.2	177.1	176.3	-173.6	0	111.4	H74	K72-H74 PolarHBondContact O-N 2.75Å; K72-H74 VanDerWaalsContact O-N 3.17Å
73	L	54.2	Low	57.8	Low	55 Å²	55	81.5 Å²	81.5	29%	0.288	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-54.1	120.9	169.4	-80	171.6	0	0	0	110	I64 L65 H66 E71 L101	I64-L73 HydrophobicContact CG2-CD2 4.01Å; L65-L73 WeakPolarHBondContact O-CD2 3.32Å; H66-L73 HydrophobicContact CB-CD2 3.65Å; H66-L73 VanDerWaalsContact CD2-CD2 3.41Å; H66-L73 WeakPolarHBondContact CD2-CD2 3.48Å; E71-L73 PolarHBondContact O-N 3.27Å; L73-L101 HydrophobicContact CD1-CD1 3.72Å
74	H	55.7	Low	57.9	Low	81 Å²	81	79.4 Å²	79.4	38%	0.375	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	106.7	172.5	-160.4	-86.5	0	0	0	108.9	L65 K72 E96	L65-H74 HydrophobicContact CB-CB 4.41Å; L65-H74 PolarHBondContact N-O 2.85Å; L65-H74 PolarHBondContact O-N 3.49Å; K72-H74 PolarHBondContact O-N 2.75Å; K72-H74 VanDerWaalsContact O-N 3.17Å; H74-E96 IonicContact CE1-OE1 3.46Å; H74-E96 PolarHBondContact CE1-OE1 3.5Å; H74-E96 IonicContact NE2-OE1 3.88Å
75	S	59.3	Low	57.2	Low	16 Å²	16	78.6 Å²	78.6	11%	0.112	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134	167.9	56.1	0	0	0	0	109.8	R63 V97 H99	R63-S75 CarbonylContact O-C 3.56Å; R63-S75 VanDerWaalsContact O-CA 3.32Å; R63-S75 WeakPolarHBondContact O-CA 3.21Å; S75-V97 VanDerWaalsContact O-O 3.09Å; S75-V97 PolarHBondContact OG-O 3.02Å; S75-H99 PolarHBondContact OG-N 2.76Å
76	R	62.9	Low	56.9	Low	103 Å²	103	85.6 Å²	85.6	39%	0.389	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.1	170.7	-172.4	175.1	-177.2	-178.5	3.9	109.3	W62 R63 Q78	W62-R76 WeakPolarHBondContact CA-O 3.49Å; R63-R76 PolarHBondContact N-O 2.81Å; R63-R76 PolarHBondContact O-N 3.46Å; R76-Q78 HydrophobicContact CG-CG 4.39Å
77	V	59.8	Low	56.6	Low	43 Å²	43	91.9 Å²	91.9	26%	0.261	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.3	171.7	-176.3	0	0	0	0	108.4	T61 V79	T61-V77 CarbonylContact O-C 3.59Å; T61-V77 VanDerWaalsContact O-CA 3.29Å; T61-V77 WeakPolarHBondContact O-CA 3.45Å; V77-V79 HydrophobicContact CG1-CG2 4.17Å
78	Q	59	Low	55.9	Low	58 Å²	58	101.1 Å²	101.1	27%	0.271	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.8	170.8	-63.6	-178.4	-4.2	0	0	108.6	F60 T61 R76	F60-Q78 WeakPolarHBondContact CA-O 3.45Å; T61-Q78 PolarHBondContact N-O 2.92Å; T61-Q78 PolarHBondContact O-N 2.82Å; R76-Q78 HydrophobicContact CG-CG 4.39Å
79	V	55.2	Low	55.3	Low	46 Å²	46	105.6 Å²	105.6	28%	0.279	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.6	177.6	-171.8	0	0	0	0	108.2	V58 N59 F60 V77 G93	V58-V79 HydrophobicContact CG1-CG1 3.53Å; N59-V79 WeakPolarHBondContact O-CA 3.38Å; F60-V79 HydrophobicContact CD1-CG1 4.38Å; F60-V79 HydrophobicContact CD1-CG2 3.68Å; F60-V79 HydrophobicContact CE1-CG1 4.02Å; F60-V79 HydrophobicContact CE1-CG2 3.73Å; F60-V79 HydrophobicContact CZ-CG1 4.32Å; V77-V79 HydrophobicContact CG1-CG2 4.17Å; V79-G93 CarbonylContact O-C 3.56Å; V79-G93 PolarHBondContact O-N 2.98Å
80	G	59.3	Low	55	Low	24 Å²	24	108.2 Å²	108.2	25%	0.247	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.7	173	0	0	0	0	0	109.7	V58 N59	V58-G80 CarbonylContact C-O 3.45Å; V58-G80 VanDerWaalsContact CA-O 3.31Å; V58-G80 WeakPolarHBondContact CA-O 3.41Å; N59-G80 PolarHBondContact N-O 2.94Å; N59-G80 PolarHBondContact O-N 2.89Å
81	S	61.8	Low	54.5	Low	36 Å²	36	103.7 Å²	103.7	25%	0.252	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.7	172.3	-178.4	0	0	0	0	110.7	T56 T57 C91	T56-S81 WeakPolarHBondContact CG2-OG 3.24Å; T57-S81 WeakPolarHBondContact O-CA 3.31Å; S81-C91 PolarHBondContact N-O 3.48Å; S81-C91 PolarHBondContact O-N 3.06Å
82	R	59.5	Low	54.2	Low	136 Å²	136	104.1 Å²	104.1	51%	0.513	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122	172.6	-178.4	179.6	169.1	-159.7	-8.8	108.7	T56 T57 D84	T56-R82 WeakPolarHBondContact CA-O 3.42Å; T57-R82 PolarHBondContact N-O 3.21Å; T57-R82 PolarHBondContact O-N 3.43Å; R82-D84 IonicContact CZ-OD1 3Å; R82-D84 IonicContact CZ-OD2 3.98Å; R82-D84 IonicContact NE-OD1 2.85Å; R82-D84 PolarHBondContact NE-OD1 3.06Å; R82-D84 IonicContact NH2-OD1 2.73Å; R82-D84 PolarHBondContact NH2-OD1 3.3Å; R82-D84 IonicContact NH2-OD2 3.92Å
83	R	54.8	Low	53.5	Low	164 Å²	164	98.2 Å²	98.2	62%	0.619	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.8	166.8	-70.4	-175.3	177.4	177.6	1	109	T56 G85	T56-R83 HydrophobicContact CG2-CG 4.34Å; R83-G85 PolarHBondContact O-N 3.18Å; R83-G85 VanDerWaalsContact O-N 3.13Å
84	D	57.9	Low	52.8	Low	75 Å²	75	98.3 Å²	98.3	40%	0.401	50%	0.498	S	S	.	.			trans	-87.6	60.6	169.7	-77.4	-28	0	0	0	109.9	S55 R82	S55-D84 PolarHBondContact O-N 3.17Å; S55-D84 VanDerWaalsContact O-N 3.15Å; R82-D84 IonicContact CZ-OD1 3Å; R82-D84 IonicContact CZ-OD2 3.98Å; R82-D84 IonicContact NE-OD1 2.85Å; R82-D84 PolarHBondContact NE-OD1 3.06Å; R82-D84 IonicContact NH2-OD1 2.73Å; R82-D84 PolarHBondContact NH2-OD1 3.3Å; R82-D84 IonicContact NH2-OD2 3.92Å
85	G	50.5	Low	52	Low	24 Å²	24	101.1 Å²	101.1	25%	0.247	51%	0.511	C	S	.	.	S	Bend	trans	-116.4	161	167.2	0	0	0	0	0	109.8	R83 R87	R83-G85 PolarHBondContact O-N 3.18Å; R83-G85 VanDerWaalsContact O-N 3.13Å; G85-R87 CarbonylContact O-C 3.51Å; G85-R87 PolarHBondContact O-N 3.11Å
86	K	53.3	Low	51	Low	225 Å²	225	105.9 Å²	105.9	98%	0.978	53%	0.531	S	S	*	.	S	Bend	trans	-50.1	-8.5	-177.7	-73.5	-170.4	176.6	-177.6	0	116.2
87	R	51.5	Low	50	Low	221 Å²	221	103.1 Å²	103.1	83%	0.834	53%	0.526	S	S	*	.	S	Bend	trans	-113.9	101.4	175.6	-63.7	-175.8	175.8	-173.5	-1.3	109.3	G85 Q89	G85-R87 CarbonylContact O-C 3.51Å; G85-R87 PolarHBondContact O-N 3.11Å; R87-Q89 PolarHBondContact O-N 2.81Å
88	K	42.3	Very low	49	Very low	202 Å²	202	104.6 Å²	104.6	88%	0.878	54%	0.538	S	S	*	.			trans	-63.9	92.4	173.9	-66.4	-174.9	178.2	-177.3	0	110
89	Q	46.5	Very low	48	Very low	147 Å²	147	107.3 Å²	107.3	69%	0.687	55%	0.551	S	S	*	*			trans	-114.2	106.8	158.6	-82	-176	-8.5	0	0	107.3	R87	R87-Q89 PolarHBondContact O-N 2.81Å
90	Q	48.1	Very low	47	Very low	150 Å²	150	108.8 Å²	108.8	70%	0.701	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.1	120.5	164.7	-72.7	179.9	-18.9	0	0	106.8
91	C	45.5	Very low	46	Very low	82 Å²	82	112 Å²	112	55%	0.554	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.3	101.6	168	-67.3	0	0	0	0	107.2	S81 G93	S81-C91 PolarHBondContact N-O 3.48Å; S81-C91 PolarHBondContact O-N 3.06Å; C91-G93 PolarHBondContact O-N 3.3Å
92	T	45	Very low	44.6	Very low	127 Å²	127	118.4 Å²	118.4	78%	0.779	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.5	92.6	165.9	43.8	0	0	0	0	108
93	G	41.2	Very low	43.8	Very low	48 Å²	48	119.3 Å²	119.3	50%	0.495	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.7	88.4	172.2	0	0	0	0	0	109.1	V79 C91 Q95	V79-G93 CarbonylContact O-C 3.56Å; V79-G93 PolarHBondContact O-N 2.98Å; C91-G93 PolarHBondContact O-N 3.3Å; G93-Q95 PolarHBondContact O-N 3.46Å
94	G	39.3	Very low	42.7	Very low	56 Å²	56	114.7 Å²	114.7	58%	0.577	62%	0.618	S	S	*	*			trans	-78.1	113.9	171.2	0	0	0	0	0	109.6
95	Q	40	Very low	41.7	Very low	141 Å²	141	116.5 Å²	116.5	66%	0.659	63%	0.627	S	S	*	*			trans	-93	105.1	166.9	-169.7	175.2	-0.7	0	0	108.3	G93 V97	G93-Q95 PolarHBondContact O-N 3.46Å; Q95-V97 HydrophobicContact CG-CG2 3.86Å; Q95-V97 PolarHBondContact O-N 3.45Å
96	E	38.3	Very low	40.8	Very low	115 Å²	115	125.5 Å²	125.5	54%	0.537	65%	0.654	S	S	.	*			trans	-71.7	107.5	170.4	-172.3	158	-139.7	0	0	108.5	H74	H74-E96 IonicContact CE1-OE1 3.46Å; H74-E96 PolarHBondContact CE1-OE1 3.5Å; H74-E96 IonicContact NE2-OE1 3.88Å
97	V	41	Very low	39.9	Very low	45 Å²	45	122.8 Å²	122.8	27%	0.273	65%	0.649	S	S	.	*			trans	-109.3	95	172.1	-173.6	0	0	0	0	106.7	S75 Q95 H99	S75-V97 VanDerWaalsContact O-O 3.09Å; S75-V97 PolarHBondContact OG-O 3.02Å; Q95-V97 HydrophobicContact CG-CG2 3.86Å; Q95-V97 PolarHBondContact O-N 3.45Å; V97-H99 WeakPolarHBondContact CG1-NE2 3.45Å; V97-H99 PolarHBondContact O-N 3.35Å
98	S	39.8	Very low	38.8	Very low	74 Å²	74	119.9 Å²	119.9	52%	0.517	65%	0.645	S	S	.	*			trans	-80	105.6	170.5	58.1	0	0	0	0	108.6	C100	S98-C100 PolarHBondContact O-N 3.45Å
99	H	37.6	Very low	38.1	Very low	116 Å²	116	119.6 Å²	119.6	54%	0.537	65%	0.647	S	S	.	*			trans	-85.9	105.6	164.6	-77.1	-76.5	0	0	0	108.3	S75 V97 L101	S75-H99 PolarHBondContact OG-N 2.76Å; V97-H99 WeakPolarHBondContact CG1-NE2 3.45Å; V97-H99 PolarHBondContact O-N 3.35Å; H99-L101 PolarHBondContact O-N 3.28Å
100	C	33.7	Very low	37.2	Very low	76 Å²	76	118.5 Å²	118.5	51%	0.514	65%	0.651	S	S	.	*			trans	-68.8	105.5	152.1	-66.7	0	0	0	0	105	S98 E102	S98-C100 PolarHBondContact O-N 3.45Å; C100-E102 PolarHBondContact O-N 3.37Å
101	L	38	Very low	36	Very low	91 Å²	91	114.8 Å²	114.8	48%	0.476	65%	0.653	S	S	.	*			trans	-63	108.6	158.9	-65.6	178.8	0	0	0	104.6	L73 H99 D105	L73-L101 HydrophobicContact CD1-CD1 3.72Å; H99-L101 PolarHBondContact O-N 3.28Å; L101-D105 HydrophobicContact CB-CB 4.38Å; L101-D105 HydrophobicContact CD1-CB 4.4Å; L101-D105 HydrophobicContact CD2-CB 4.06Å; L101-D105 VanDerWaalsContact CD2-OD2 3.31Å; L101-D105 WeakPolarHBondContact CD2-OD2 3.5Å
102	E	33.9	Very low	35.3	Very low	171 Å²	171	121.8 Å²	121.8	80%	0.799	67%	0.667	S	S	*	*			trans	-57.4	149.3	162.8	-83	-175.4	140.3	0	0	107.6	C100 G104 D105	C100-E102 PolarHBondContact O-N 3.37Å; E102-G104 PolarHBondContact O-N 2.86Å; E102-D105 PolarHBondContact O-N 2.92Å
103	D	41.2	Very low	34.3	Very low	155 Å²	155	120.7 Å²	120.7	83%	0.829	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	-1.3	-173.8	-91.8	-37.8	0	0	0	116.7
104	G	33.4	Very low	33.8	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-20	176.6	0	0	0	0	0	115.8	E102 R106	E102-G104 PolarHBondContact O-N 2.86Å; G104-R106 PolarHBondContact O-N 2.94Å
105	D	36.3	Very low	33.3	Very low	112 Å²	112	130 Å²	130	60%	0.599	69%	0.69	S	S	*	*			trans	-90.6	28.8	-179.9	-72.1	-22.7	0	0	0	112.7	L101 E102 L107	L101-D105 HydrophobicContact CB-CB 4.38Å; L101-D105 HydrophobicContact CD1-CB 4.4Å; L101-D105 HydrophobicContact CD2-CB 4.06Å; L101-D105 VanDerWaalsContact CD2-OD2 3.31Å; L101-D105 WeakPolarHBondContact CD2-OD2 3.5Å; E102-D105 PolarHBondContact O-N 2.92Å; D105-L107 VanDerWaalsContact C-N 3.26Å; D105-L107 PolarHBondContact O-N 3.33Å
106	R	32.1	Very low	32.8	Very low	213 Å²	213	132.6 Å²	132.6	80%	0.804	70%	0.703	S	S	*	*			trans	-58	98.6	158.2	-83.8	-177.4	165.3	-167.6	-3.4	106.7	G104 E108	G104-R106 PolarHBondContact O-N 2.94Å; R106-E108 VanDerWaalsContact C-N 3.25Å; R106-E108 PolarHBondContact O-N 3.21Å
107	L	34.5	Very low	32.3	Very low	168 Å²	168	134.2 Å²	134.2	88%	0.88	72%	0.715	S	S	*	*			trans	-52	100.6	159.3	-79.1	162.9	0	0	0	105.6	D105 E109	D105-L107 VanDerWaalsContact C-N 3.26Å; D105-L107 PolarHBondContact O-N 3.33Å; L107-E109 PolarHBondContact O-N 3.07Å
108	E	27.4	Very low	31.9	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	74%	0.743	S	S	*	*			trans	-52.6	113.5	161.9	-84	-167	150.1	0	0	105.1	R106 T110	R106-E108 VanDerWaalsContact C-N 3.25Å; R106-E108 PolarHBondContact O-N 3.21Å; E108-T110 PolarHBondContact O-N 2.81Å; E108-T110 PolarHBondContact O-OG1 3.49Å
109	E	27.5	Very low	31.3	Very low	195 Å²	195	140.5 Å²	140.5	91%	0.911	75%	0.75	S	S	*	*			trans	-55.9	89.3	158.5	-95.3	-172	143.8	0	0	105.8	L107 G111	L107-E109 PolarHBondContact O-N 3.07Å; E109-G111 PolarHBondContact O-N 2.84Å
110	T	28.1	Very low	30.8	Very low	125 Å²	125	143.7 Å²	143.7	77%	0.767	77%	0.765	S	S	*	*			trans	-74.1	79.3	170.4	-2.3	0	0	0	0	105.3	E108 R112	E108-T110 PolarHBondContact O-N 2.81Å; E108-T110 PolarHBondContact O-OG1 3.49Å; T110-R112 PolarHBondContact O-N 3.03Å
111	G	23.2	Very low	30.5	Very low	72 Å²	72	145.6 Å²	145.6	74%	0.742	78%	0.775	S	S	*	*			trans	-62.9	85.5	165.2	0	0	0	0	0	108.9	E109	E109-G111 PolarHBondContact O-N 2.84Å
112	R	29.6	Very low	29.9	Very low	229 Å²	229	149.4 Å²	149.4	86%	0.864	79%	0.792	S	S	*	*			trans	-179.7	112.9	144.8	-105.6	176.4	-168.6	-161.1	2.9	109.7	T110 P114	T110-R112 PolarHBondContact O-N 3.03Å; R112-P114 WeakPolarHBondContact O-CD 3.41Å
113	S	25	Very low	29.7	Very low	104 Å²	104	151.7 Å²	151.7	73%	0.727	79%	0.793	S	S	*	*			trans	-39.5	134.8	144.7	151.2	0	0	0	0	110.4
114	P	31	Very low	28.9	Very low	119 Å²	119	152.9 Å²	152.9	77%	0.773	79%	0.794	S	S	*	*				-120.4	140.1	120.9	34.3	-28.7	0	0	0	110.5	R112	R112-P114 WeakPolarHBondContact O-CD 3.41Å
115	E	27.9	Very low	28.8	Very low	179 Å²	179	155.3 Å²	155.3	84%	0.836	80%	0.795	S	S	*	*			trans	-47.5	147.5	173.8	-66.7	167	149.6	0	0	112.2	D117	E115-D117 PolarHBondContact O-N 2.91Å
116	E	28.7	Very low	28.4	Very low	196 Å²	196	155.3 Å²	155.3	92%	0.916	80%	0.801	S	S	*	*			trans	-39.2	111.6	172.6	-64.5	162.5	153.2	0	0	113
117	D	28.2	Very low	28.1	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	81%	0.806	S	S	*	*			trans	-153	61.4	151.4	-140.7	4.5	0	0	0	110.3	E115	E115-D117 PolarHBondContact O-N 2.91Å
118	V	33.1	Very low	28	Very low	140 Å²	140	156.9 Å²	156.9	85%	0.848	80%	0.803	S	S	*	*			trans	-105.9	92.5	164.9	-175.1	0	0	0	0	107.7	E120	V118-E120 PolarHBondContact O-N 2.87Å; V118-E120 VanDerWaalsContact O-N 3.14Å
119	V	26.6	Very low	28.1	Very low	110 Å²	110	154.8 Å²	154.8	67%	0.667	80%	0.803	S	S	*	*			trans	-38.9	115	163.4	173.8	0	0	0	0	109.7	T121	V119-T121 PolarHBondContact O-N 3.34Å
120	E	27	Very low	28.1	Very low	183 Å²	183	153.2 Å²	153.2	86%	0.855	80%	0.8	S	S	*	*			trans	-57.5	97.7	171.7	-76.7	-170.9	150.2	0	0	109.2	V118 M122	V118-E120 PolarHBondContact O-N 2.87Å; V118-E120 VanDerWaalsContact O-N 3.14Å; E120-M122 PolarHBondContact O-N 2.73Å; E120-M122 VanDerWaalsContact O-N 3.09Å
121	T	28.6	Very low	28.3	Very low	117 Å²	117	155.6 Å²	155.6	72%	0.718	81%	0.807	S	S	*	*			trans	-74.1	101.8	166.9	29.1	0	0	0	0	107.1	V119 R123	V119-T121 PolarHBondContact O-N 3.34Å; T121-R123 PolarHBondContact O-N 3.3Å
122	M	24.9	Very low	28.5	Very low	171 Å²	171	157.8 Å²	157.8	84%	0.842	81%	0.806	S	S	*	*			trans	-55.7	85.1	170	-73.4	177.3	49.4	0	0	110.2	E120 E124	E120-M122 PolarHBondContact O-N 2.73Å; E120-M122 VanDerWaalsContact O-N 3.09Å; M122-E124 PolarHBondContact O-N 3.24Å
123	R	29.4	Very low	28.4	Very low	219 Å²	219	157.9 Å²	157.9	83%	0.826	81%	0.806	S	S	*	*			trans	-79.9	103.2	162.6	-83.5	-170.6	167.6	-165.7	-1.9	107.3	T121 T125	T121-R123 PolarHBondContact O-N 3.3Å; R123-T125 VanDerWaalsContact C-N 3.3Å; R123-T125 PolarHBondContact O-N 2.67Å; R123-T125 PolarHBondContact O-OG1 2.93Å; R123-T125 VanDerWaalsContact O-OG1 3.11Å
124	E	25.1	Very low	28.7	Very low	179 Å²	179	159.8 Å²	159.8	84%	0.836	81%	0.814	S	S	*	*			trans	-51.3	95.5	166.2	-66.7	-165.8	147.7	0	0	109.3	M122	M122-E124 PolarHBondContact O-N 3.24Å
125	T	30.2	Very low	28.5	Very low	119 Å²	119	157.7 Å²	157.7	73%	0.73	81%	0.814	S	S	*	*			trans	-91.1	133.7	172.7	-40.3	0	0	0	0	106.9	R123 R127	R123-T125 VanDerWaalsContact C-N 3.3Å; R123-T125 PolarHBondContact O-N 2.67Å; R123-T125 PolarHBondContact O-OG1 2.93Å; R123-T125 VanDerWaalsContact O-OG1 3.11Å; T125-R127 PolarHBondContact O-N 2.91Å
126	P	28.7	Very low	28.6	Very low	112 Å²	112	158 Å²	158	73%	0.727	82%	0.815	S	S	*	*			trans	-56.7	134.3	-163.5	-25.7	33.1	0	0	0	113.9	H128	P126-H128 PolarHBondContact O-N 3.19Å
127	R	26.1	Very low	28.5	Very low	238 Å²	238	157.4 Å²	157.4	90%	0.898	81%	0.812	S	S	*	*			trans	-59	99.2	175.5	-63	177.5	-179.3	170.1	1.2	110.1	T125	T125-R127 PolarHBondContact O-N 2.91Å
128	H	31.1	Very low	28.6	Very low	177 Å²	177	161 Å²	161	82%	0.819	82%	0.821	S	S	*	*			trans	-69.6	133.2	154.2	-86.5	-74.3	0	0	0	108.3	P126 L130	P126-H128 PolarHBondContact O-N 3.19Å; H128-L130 PolarHBondContact O-N 2.81Å
129	P	30.2	Very low	28.1	Very low	117 Å²	117	157 Å²	157	76%	0.76	81%	0.809	S	S	*	*			trans	-55	125.5	-174.4	-25	32.2	0	0	0	112.3	L131	P129-L131 PolarHBondContact O-N 2.79Å
130	L	27	Very low	28.1	Very low	161 Å²	161	163 Å²	163	84%	0.843	82%	0.819	S	S	*	*			trans	-47.4	102.9	164.3	-86.8	142.2	0	0	0	109.9	H128 V132	H128-L130 PolarHBondContact O-N 2.81Å; L130-V132 PolarHBondContact O-N 2.81Å
131	L	33.2	Very low	28.3	Very low	176 Å²	176	160.1 Å²	160.1	92%	0.921	82%	0.817	S	S	*	*			trans	-72.9	93.2	151	-90.8	164.6	0	0	0	107	P129 R133	P129-L131 PolarHBondContact O-N 2.79Å; L131-R133 PolarHBondContact O-N 2.92Å
132	V	27.6	Very low	28.3	Very low	117 Å²	117	163.1 Å²	163.1	71%	0.709	82%	0.82	S	S	*	*			trans	-40.2	111.4	166.2	170	0	0	0	0	111.2	L130	L130-V132 PolarHBondContact O-N 2.81Å
133	R	27.8	Very low	28.4	Very low	231 Å²	231	163 Å²	163	87%	0.872	82%	0.817	S	S	*	*				44.1	97	126.9	-153.8	-178.3	-168.9	178.1	3.4	117.2	L131	L131-R133 PolarHBondContact O-N 2.92Å
134	T	29.5	Very low	28.6	Very low	145 Å²	145	159 Å²	159	89%	0.89	81%	0.808	S	S	*	*			trans	-136.4	110.9	136	28.2	0	0	0	0	104.1
135	G	27.5	Very low	28.9	Very low	75 Å²	75	154.8 Å²	154.8	77%	0.773	80%	0.795	S	S	*	*			cis	96.1	22.9	49.4	0	0	0	0	0	112.2
136	E	29.6	Very low	29.2	Very low	184 Å²	184	155.5 Å²	155.5	86%	0.86	79%	0.788	S	S	*	*			trans	-112.6	110.4	167.4	-106.8	176.4	169.9	0	0	110.2	F138	E136-F138 PolarHBondContact O-N 2.8Å
137	Q	26.5	Very low	29.5	Very low	185 Å²	185	154.2 Å²	154.2	86%	0.864	78%	0.778	S	S	*	*			trans	-58.2	121.8	176.1	-65.8	168.6	-5.2	0	0	108.7	G139	Q137-G139 PolarHBondContact O-N 2.86Å
138	F	29.9	Very low	29.9	Very low	224 Å²	224	150.4 Å²	150.4	98%	0.982	77%	0.768	S	S	*	*			trans	-69.1	69.7	156.5	-73.9	-82.2	0	0	0	108.2	E136 R140	E136-F138 PolarHBondContact O-N 2.8Å; F138-R140 PolarHBondContact O-N 3.15Å
139	G	23.7	Very low	30.4	Very low	58 Å²	58	146.6 Å²	146.6	60%	0.598	75%	0.752	S	S	*	*			trans	-83.6	108.6	176.1	0	0	0	0	0	109.8	Q137	Q137-G139 PolarHBondContact O-N 2.86Å
140	R	26.1	Very low	30.7	Very low	234 Å²	234	143.9 Å²	143.9	88%	0.883	74%	0.74	S	S	*	*			trans	97.7	116.9	163.8	-67.1	-173.6	173.3	-131.4	-2.3	116.9	F138 F142	F138-R140 PolarHBondContact O-N 3.15Å; R140-F142 PolarHBondContact O-N 3.14Å
141	P	31.2	Very low	31.3	Very low	123 Å²	123	142.3 Å²	142.3	80%	0.799	73%	0.728	S	S	*	*			trans	-64.6	122.8	166.2	27.1	-30.1	0	0	0	108.4	H143	P141-H143 VanDerWaalsContact C-N 3.35Å; P141-H143 PolarHBondContact O-N 3.1Å
142	F	29	Very low	31.6	Very low	181 Å²	181	142.3 Å²	142.3	79%	0.794	72%	0.721	S	S	*	*			trans	-69.6	98.7	171.9	-142.9	-96.4	0	0	0	107.6	R140 E144	R140-F142 PolarHBondContact O-N 3.14Å; F142-E144 HydrophobicContact CD1-CB 4.12Å; F142-E144 HydrophobicContact CD1-CG 4.27Å; F142-E144 HydrophobicContact CE1-CB 4.45Å; F142-E144 HydrophobicContact CE1-CG 4.12Å; F142-E144 PolarHBondContact O-N 2.72Å
143	H	28.1	Very low	32.2	Very low	167 Å²	167	143.4 Å²	143.4	77%	0.773	72%	0.72	S	S	*	*			trans	-72.8	71.4	172.3	-140.6	-50.1	0	0	0	108.1	P141	P141-H143 VanDerWaalsContact C-N 3.35Å; P141-H143 PolarHBondContact O-N 3.1Å
144	E	31.9	Very low	32.6	Very low	135 Å²	135	138.9 Å²	138.9	63%	0.631	71%	0.708	S	S	*	*			trans	-108.8	90.8	158.9	-100.9	-166.8	145.5	0	0	109.3	F142 K146	F142-E144 HydrophobicContact CD1-CB 4.12Å; F142-E144 HydrophobicContact CD1-CG 4.27Å; F142-E144 HydrophobicContact CE1-CB 4.45Å; F142-E144 HydrophobicContact CE1-CG 4.12Å; F142-E144 PolarHBondContact O-N 2.72Å; E144-K146 PolarHBondContact O-N 2.85Å; E144-K146 VanDerWaalsContact O-N 3.07Å
145	T	32.1	Very low	33	Very low	92 Å²	92	135.7 Å²	135.7	56%	0.564	70%	0.696	S	S	*	*			trans	-48.3	107.6	166.5	-29.4	0	0	0	0	108.9	T147	T145-T147 WeakPolarHBondContact CG2-OG1 3.44Å; T145-T147 PolarHBondContact O-N 3.09Å
146	K	36.2	Very low	33.4	Very low	134 Å²	134	135 Å²	135	58%	0.583	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	27.9	178.1	-80.7	-175	176.2	178	0	114.1	E144 K148 I149	E144-K146 PolarHBondContact O-N 2.85Å; E144-K146 VanDerWaalsContact O-N 3.07Å; K146-K148 PolarHBondContact O-N 2.8Å; K146-I149 HydrophobicContact CD-CD1 4.02Å; K146-I149 HydrophobicContact CG-CD1 4.01Å; K146-I149 HydrophobicContact CG-CG1 4.47Å; K146-I149 PolarHBondContact O-N 3.26Å
147	T	36.3	Very low	33.9	Very low	85 Å²	85	133 Å²	133	52%	0.521	68%	0.684	S	S	.	*	H	α-helix	trans	-64.9	-21.5	161.5	-7	0	0	0	0	111.5	T145 Q151	T145-T147 WeakPolarHBondContact CG2-OG1 3.44Å; T145-T147 PolarHBondContact O-N 3.09Å; T147-Q151 WeakPolarHBondContact O-CG 3.21Å; T147-Q151 PolarHBondContact O-N 2.83Å
148	K	33.4	Very low	34.6	Very low	157 Å²	157	131.4 Å²	131.4	68%	0.683	68%	0.677	S	S	*	*	H	α-helix	trans	-76.1	-26.9	176.7	-79.8	-176.3	177.4	176	0	115.2	K146 K152	K146-K148 PolarHBondContact O-N 2.8Å; K148-K152 PolarHBondContact O-N 3.42Å
149	I	40.9	Very low	35.3	Very low	97 Å²	97	128.2 Å²	128.2	50%	0.497	67%	0.67	S	S	.	*	H	α-helix	trans	-79.6	-34	177.1	-59.7	-179.1	0	0	0	110.4	K146 K152	K146-I149 HydrophobicContact CD-CD1 4.02Å; K146-I149 HydrophobicContact CG-CD1 4.01Å; K146-I149 HydrophobicContact CG-CG1 4.47Å; K146-I149 PolarHBondContact O-N 3.26Å; I149-K152 PolarHBondContact O-N 2.78Å
150	A	37.3	Very low	35.9	Very low	60 Å²	60	134.5 Å²	134.5	50%	0.496	68%	0.681	S	S	.	*	H	α-helix	trans	-67.2	-38.7	172.7	0	0	0	0	0	112.3	K152 M153 H154	A150-K152 PolarHBondContact O-N 2.93Å; A150-M153 PolarHBondContact O-N 2.83Å; A150-H154 PolarHBondContact O-N 3.42Å
151	Q	40.5	Very low	36.4	Very low	129 Å²	129	131.2 Å²	131.2	60%	0.603	68%	0.68	S	S	*	*	H	α-helix	trans	-68.4	-30.9	177.4	-78.2	-179.9	-11.8	0	0	113.7	T147 M153 H154 A155	T147-Q151 WeakPolarHBondContact O-CG 3.21Å; T147-Q151 PolarHBondContact O-N 2.83Å; Q151-M153 VanDerWaalsContact C-N 3.3Å; Q151-M153 PolarHBondContact O-N 3.47Å; Q151-H154 PolarHBondContact O-N 3.12Å; Q151-A155 WeakPolarHBondContact O-CB 3.35Å; Q151-A155 PolarHBondContact O-N 2.96Å
152	K	38.9	Very low	36.9	Very low	176 Å²	176	132.3 Å²	132.3	77%	0.765	68%	0.679	S	S	*	*	H	α-helix	trans	-71.8	-24.7	177.4	-155	175.4	-176.1	-178.6	0	113	K148 I149 A150	K148-K152 PolarHBondContact O-N 3.42Å; I149-K152 PolarHBondContact O-N 2.78Å; A150-K152 PolarHBondContact O-N 2.93Å
153	M	39	Very low	37.3	Very low	139 Å²	139	131 Å²	131	69%	0.685	68%	0.68	S	S	*	*	H	α-helix	trans	-81.2	-28	171.1	-70.6	-156.5	-81.9	0	0	112.7	A150 Q151	A150-M153 PolarHBondContact O-N 2.83Å; Q151-M153 VanDerWaalsContact C-N 3.3Å; Q151-M153 PolarHBondContact O-N 3.47Å
154	H	36.4	Very low	37.7	Very low	137 Å²	137	129.4 Å²	129.4	63%	0.634	68%	0.682	S	S	*	*	H	α-helix	trans	-76.2	-39	175.9	-131.4	-72.8	0	0	0	112.8	A150 Q151 G156 L157	A150-H154 PolarHBondContact O-N 3.42Å; Q151-H154 PolarHBondContact O-N 3.12Å; H154-G156 PolarHBondContact O-N 3.14Å; H154-L157 PolarHBondContact O-N 3.38Å
155	A	38.1	Very low	38	Very low	77 Å²	77	131.2 Å²	131.2	64%	0.636	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-13.8	179	0	0	0	0	0	114.1	Q151	Q151-A155 WeakPolarHBondContact O-CB 3.35Å; Q151-A155 PolarHBondContact O-N 2.96Å
156	G	36.2	Very low	38.2	Very low	62 Å²	62	134.2 Å²	134.2	64%	0.639	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-5.9	179.3	0	0	0	0	0	114.9	H154	H154-G156 PolarHBondContact O-N 3.14Å
157	L	39.4	Very low	38.3	Very low	140 Å²	140	135.5 Å²	135.5	73%	0.733	72%	0.717	S	S	*	*	S	Bend	trans	-105.8	-9.2	-175.6	-105.8	158.7	0	0	0	114	H154	H154-L157 PolarHBondContact O-N 3.38Å
158	E	42.4	Very low	38.3	Very low	153 Å²	153	142.3 Å²	142.3	72%	0.715	73%	0.733	S	S	*	*	S	Bend	trans	-91.9	-8.3	-180	-69.6	-173.6	152.4	0	0	114.3	K160	E158-K160 PolarHBondContact O-N 3.2Å
159	D	43.8	Very low	38.5	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	15.8	-176.4	-113.9	10.8	0	0	0	114.7
160	K	36.2	Very low	38.3	Very low	190 Å²	190	144 Å²	144	83%	0.826	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140	28.4	179.3	-75	-156.7	173.3	-162.5	0	115.8	E158	E158-K160 PolarHBondContact O-N 3.2Å
161	L	36.6	Very low	38.3	Very low	164 Å²	164	148.1 Å²	148.1	86%	0.859	77%	0.77	S	S	*	*	S	Bend	trans	-118.9	23.8	167.7	-72.2	177.8	0	0	0	113.5
162	D	42.7	Very low	38.3	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	77%	0.771	S	S	*	*	S	Bend	trans	-104.4	139.3	153.5	-99.1	-29.5	0	0	0	107.8
163	D	36	Very low	38.5	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	78%	0.775	S	S	*	*			trans	92.2	67.4	178.4	-53.3	-25.2	0	0	0	117.2
164	T	37.6	Very low	38.6	Very low	133 Å²	133	147.9 Å²	147.9	82%	0.816	78%	0.777	S	S	*	*	S	Bend		-167.3	83.7	122.2	-0.6	0	0	0	0	108.4
165	E	37.6	Very low	39.1	Very low	173 Å²	173	148.3 Å²	148.3	81%	0.808	78%	0.784	S	S	*	*				92.4	99.1	95.1	-162.9	168.1	-159.3	0	0	109.9	D167	E165-D167 VanDerWaalsContact C-N 3.34Å; E165-D167 PolarHBondContact O-N 2.77Å
166	N	36.6	Very low	39	Very low	155 Å²	155	152.5 Å²	152.5	83%	0.829	79%	0.79	S	S	*	*			trans	-51.6	98.1	164.5	-75	-62.1	0	0	0	108.8	R168	N166-R168 VanDerWaalsContact C-N 3.29Å; N166-R168 PolarHBondContact O-N 2.7Å
167	D	38.8	Very low	39.8	Very low	162 Å²	162	159.9 Å²	159.9	87%	0.866	82%	0.823	S	S	*	*			trans	-69.5	97.8	165.5	-139.3	-3.6	0	0	0	107	E165 L169	E165-D167 VanDerWaalsContact C-N 3.34Å; E165-D167 PolarHBondContact O-N 2.77Å; D167-L169 PolarHBondContact O-N 2.85Å; D167-L169 VanDerWaalsContact O-N 3.12Å
168	R	36.7	Very low	39.8	Very low	227 Å²	227	160.9 Å²	160.9	86%	0.857	83%	0.827	S	S	*	*			trans	-58	110	-179.4	-69.2	175.6	179.2	-179.9	-0.4	108.6	N166 P170	N166-R168 VanDerWaalsContact C-N 3.29Å; N166-R168 PolarHBondContact O-N 2.7Å; R168-P170 VanDerWaalsContact O-CD 3.24Å; R168-P170 WeakPolarHBondContact O-CD 3.37Å
169	L	36.2	Very low	39.7	Very low	166 Å²	166	161.3 Å²	161.3	87%	0.869	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-59.7	117.8	154.8	-97.1	142.2	0	0	0	108.3	D167 D171	D167-L169 PolarHBondContact O-N 2.85Å; D167-L169 VanDerWaalsContact O-N 3.12Å; L169-D171 PolarHBondContact O-N 3.24Å
170	P	37.3	Very low	39.4	Very low	123 Å²	123	161.5 Å²	161.5	80%	0.799	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-73.4	130.4	168.4	28.8	-29.3	0	0	0	109.6	R168	R168-P170 VanDerWaalsContact O-CD 3.24Å; R168-P170 WeakPolarHBondContact O-CD 3.37Å
171	D	38.1	Very low	39.6	Very low	148 Å²	148	159.8 Å²	159.8	79%	0.791	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-67.4	150.1	-179.8	-152.6	-7.6	0	0	0	112.6	L169	L169-D171 PolarHBondContact O-N 3.24Å
172	S	40.5	Very low	39.8	Very low	90 Å²	90	159.6 Å²	159.6	63%	0.629	83%	0.832	S	S	*	*			trans	55.5	111.9	155.5	73	0	0	0	0	120.2
173	H	42.9	Very low	39.6	Very low	180 Å²	180	160.4 Å²	160.4	83%	0.833	84%	0.835	S	S	*	*			trans	-118.8	100.1	135.9	-112.8	-79.8	0	0	0	108.3	D175	H173-D175 IonicContact ND1-OD2 3.58Å
174	K	39.8	Very low	39.9	Very low	168 Å²	168	160.9 Å²	160.9	73%	0.73	84%	0.836	S	S	*	*			trans	-65.3	135.5	148	-70.6	178.7	174.4	179.2	0	106.4
175	D	47.1	Very low	40	Very low	147 Å²	147	163.1 Å²	163.1	79%	0.786	84%	0.838	S	S	*	*			trans	-144.9	125.4	143	-92.4	-40.7	0	0	0	110	H173	H173-D175 IonicContact ND1-OD2 3.58Å
176	H	35.6	Very low	40.3	Very low	164 Å²	164	162.3 Å²	162.3	76%	0.759	84%	0.84	S	S	*	*			trans	-71.6	137.3	176.2	-76.6	-97.3	0	0	0	110.2
177	T	53.6	Low	40.6	Very low	217 Å²	217	162.9 Å²	162.9	100%	1.331	84%	0.841	S	S	*	*				-173.7	0	119.4	-60.9	0	0	0	0	108.4

Retrieved 177 of 177 residues in 208.6 ms (Link to these results)

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