A0A077ZQY8_TRITR Loading...

Trypsin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZQY8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 232 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	G	72.5	Confident	84.3	Confident	41 Å²	41	75.4 Å²	75.4	42%	0.423	44%	0.44	S	S	.	.				0	174.1	0	0	0	0	0	0	113.5	K7 D8	G1-K7 CarbonylContact C-O 3.56Å; G1-K7 WeakPolarHBondContact CA-O 3.47Å; G1-D8 WeakPolarHBondContact CA-OD1 3.42Å; G1-D8 PolarHBondContact N-OD1 2.99Å
2	T	75.3	Confident	84.3	Confident	61 Å²	61	75.4 Å²	75.4	37%	0.374	47%	0.469	S	S	.	.			trans	-96.2	143.4	175.9	60.5	0	0	0	0	110.9	H4 G5 K7	T2-H4 PolarHBondContact O-N 3.5Å; T2-G5 PolarHBondContact O-N 3.14Å; T2-G5 PolarHBondContact OG1-O 3.4Å; T2-G5 VanDerWaalsContact OG1-O 3.05Å; T2-K7 HydrophobicContact CG2-CB 4.23Å; T2-K7 PolarHBondContact N-O 2.99Å
3	L	81	Confident	84.5	Confident	40 Å²	40	75.7 Å²	75.7	21%	0.209	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.8	177.9	-66.2	177.1	0	0	0	113.6	G5 N42 A44 I226	L3-G5 PolarHBondContact O-N 3.22Å; L3-N42 PolarHBondContact O-N 3.47Å; L3-A44 HydrophobicContact CD2-CB 4.13Å; L3-I226 HydrophobicContact CD1-CD1 3.3Å
4	H	85.4	Confident	84.7	Confident	176 Å²	176	75.3 Å²	75.3	82%	0.815	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-10	172	-75.7	79.6	0	0	0	112.9	T2	T2-H4 PolarHBondContact O-N 3.5Å
5	G	85.4	Confident	84.6	Confident	14 Å²	14	72.4 Å²	72.4	14%	0.144	46%	0.458	C	S	.	.	S	Bend	trans	75.6	-174.8	-171.8	0	0	0	0	0	112.8	T2 L3 K7 G39	T2-G5 PolarHBondContact O-N 3.14Å; T2-G5 PolarHBondContact OG1-O 3.4Å; T2-G5 VanDerWaalsContact OG1-O 3.05Å; L3-G5 PolarHBondContact O-N 3.22Å; G5-K7 PolarHBondContact O-N 2.79Å; G5-K7 VanDerWaalsContact O-N 3.1Å; G5-G39 CarbonylContact C-O 3.55Å; G5-G39 VanDerWaalsContact CA-O 3.27Å; G5-G39 WeakPolarHBondContact CA-O 3.16Å
6	G	87.3	Confident	84.5	Confident	74 Å²	74	69.2 Å²	69.2	76%	0.763	44%	0.443	S	S	*	.	S	Bend	trans	76.3	-18.8	-179.4	0	0	0	0	0	115.3	G39	G6-G39 PolarHBondContact N-O 3.34Å
7	K	87.7	Confident	84.7	Confident	157 Å²	157	68.4 Å²	68.4	68%	0.683	44%	0.438	S	S	*	.			trans	-134.7	119.8	177	-66.9	-174.8	179.8	-176.8	0	111.5	G1 T2 G5	G1-K7 CarbonylContact C-O 3.56Å; G1-K7 WeakPolarHBondContact CA-O 3.47Å; T2-K7 HydrophobicContact CG2-CB 4.23Å; T2-K7 PolarHBondContact N-O 2.99Å; G5-K7 PolarHBondContact O-N 2.79Å; G5-K7 VanDerWaalsContact O-N 3.1Å
8	D	89.9	Confident	84.9	Confident	40 Å²	40	68 Å²	68	21%	0.214	43%	0.431	C	S	.	.			trans	-162.2	162.6	174.4	-152.8	5.6	0	0	0	111.2	G1 G45	G1-D8 WeakPolarHBondContact CA-OD1 3.42Å; G1-D8 PolarHBondContact N-OD1 2.99Å; D8-G45 WeakPolarHBondContact OD1-CA 3.43Å; D8-G45 PolarHBondContact OD1-N 3.46Å; D8-G45 VanDerWaalsContact OD1-N 3.14Å; D8-G45 PolarHBondContact OD2-N 3.05Å
9	S	87.4	Confident	85.1	Confident	21 Å²	21	67.7 Å²	67.7	15%	0.147	43%	0.428	C	S	.	.			trans	-68.3	155.2	159.4	49.2	0	0	0	0	109.8	Y47	S9-Y47 PolarHBondContact OG-OH 2.7Å; S9-Y47 VanDerWaalsContact OG-OH 3.12Å
10	C	89.5	Confident	85	Confident	53 Å²	53	66.7 Å²	66.7	36%	0.358	42%	0.423	S	S	.	.			trans	-137.1	-172.4	-176.9	-158.5	0	0	0	0	112.9	G12 D13 C38	C10-G12 PolarHBondContact O-N 3.04Å; C10-D13 PolarHBondContact N-OD2 3.07Å; C10-D13 WeakPolarHBondContact O-CB 3.48Å; C10-D13 PolarHBondContact O-N 3.34Å; C10-C38 WeakPolarHBondContact CA-SG 3.43Å; C10-C38 HydrophobicContact CB-CB 3.64Å; C10-C38 WeakPolarHBondContact CB-SG 3.4Å; C10-C38 WeakPolarHBondContact SG-CB 3.43Å; C10-C38 CovalentContact SG-SG 2.03Å; C10-C38 PolarHBondContact SG-SG 2.68Å
11	Q	85.6	Confident	85.2	Confident	152 Å²	152	70 Å²	70	71%	0.71	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	130.1	176.8	-60.6	-62.4	73.1	0	0	110
12	G	84.7	Confident	85.7	Confident	76 Å²	76	71 Å²	71	78%	0.784	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	-19.2	-173.4	0	0	0	0	0	113.8	C10 S14	C10-G12 PolarHBondContact O-N 3.04Å; G12-S14 VanDerWaalsContact C-N 3.34Å
13	D	87	Confident	86.5	Confident	79 Å²	79	75.9 Å²	75.9	42%	0.422	45%	0.452	S	S	.	.			trans	-86.6	-5.9	176.9	-58.9	-37.4	0	0	0	112.9	C10 G15 G16 V32	C10-D13 PolarHBondContact N-OD2 3.07Å; C10-D13 WeakPolarHBondContact O-CB 3.48Å; C10-D13 PolarHBondContact O-N 3.34Å; D13-G15 PolarHBondContact O-N 3.14Å; D13-G16 WeakPolarHBondContact O-CA 3.47Å; D13-G16 PolarHBondContact O-N 3.22Å; D13-V32 HydrophobicContact CB-CG1 4.16Å; D13-V32 HydrophobicContact CB-CG2 4.49Å; D13-V32 VanDerWaalsContact O-CB 3.27Å; D13-V32 WeakPolarHBondContact O-CB 3.42Å; D13-V32 WeakPolarHBondContact O-CG1 3.09Å
14	S	86.8	Confident	86.9	Confident	70 Å²	70	76.8 Å²	76.8	49%	0.49	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	132.7	-179.2	-62.6	0	0	0	0	111.8	G12 G16	G12-S14 VanDerWaalsContact C-N 3.34Å; S14-G16 VanDerWaalsContact C-N 3.25Å
15	G	83.9	Confident	86.7	Confident	32 Å²	32	75.3 Å²	75.3	33%	0.33	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	-14.2	-172.5	0	0	0	0	0	114.1	D13 V32	D13-G15 PolarHBondContact O-N 3.14Å; G15-V32 PolarHBondContact N-O 2.82Å
16	G	82.2	Confident	86.7	Confident	21 Å²	21	79.6 Å²	79.6	22%	0.216	48%	0.477	C	S	.	.			trans	-66.4	153.9	177.3	0	0	0	0	0	113.5	D13 S14 V31 V32	D13-G16 WeakPolarHBondContact O-CA 3.47Å; D13-G16 PolarHBondContact O-N 3.22Å; S14-G16 VanDerWaalsContact C-N 3.25Å; G16-V31 WeakPolarHBondContact O-CA 2.9Å; G16-V32 WeakPolarHBondContact O-CG2 3.32Å; G16-V32 PolarHBondContact O-N 3.41Å
17	P	88.7	Confident	86.6	Confident	56 Å²	56	79 Å²	79	36%	0.364	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	139.9	-177.1	31.6	-35.3	0	0	0	112.6	V19 Q28	P17-V19 HydrophobicContact CB-CG1 4.36Å; P17-Q28 HydrophobicContact CB-CG 4.25Å
18	L	88.2	Confident	86.6	Confident	61 Å²	61	72.7 Å²	72.7	32%	0.319	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	105.9	157	175.5	68.3	0	0	0	107.8	Y29 G30 Y47	L18-Y29 PolarHBondContact O-N 3.38Å; L18-G30 PolarHBondContact N-O 3.16Å; L18-G30 PolarHBondContact O-N 2.73Å; L18-G30 VanDerWaalsContact O-N 3.07Å; L18-Y47 HydrophobicContact CB-CD1 3.71Å; L18-Y47 HydrophobicContact CB-CE1 3.92Å; L18-Y47 HydrophobicContact CB-CG 4.49Å; L18-Y47 HydrophobicContact CD1-CE1 4.27Å; L18-Y47 HydrophobicContact CD2-CD1 3.9Å; L18-Y47 HydrophobicContact CD2-CD2 4.22Å; L18-Y47 HydrophobicContact CD2-CE1 4.25Å; L18-Y47 HydrophobicContact CD2-CG 3.89Å; L18-Y47 HydrophobicContact CG-CD1 4.3Å; L18-Y47 HydrophobicContact CG-CE1 4.38Å
19	V	87.8	Confident	86.4	Confident	62 Å²	62	76.5 Å²	76.5	38%	0.376	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.1	179.2	-80.2	0	0	0	0	111.5	P17 T27 Q28 A139	P17-V19 HydrophobicContact CB-CG1 4.36Å; V19-T27 WeakPolarHBondContact CA-O 3.2Å; V19-Q28 HydrophobicContact CG1-CB 4.3Å; V19-A139 HydrophobicContact CG1-CB 4.49Å
20	C	83.4	Confident	86.4	Confident	48 Å²	48	75.6 Å²	75.6	32%	0.324	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.2	174.3	-63.4	0	0	0	0	109.4	I22 T27 Y29	C20-I22 HydrophobicContact CB-CG1 4.34Å; C20-I22 PolarHBondContact O-N 2.95Å; C20-T27 PolarHBondContact N-O 3.07Å; C20-T27 PolarHBondContact O-N 3.37Å; C20-Y29 HydrophobicContact CB-CD2 4.39Å
21	E	88.7	Confident	86.3	Confident	135 Å²	135	74.9 Å²	74.9	63%	0.631	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	117.6	171	-168.7	-177.8	169.3	0	0	109.1	K25 F26	E21-K25 WeakPolarHBondContact CA-O 3.32Å; E21-F26 HydrophobicContact CB-CD1 4.34Å; E21-F26 HydrophobicContact CB-CE1 4.12Å
22	I	84.5	Confident	86.4	Confident	64 Å²	64	68.4 Å²	68.4	33%	0.328	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.9	179.5	-55.5	176.3	0	0	0	106.8	C20 G24 K25 Y29	C20-I22 HydrophobicContact CB-CG1 4.34Å; C20-I22 PolarHBondContact O-N 2.95Å; I22-G24 PolarHBondContact O-N 2.48Å; I22-G24 VanDerWaalsContact O-N 3.15Å; I22-K25 PolarHBondContact N-O 2.93Å; I22-K25 PolarHBondContact O-N 2.85Å; I22-Y29 HydrophobicContact CD1-CD2 3.91Å; I22-Y29 HydrophobicContact CD1-CE2 3.64Å
23	D	91.3	Very high	86.3	Confident	162 Å²	162	67.2 Å²	67.2	87%	0.866	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	38.9	-179.7	-56.2	-38.1	0	0	0	113.7	K25	D23-K25 VanDerWaalsContact C-N 3.29Å; D23-K25 PolarHBondContact O-N 3.24Å
24	G	90	Very high	86.3	Confident	59 Å²	59	68 Å²	68	61%	0.608	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	11.8	-179.1	0	0	0	0	0	114.9	I22	I22-G24 PolarHBondContact O-N 2.48Å; I22-G24 VanDerWaalsContact O-N 3.15Å
25	K	81.7	Confident	86.1	Confident	145 Å²	145	66.2 Å²	66.2	63%	0.63	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	136	177.1	-63.3	-174.9	178	-172.5	0	111.3	E21 I22 D23 T27	E21-K25 WeakPolarHBondContact CA-O 3.32Å; I22-K25 PolarHBondContact N-O 2.93Å; I22-K25 PolarHBondContact O-N 2.85Å; D23-K25 VanDerWaalsContact C-N 3.29Å; D23-K25 PolarHBondContact O-N 3.24Å; K25-T27 PolarHBondContact O-N 3.08Å
26	F	84.6	Confident	86.1	Confident	105 Å²	105	66.8 Å²	66.8	46%	0.461	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	105.8	173	-72.1	-76.9	0	0	0	110	E21 A139	E21-F26 HydrophobicContact CB-CD1 4.34Å; E21-F26 HydrophobicContact CB-CE1 4.12Å; F26-A139 HydrophobicContact CB-CB 4.4Å
27	T	84.2	Confident	86.3	Confident	60 Å²	60	67.5 Å²	67.5	37%	0.368	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.2	178.8	-57.1	0	0	0	0	109.6	V19 C20 K25 Y29	V19-T27 WeakPolarHBondContact CA-O 3.2Å; C20-T27 PolarHBondContact N-O 3.07Å; C20-T27 PolarHBondContact O-N 3.37Å; K25-T27 PolarHBondContact O-N 3.08Å; T27-Y29 PolarHBondContact O-N 2.95Å
28	Q	88.3	Confident	86.3	Confident	25 Å²	25	67.2 Å²	67.2	12%	0.117	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	113.6	172.5	-170.2	177.6	-0.8	0	0	110.3	P17 V19 G30 V50 V137 L138	P17-Q28 HydrophobicContact CB-CG 4.25Å; V19-Q28 HydrophobicContact CG1-CB 4.3Å; Q28-G30 PolarHBondContact NE2-O 2.81Å; Q28-V50 HydrophobicContact CG-CG2 4.34Å; Q28-V137 PolarHBondContact OE1-O 3.37Å; Q28-V137 VanDerWaalsContact OE1-O 3.05Å; Q28-L138 HydrophobicContact CB-CD2 3.83Å; Q28-L138 VanDerWaalsContact OE1-CG 3.26Å
29	Y	85.4	Confident	86.2	Confident	121 Å²	121	65.3 Å²	65.3	48%	0.475	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-30.1	-176.9	-135.8	-98.7	0	0	0	112.4	L18 C20 I22 T27 L49 V50	L18-Y29 PolarHBondContact O-N 3.38Å; C20-Y29 HydrophobicContact CB-CD2 4.39Å; I22-Y29 HydrophobicContact CD1-CD2 3.91Å; I22-Y29 HydrophobicContact CD1-CE2 3.64Å; T27-Y29 PolarHBondContact O-N 2.95Å; Y29-L49 HydrophobicContact CD1-CD1 4.39Å; Y29-L49 HydrophobicContact CE1-CD1 4.37Å; Y29-V50 PolarHBondContact O-N 2.76Å
30	G	87.5	Confident	86	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.021	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	171.7	-178.1	0	0	0	0	0	114.9	L18 Q28 T48	L18-G30 PolarHBondContact N-O 3.16Å; L18-G30 PolarHBondContact O-N 2.73Å; L18-G30 VanDerWaalsContact O-N 3.07Å; Q28-G30 PolarHBondContact NE2-O 2.81Å; G30-T48 CarbonylContact C-O 3.47Å; G30-T48 WeakPolarHBondContact CA-O 3.11Å
31	V	87.9	Confident	86	Confident	38 Å²	38	71.5 Å²	71.5	23%	0.23	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.6	170.9	-179.2	0	0	0	0	108.4	G16 S33 Y47 T48 V50	G16-V31 WeakPolarHBondContact O-CA 2.9Å; V31-S33 PolarHBondContact O-N 3.29Å; V31-Y47 CarbonylContact O-C 3.44Å; V31-Y47 WeakPolarHBondContact O-CA 3.16Å; V31-Y47 WeakPolarHBondContact O-CB 3.38Å; V31-T48 PolarHBondContact N-O 3.05Å; V31-T48 VanDerWaalsContact N-O 3.09Å; V31-T48 PolarHBondContact O-N 3.21Å; V31-V50 HydrophobicContact CG2-CG2 3.94Å
32	V	86.6	Confident	85.6	Confident	16 Å²	16	69.2 Å²	69.2	10%	0.097	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	125.4	177.1	178	0	0	0	0	109.1	D13 G15 G16 Y47	D13-V32 HydrophobicContact CB-CG1 4.16Å; D13-V32 HydrophobicContact CB-CG2 4.49Å; D13-V32 VanDerWaalsContact O-CB 3.27Å; D13-V32 WeakPolarHBondContact O-CB 3.42Å; D13-V32 WeakPolarHBondContact O-CG1 3.09Å; G15-V32 PolarHBondContact N-O 2.82Å; G16-V32 WeakPolarHBondContact O-CG2 3.32Å; G16-V32 PolarHBondContact O-N 3.41Å; V32-Y47 HydrophobicContact CB-CD1 4.41Å; V32-Y47 HydrophobicContact CB-CE1 4.34Å; V32-Y47 HydrophobicContact CG2-CD1 4.03Å; V32-Y47 HydrophobicContact CG2-CE1 3.59Å
33	S	84.2	Confident	85.5	Confident	50 Å²	50	71 Å²	71	35%	0.35	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	-74.7	-176.1	-169.3	0	0	0	0	111.5	V31 V46	V31-S33 PolarHBondContact O-N 3.29Å; S33-V46 WeakPolarHBondContact CB-O 3.43Å; S33-V46 PolarHBondContact N-O 3.16Å; S33-V46 VanDerWaalsContact N-O 3.1Å
34	F	86.1	Confident	85.1	Confident	96 Å²	96	63.8 Å²	63.8	42%	0.421	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	174.9	-175.8	69.3	-88.1	0	0	0	112.6	V46 Y214	F34-V46 HydrophobicContact CD1-CB 4.06Å; F34-V46 HydrophobicContact CD1-CG1 4.14Å; F34-V46 HydrophobicContact CD2-CB 4.19Å; F34-V46 HydrophobicContact CD2-CG2 4.12Å; F34-V46 HydrophobicContact CE1-CB 3.87Å; F34-V46 HydrophobicContact CE1-CG1 3.53Å; F34-V46 HydrophobicContact CE1-CG2 4.42Å; F34-V46 HydrophobicContact CE2-CB 4.01Å; F34-V46 HydrophobicContact CE2-CG1 4.3Å; F34-V46 HydrophobicContact CE2-CG2 3.72Å; F34-V46 HydrophobicContact CG-CB 4.22Å; F34-V46 HydrophobicContact CZ-CB 3.85Å; F34-V46 HydrophobicContact CZ-CG1 3.64Å; F34-V46 HydrophobicContact CZ-CG2 3.89Å; F34-V46 PolarHBondContact N-O 3.19Å; F34-V46 WeakPolarHBondContact O-CA 3.41Å; F34-V46 WeakPolarHBondContact O-CB 3.38Å; F34-V46 PolarHBondContact O-N 2.74Å; F34-Y214 HydrophobicContact CE2-CE2 4.36Å; F34-Y214 HydrophobicContact CZ-CE2 4.35Å
35	G	83.9	Confident	84.9	Confident	33 Å²	33	61.4 Å²	61.4	34%	0.34	33%	0.332	S	S	.	.			trans	-170.4	160.9	175.4	0	0	0	0	0	112.2	G37	G35-G37 PolarHBondContact O-N 3.49Å
36	A	83.1	Confident	85.1	Confident	44 Å²	44	55.5 Å²	55.5	36%	0.364	31%	0.308	S	S	.	.	S	Bend	trans	-82	65.1	179	0	0	0	0	0	112	K40 Y43	A36-K40 VanDerWaalsContact O-CD 3.3Å; A36-K40 WeakPolarHBondContact O-CD 3.48Å; A36-K40 WeakPolarHBondContact O-CE 3.45Å; A36-K40 PolarHBondContact O-NZ 3.49Å; A36-Y43 HydrophobicContact CB-CD1 3.57Å; A36-Y43 HydrophobicContact CB-CE1 4.11Å; A36-Y43 HydrophobicContact CB-CG 4.15Å
37	G	86.2	Confident	85.2	Confident	36 Å²	36	53.5 Å²	53.5	37%	0.371	30%	0.298	S	S	.	.	S	Bend	trans	74.9	-172.7	-162	0	0	0	0	0	111.1	G35	G35-G37 PolarHBondContact O-N 3.49Å
38	C	88	Confident	85.3	Confident	49 Å²	49	52.8 Å²	52.8	33%	0.331	29%	0.293	S	S	.	.	S	Bend	trans	-118.5	135	-171.2	-44.1	0	0	0	0	111.1	C10 K40	C10-C38 WeakPolarHBondContact CA-SG 3.43Å; C10-C38 HydrophobicContact CB-CB 3.64Å; C10-C38 WeakPolarHBondContact CB-SG 3.4Å; C10-C38 WeakPolarHBondContact SG-CB 3.43Å; C10-C38 CovalentContact SG-SG 2.03Å; C10-C38 PolarHBondContact SG-SG 2.68Å; C38-K40 PolarHBondContact O-N 3.44Å
39	G	87.7	Confident	85.2	Confident	22 Å²	22	55.2 Å²	55.2	23%	0.227	31%	0.306	C	S	.	.	S	Bend	trans	64.4	24	171.5	0	0	0	0	0	114.2	G5 G6	G5-G39 CarbonylContact C-O 3.55Å; G5-G39 VanDerWaalsContact CA-O 3.27Å; G5-G39 WeakPolarHBondContact CA-O 3.16Å; G6-G39 PolarHBondContact N-O 3.34Å
40	K	82.3	Confident	85.1	Confident	108 Å²	108	50.4 Å²	50.4	47%	0.47	29%	0.29	S	S	.	.			trans	-81.4	141.6	179.6	-67.9	-171.4	-170.3	158.9	0	111	A36 C38 N42 Y43	A36-K40 VanDerWaalsContact O-CD 3.3Å; A36-K40 WeakPolarHBondContact O-CD 3.48Å; A36-K40 WeakPolarHBondContact O-CE 3.45Å; A36-K40 PolarHBondContact O-NZ 3.49Å; C38-K40 PolarHBondContact O-N 3.44Å; K40-N42 PolarHBondContact O-N 3.17Å; K40-Y43 HydrophobicContact CB-CD2 3.93Å; K40-Y43 HydrophobicContact CB-CG 4.43Å; K40-Y43 HydrophobicContact CD-CD2 4.47Å; K40-Y43 PolarHBondContact O-N 3.16Å; K40-Y43 VanDerWaalsContact O-N 3.16Å; K40-Y43 VanDerWaalsContact O-O 3.09Å
41	M	83	Confident	84.9	Confident	131 Å²	131	54.1 Å²	54.1	65%	0.645	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	134.4	173.3	-164.7	173.1	91.8	0	0	110.1	Y43	M41-Y43 VanDerWaalsContact O-CD2 3.28Å; M41-Y43 WeakPolarHBondContact O-CD2 3.36Å; M41-Y43 PolarHBondContact O-N 3.33Å
42	N	82.1	Confident	84.8	Confident	88 Å²	88	62 Å²	62	47%	0.471	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	4.1	-176.6	-56	-45.3	0	0	0	116.8	L3 K40 Q228	L3-N42 PolarHBondContact O-N 3.47Å; K40-N42 PolarHBondContact O-N 3.17Å; N42-Q228 PolarHBondContact O-NE2 2.93Å
43	Y	81.5	Confident	84.6	Confident	101 Å²	101	64.1 Å²	64.1	40%	0.396	35%	0.349	S	S	.	.			trans	-118.5	112.1	173.1	-63.3	-89.4	0	0	0	109.2	A36 K40 M41 Y230	A36-Y43 HydrophobicContact CB-CD1 3.57Å; A36-Y43 HydrophobicContact CB-CE1 4.11Å; A36-Y43 HydrophobicContact CB-CG 4.15Å; K40-Y43 HydrophobicContact CB-CD2 3.93Å; K40-Y43 HydrophobicContact CB-CG 4.43Å; K40-Y43 HydrophobicContact CD-CD2 4.47Å; K40-Y43 PolarHBondContact O-N 3.16Å; K40-Y43 VanDerWaalsContact O-N 3.16Å; K40-Y43 VanDerWaalsContact O-O 3.09Å; M41-Y43 VanDerWaalsContact O-CD2 3.28Å; M41-Y43 WeakPolarHBondContact O-CD2 3.36Å; M41-Y43 PolarHBondContact O-N 3.33Å; Y43-Y230 HydrophobicContact CD1-CE1 4.02Å; Y43-Y230 WeakPolarHBondContact CD1-OH 3.44Å; Y43-Y230 AromaticContact CE1-CE1 3.87Å; Y43-Y230 HydrophobicContact CE1-CE1 3.87Å
44	A	83.9	Confident	84.5	Confident	11 Å²	11	64.3 Å²	64.3	9%	0.091	35%	0.348	C	S	.	.			trans	-91.1	146	173.6	0	0	0	0	0	110.7	L3	L3-A44 HydrophobicContact CD2-CB 4.13Å
45	G	84.6	Confident	84.5	Confident	9 Å²	9	66 Å²	66	9%	0.093	36%	0.361	C	S	.	.			trans	-54.9	142.9	162.2	0	0	0	0	0	112	D8 Y47	D8-G45 WeakPolarHBondContact OD1-CA 3.43Å; D8-G45 PolarHBondContact OD1-N 3.46Å; D8-G45 VanDerWaalsContact OD1-N 3.14Å; D8-G45 PolarHBondContact OD2-N 3.05Å; G45-Y47 WeakPolarHBondContact O-CD2 3.48Å; G45-Y47 WeakPolarHBondContact O-CE2 3.45Å
46	V	85.8	Confident	84.7	Confident	21 Å²	21	70.3 Å²	70.3	13%	0.127	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.5	-179.2	-174.1	0	0	0	0	109	S33 F34 L216	S33-V46 WeakPolarHBondContact CB-O 3.43Å; S33-V46 PolarHBondContact N-O 3.16Å; S33-V46 VanDerWaalsContact N-O 3.1Å; F34-V46 HydrophobicContact CD1-CB 4.06Å; F34-V46 HydrophobicContact CD1-CG1 4.14Å; F34-V46 HydrophobicContact CD2-CB 4.19Å; F34-V46 HydrophobicContact CD2-CG2 4.12Å; F34-V46 HydrophobicContact CE1-CB 3.87Å; F34-V46 HydrophobicContact CE1-CG1 3.53Å; F34-V46 HydrophobicContact CE1-CG2 4.42Å; F34-V46 HydrophobicContact CE2-CB 4.01Å; F34-V46 HydrophobicContact CE2-CG1 4.3Å; F34-V46 HydrophobicContact CE2-CG2 3.72Å; F34-V46 HydrophobicContact CG-CB 4.22Å; F34-V46 HydrophobicContact CZ-CB 3.85Å; F34-V46 HydrophobicContact CZ-CG1 3.64Å; F34-V46 HydrophobicContact CZ-CG2 3.89Å; F34-V46 PolarHBondContact N-O 3.19Å; F34-V46 WeakPolarHBondContact O-CA 3.41Å; F34-V46 WeakPolarHBondContact O-CB 3.38Å; F34-V46 PolarHBondContact O-N 2.74Å; V46-L216 HydrophobicContact CG1-CD1 3.95Å; V46-L216 HydrophobicContact CG2-CD1 4.13Å; V46-L216 HydrophobicContact CG2-CD2 3.78Å
47	Y	87.3	Confident	84.6	Confident	63 Å²	63	71.5 Å²	71.5	25%	0.247	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.9	-176.3	-59.3	-101.9	0	0	0	109.8	S9 L18 V31 V32 G45 L49	S9-Y47 PolarHBondContact OG-OH 2.7Å; S9-Y47 VanDerWaalsContact OG-OH 3.12Å; L18-Y47 HydrophobicContact CB-CD1 3.71Å; L18-Y47 HydrophobicContact CB-CE1 3.92Å; L18-Y47 HydrophobicContact CB-CG 4.49Å; L18-Y47 HydrophobicContact CD1-CE1 4.27Å; L18-Y47 HydrophobicContact CD2-CD1 3.9Å; L18-Y47 HydrophobicContact CD2-CD2 4.22Å; L18-Y47 HydrophobicContact CD2-CE1 4.25Å; L18-Y47 HydrophobicContact CD2-CG 3.89Å; L18-Y47 HydrophobicContact CG-CD1 4.3Å; L18-Y47 HydrophobicContact CG-CE1 4.38Å; V31-Y47 CarbonylContact O-C 3.44Å; V31-Y47 WeakPolarHBondContact O-CA 3.16Å; V31-Y47 WeakPolarHBondContact O-CB 3.38Å; V32-Y47 HydrophobicContact CB-CD1 4.41Å; V32-Y47 HydrophobicContact CB-CE1 4.34Å; V32-Y47 HydrophobicContact CG2-CD1 4.03Å; V32-Y47 HydrophobicContact CG2-CE1 3.59Å; G45-Y47 WeakPolarHBondContact O-CD2 3.48Å; G45-Y47 WeakPolarHBondContact O-CE2 3.45Å; Y47-L49 PolarHBondContact O-N 3.14Å
48	T	85.8	Confident	84.5	Confident	44 Å²	44	75.7 Å²	75.7	27%	0.27	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	128.1	168.1	-56.9	0	0	0	0	108.6	G30 V31 V50 F53	G30-T48 CarbonylContact C-O 3.47Å; G30-T48 WeakPolarHBondContact CA-O 3.11Å; V31-T48 PolarHBondContact N-O 3.05Å; V31-T48 VanDerWaalsContact N-O 3.09Å; V31-T48 PolarHBondContact O-N 3.21Å; T48-V50 PolarHBondContact O-N 3.16Å; T48-F53 HydrophobicContact CG2-CD2 3.91Å; T48-F53 HydrophobicContact CG2-CE2 3.44Å; T48-F53 VanDerWaalsContact CG2-CE2 3.44Å; T48-F53 HydrophobicContact CG2-CZ 4.13Å
49	L	87	Confident	84.4	Confident	76 Å²	76	79.9 Å²	79.9	40%	0.398	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	102.5	179.9	178.8	65	0	0	0	110.2	Y29 Y47 S51 R52 F53	Y29-L49 HydrophobicContact CD1-CD1 4.39Å; Y29-L49 HydrophobicContact CE1-CD1 4.37Å; Y47-L49 PolarHBondContact O-N 3.14Å; L49-S51 WeakPolarHBondContact CG-OG 3.46Å; L49-S51 PolarHBondContact O-N 3.06Å; L49-S51 VanDerWaalsContact O-N 3.16Å; L49-R52 HydrophobicContact CB-CG 4.31Å; L49-R52 HydrophobicContact CD2-CG 3.81Å; L49-R52 HydrophobicContact CG-CG 4.13Å; L49-R52 WeakPolarHBondContact O-CB 3.44Å; L49-R52 PolarHBondContact O-N 2.73Å; L49-F53 WeakPolarHBondContact O-CD2 3.34Å
50	V	83	Confident	84.3	Confident	21 Å²	21	81.8 Å²	81.8	13%	0.127	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-57.6	-34.9	-172.4	170.6	0	0	0	0	112.4	Q28 Y29 V31 T48 R52 F53 V54 L57	Q28-V50 HydrophobicContact CG-CG2 4.34Å; Y29-V50 PolarHBondContact O-N 2.76Å; V31-V50 HydrophobicContact CG2-CG2 3.94Å; T48-V50 PolarHBondContact O-N 3.16Å; V50-R52 PolarHBondContact O-N 2.89Å; V50-F53 PolarHBondContact O-N 3.1Å; V50-V54 PolarHBondContact O-N 2.88Å; V50-L57 HydrophobicContact CG1-CD1 4.28Å
51	S	84	Confident	84.2	Confident	79 Å²	79	81.8 Å²	81.8	55%	0.552	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-59.6	-22.2	179.6	63.3	0	0	0	0	114.1	L49 F53	L49-S51 WeakPolarHBondContact CG-OG 3.46Å; L49-S51 PolarHBondContact O-N 3.06Å; L49-S51 VanDerWaalsContact O-N 3.16Å; S51-F53 VanDerWaalsContact C-N 3.3Å
52	R	85	Confident	84.4	Confident	205 Å²	205	79.8 Å²	79.8	77%	0.774	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-76.3	-16.4	175.4	-67	-67.8	-171.4	178.2	1.4	113.7	L49 V50	L49-R52 HydrophobicContact CB-CG 4.31Å; L49-R52 HydrophobicContact CD2-CG 3.81Å; L49-R52 HydrophobicContact CG-CG 4.13Å; L49-R52 WeakPolarHBondContact O-CB 3.44Å; L49-R52 PolarHBondContact O-N 2.73Å; V50-R52 PolarHBondContact O-N 2.89Å
53	F	83.2	Confident	84.6	Confident	60 Å²	60	81.6 Å²	81.6	26%	0.263	40%	0.4	S	S	.	.	S	Bend	trans	-114.6	6.1	-173	-63.3	-90.5	0	0	0	112.8	T48 L49 V50 S51 D55 W56 L57 E160	T48-F53 HydrophobicContact CG2-CD2 3.91Å; T48-F53 HydrophobicContact CG2-CE2 3.44Å; T48-F53 VanDerWaalsContact CG2-CE2 3.44Å; T48-F53 HydrophobicContact CG2-CZ 4.13Å; L49-F53 WeakPolarHBondContact O-CD2 3.34Å; V50-F53 PolarHBondContact O-N 3.1Å; S51-F53 VanDerWaalsContact C-N 3.3Å; F53-D55 VanDerWaalsContact C-N 3.34Å; F53-D55 PolarHBondContact O-N 3.26Å; F53-W56 HydrophobicContact CB-CE3 4.28Å; F53-W56 PolarHBondContact O-N 3.01Å; F53-L57 WeakPolarHBondContact O-CB 3.35Å; F53-L57 WeakPolarHBondContact O-CG 3.08Å; F53-L57 PolarHBondContact O-N 3.21Å; F53-E160 WeakPolarHBondContact CE1-OE1 3.32Å
54	V	81.9	Confident	84.6	Confident	53 Å²	53	81.7 Å²	81.7	32%	0.321	41%	0.407	S	S	.	.	H	α-helix	trans	-58.8	-42.7	-176.6	172.8	0	0	0	0	112.3	V50 W56 L57 K58	V50-V54 PolarHBondContact O-N 2.88Å; V54-W56 VanDerWaalsContact C-N 3.34Å; V54-L57 PolarHBondContact O-N 2.85Å; V54-K58 HydrophobicContact CG1-CD 4.14Å; V54-K58 VanDerWaalsContact O-CG 3.32Å; V54-K58 WeakPolarHBondContact O-CG 3.44Å; V54-K58 PolarHBondContact O-N 3.09Å
55	D	85.8	Confident	84.5	Confident	131 Å²	131	85.9 Å²	85.9	70%	0.701	43%	0.433	S	S	*	.	H	α-helix	trans	-67.8	-37.6	179.8	-65.7	-26.8	0	0	0	111.8	F53 K59	F53-D55 VanDerWaalsContact C-N 3.34Å; F53-D55 PolarHBondContact O-N 3.26Å; D55-K59 WeakPolarHBondContact O-CB 3.49Å; D55-K59 PolarHBondContact O-N 3.27Å
56	W	88.1	Confident	84	Confident	125 Å²	125	90.4 Å²	90.4	47%	0.473	47%	0.469	S	S	.	.	H	α-helix	trans	-65.5	-47.2	173.4	171.7	77.2	0	0	0	111.2	F53 V54 K58 K59 E60	F53-W56 HydrophobicContact CB-CE3 4.28Å; F53-W56 PolarHBondContact O-N 3.01Å; V54-W56 VanDerWaalsContact C-N 3.34Å; W56-K58 VanDerWaalsContact C-N 3.34Å; W56-K58 PolarHBondContact O-N 3.36Å; W56-K59 WeakPolarHBondContact O-CB 3.15Å; W56-K59 PolarHBondContact O-N 3.07Å; W56-K59 VanDerWaalsContact O-N 3.08Å; W56-E60 HydrophobicContact CD2-CG 4.2Å; W56-E60 HydrophobicContact CG-CG 4.49Å; W56-E60 HydrophobicContact CZ2-CG 3.86Å; W56-E60 WeakPolarHBondContact O-CG 3.36Å; W56-E60 PolarHBondContact O-N 3.19Å
57	L	81.7	Confident	83	Confident	68 Å²	68	91 Å²	91	36%	0.356	48%	0.475	S	S	.	.	H	α-helix	trans	-55.5	-48.6	176.8	-76.5	168.3	0	0	0	111.3	V50 F53 V54 K59 E60 E61	V50-L57 HydrophobicContact CG1-CD1 4.28Å; F53-L57 WeakPolarHBondContact O-CB 3.35Å; F53-L57 WeakPolarHBondContact O-CG 3.08Å; F53-L57 PolarHBondContact O-N 3.21Å; V54-L57 PolarHBondContact O-N 2.85Å; L57-K59 VanDerWaalsContact C-N 3.3Å; L57-K59 PolarHBondContact O-N 2.78Å; L57-E60 PolarHBondContact O-N 2.88Å; L57-E61 WeakPolarHBondContact O-CB 3.27Å; L57-E61 PolarHBondContact O-N 2.77Å
58	K	82.4	Confident	81.3	Confident	124 Å²	124	93.7 Å²	93.7	54%	0.539	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-39.6	177	-74.1	174.1	178.4	176.6	0	112.5	V54 W56 A62	V54-K58 HydrophobicContact CG1-CD 4.14Å; V54-K58 VanDerWaalsContact O-CG 3.32Å; V54-K58 WeakPolarHBondContact O-CG 3.44Å; V54-K58 PolarHBondContact O-N 3.09Å; W56-K58 VanDerWaalsContact C-N 3.34Å; W56-K58 PolarHBondContact O-N 3.36Å; K58-A62 WeakPolarHBondContact O-CB 3.35Å; K58-A62 PolarHBondContact O-N 2.94Å; K58-A62 VanDerWaalsContact O-N 3.07Å
59	K	86.9	Confident	79.6	Confident	137 Å²	137	93.6 Å²	93.6	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-66.3	-40.7	178.2	-179.4	-178.9	176.6	-177.9	0	111.7	D55 W56 L57	D55-K59 WeakPolarHBondContact O-CB 3.49Å; D55-K59 PolarHBondContact O-N 3.27Å; W56-K59 WeakPolarHBondContact O-CB 3.15Å; W56-K59 PolarHBondContact O-N 3.07Å; W56-K59 VanDerWaalsContact O-N 3.08Å; L57-K59 VanDerWaalsContact C-N 3.3Å; L57-K59 PolarHBondContact O-N 2.78Å
60	E	86.1	Confident	77.8	Confident	62 Å²	62	99.2 Å²	99.2	29%	0.29	53%	0.528	S	S	.	.	H	α-helix	trans	-72.9	-40.5	177.8	-62.7	-49.5	131.1	0	0	111.5	W56 L57 A62 K63	W56-E60 HydrophobicContact CD2-CG 4.2Å; W56-E60 HydrophobicContact CG-CG 4.49Å; W56-E60 HydrophobicContact CZ2-CG 3.86Å; W56-E60 WeakPolarHBondContact O-CG 3.36Å; W56-E60 PolarHBondContact O-N 3.19Å; L57-E60 PolarHBondContact O-N 2.88Å; E60-A62 VanDerWaalsContact C-N 3.28Å; E60-A62 PolarHBondContact O-N 2.82Å; E60-K63 WeakPolarHBondContact O-CB 3.42Å; E60-K63 PolarHBondContact O-N 3.22Å; E60-K63 IonicContact OE1-NZ 2.68Å; E60-K63 PolarHBondContact OE1-NZ 2.9Å; E60-K63 WeakPolarHBondContact OE2-CE 3.5Å; E60-K63 IonicContact OE2-NZ 2.7Å; E60-K63 PolarHBondContact OE2-NZ 2.81Å
61	E	80	Confident	76.4	Confident	109 Å²	109	102.6 Å²	102.6	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-56.2	-42.4	174	-175.1	-177.6	-174.3	0	0	111.7	L57 K63 L64	L57-E61 WeakPolarHBondContact O-CB 3.27Å; L57-E61 PolarHBondContact O-N 2.77Å; E61-K63 PolarHBondContact O-N 3.47Å; E61-K63 VanDerWaalsContact O-N 3.14Å; E61-L64 WeakPolarHBondContact O-CB 3.36Å; E61-L64 PolarHBondContact O-N 3.06Å
62	A	86.5	Confident	74.8	Confident	88 Å²	88	105 Å²	105	73%	0.727	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-17.5	178.4	0	0	0	0	0	114.4	K58 E60	K58-A62 WeakPolarHBondContact O-CB 3.35Å; K58-A62 PolarHBondContact O-N 2.94Å; K58-A62 VanDerWaalsContact O-N 3.07Å; E60-A62 VanDerWaalsContact C-N 3.28Å; E60-A62 PolarHBondContact O-N 2.82Å
63	K	87	Confident	73.3	Confident	126 Å²	126	100 Å²	100	55%	0.548	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-18.3	174.9	-59	175.8	-162.6	165.2	0	112.3	E60 E61	E60-K63 WeakPolarHBondContact O-CB 3.42Å; E60-K63 PolarHBondContact O-N 3.22Å; E60-K63 IonicContact OE1-NZ 2.68Å; E60-K63 PolarHBondContact OE1-NZ 2.9Å; E60-K63 WeakPolarHBondContact OE2-CE 3.5Å; E60-K63 IonicContact OE2-NZ 2.7Å; E60-K63 PolarHBondContact OE2-NZ 2.81Å; E61-K63 PolarHBondContact O-N 3.47Å; E61-K63 VanDerWaalsContact O-N 3.14Å
64	L	79.9	Confident	71.6	Confident	103 Å²	103	106.5 Å²	106.5	54%	0.539	57%	0.569	S	S	.	*	S	Bend	trans	-77.9	141.2	-179	-60.1	176.3	0	0	0	109.3	E61	E61-L64 WeakPolarHBondContact O-CB 3.36Å; E61-L64 PolarHBondContact O-N 3.06Å
65	P	82.2	Confident	70	Confident	100 Å²	100	110.7 Å²	110.7	65%	0.649	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-60.2	143.1	172.3	26	-32.6	0	0	0	109.2	S67	P65-S67 PolarHBondContact O-N 2.71Å
66	A	73.6	Confident	68.5	Low	103 Å²	103	107.6 Å²	107.6	85%	0.851	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-53.4	117.3	175.3	0	0	0	0	0	109.1	S68	A66-S68 PolarHBondContact O-N 3.26Å
67	S	65.5	Low	67.1	Low	34 Å²	34	105.9 Å²	105.9	24%	0.238	57%	0.571	C	S	.	*			trans	-63.9	115.3	177.2	39.4	0	0	0	0	109.7	P65 P144 V146	P65-S67 PolarHBondContact O-N 2.71Å; S67-P144 WeakPolarHBondContact CB-O 3.43Å; S67-P144 WeakPolarHBondContact O-CG 3.36Å; S67-P144 PolarHBondContact OG-O 3.06Å; S67-V146 VanDerWaalsContact CA-CG2 3.44Å
68	S	50.7	Low	65.9	Low	119 Å²	119	107.6 Å²	107.6	83%	0.832	58%	0.581	S	S	*	*			trans	-95.6	101.9	169.8	-167.4	0	0	0	0	109	A66	A66-S68 PolarHBondContact O-N 3.26Å
69	G	51.2	Low	64.6	Low	42 Å²	42	105.8 Å²	105.8	43%	0.433	58%	0.584	S	S	.	*	S	Bend	trans	126.9	142	168.4	0	0	0	0	0	115.1	P144	G69-P144 WeakPolarHBondContact O-CB 3.42Å
70	Y	48.7	Very low	62.8	Low	194 Å²	194	107.1 Å²	107.1	76%	0.761	59%	0.592	S	S	*	*			trans	-70	128.2	171.2	-118.3	-93.8	0	0	0	109.8
71	V	54.5	Low	60.8	Low	93 Å²	93	107.4 Å²	107.4	56%	0.564	61%	0.612	S	S	*	*			trans	-85.8	115.3	163.1	-179.3	0	0	0	0	106.3	V145	V71-V145 WeakPolarHBondContact CG2-O 3.03Å
72	E	49.9	Very low	59	Low	130 Å²	130	108 Å²	108	61%	0.607	62%	0.618	S	S	*	*			trans	-52.7	134.6	171.9	-83.7	-102.9	147.3	0	0	108.6	Y74 K75	E72-Y74 PolarHBondContact O-N 3.37Å; E72-K75 IonicContact OE2-NZ 2.76Å; E72-K75 PolarHBondContact OE2-NZ 3.12Å
73	P	53.1	Low	56.7	Low	99 Å²	99	108.9 Å²	108.9	64%	0.643	62%	0.616	S	S	*	*			trans	-49.3	137.5	171.9	-22.1	30.4	0	0	0	108.9	K75	P73-K75 VanDerWaalsContact C-N 3.35Å; P73-K75 PolarHBondContact O-N 3.43Å
74	Y	48.3	Very low	54.2	Low	197 Å²	197	112.3 Å²	112.3	77%	0.773	63%	0.631	S	S	*	*			trans	-53.1	101.8	176.8	178	-97.6	0	0	0	109.2	E72 N76	E72-Y74 PolarHBondContact O-N 3.37Å; Y74-N76 HydrophobicContact CE1-CB 4.15Å; Y74-N76 PolarHBondContact O-N 2.85Å
75	K	48.3	Very low	52	Low	141 Å²	141	112 Å²	112	61%	0.613	64%	0.635	S	S	*	*			trans	-76.2	109.3	171.1	-82.2	175.8	177.1	147.7	0	105.5	E72 P73 P77	E72-K75 IonicContact OE2-NZ 2.76Å; E72-K75 PolarHBondContact OE2-NZ 3.12Å; P73-K75 VanDerWaalsContact C-N 3.35Å; P73-K75 PolarHBondContact O-N 3.43Å; K75-P77 WeakPolarHBondContact O-CD 3.4Å
76	N	55	Low	49.6	Very low	66 Å²	66	112.3 Å²	112.3	35%	0.353	65%	0.646	S	S	.	*			trans	-60.2	112.3	171.3	-177.2	-2.4	0	0	0	107.5	Y74 D78 S79	Y74-N76 HydrophobicContact CE1-CB 4.15Å; Y74-N76 PolarHBondContact O-N 2.85Å; N76-D78 PolarHBondContact O-N 3.47Å; N76-D78 WeakPolarHBondContact OD1-CB 3.43Å; N76-D78 PolarHBondContact OD1-N 2.86Å; N76-D78 PolarHBondContact OD1-OD2 2.91Å; N76-S79 PolarHBondContact O-N 3.44Å; N76-S79 PolarHBondContact O-OG 2.76Å
77	P	56.6	Low	47.5	Very low	88 Å²	88	110.2 Å²	110.2	57%	0.571	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-59.4	-19.2	-178.9	24.6	-33.2	0	0	0	112.1	K75	K75-P77 WeakPolarHBondContact O-CD 3.4Å
78	D	58.1	Low	45.9	Very low	105 Å²	105	116.8 Å²	116.8	56%	0.561	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-84.8	-9.4	-179	-47.1	-27.6	0	0	0	113.3	N76	N76-D78 PolarHBondContact O-N 3.47Å; N76-D78 WeakPolarHBondContact OD1-CB 3.43Å; N76-D78 PolarHBondContact OD1-N 2.86Å; N76-D78 PolarHBondContact OD1-OD2 2.91Å
79	S	53.9	Low	44.8	Very low	86 Å²	86	116.2 Å²	116.2	60%	0.601	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-83.8	-17.8	179.7	64.7	0	0	0	0	113.7	N76 G81	N76-S79 PolarHBondContact O-N 3.44Å; N76-S79 PolarHBondContact O-OG 2.76Å; S79-G81 PolarHBondContact O-N 3.15Å
80	E	50.3	Low	43.8	Very low	165 Å²	165	121 Å²	121	77%	0.771	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	72.4	173	-64.6	-87.3	161.6	0	0	109.3
81	G	43	Very low	42.8	Very low	68 Å²	68	116 Å²	116	70%	0.701	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	74	37.7	158.8	0	0	0	0	0	117.8	S79 P83	S79-G81 PolarHBondContact O-N 3.15Å; G81-P83 VanDerWaalsContact O-CD 3.25Å; G81-P83 WeakPolarHBondContact O-CD 3.39Å
82	L	42.8	Very low	41.6	Very low	122 Å²	122	118 Å²	118	64%	0.639	67%	0.674	S	S	*	*			trans	-65.6	117.8	164.5	-155.4	73.8	0	0	0	108.9	K84	L82-K84 PolarHBondContact O-N 2.77Å
83	P	38.3	Very low	40.9	Very low	106 Å²	106	115.3 Å²	115.3	69%	0.688	68%	0.681	S	S	*	*			trans	-59.4	132.3	169	25	-29.8	0	0	0	106.9	G81	G81-P83 VanDerWaalsContact O-CD 3.25Å; G81-P83 WeakPolarHBondContact O-CD 3.39Å
84	K	34.8	Very low	39.9	Very low	197 Å²	197	117 Å²	117	86%	0.857	68%	0.684	S	S	*	*			trans	-37.9	122.1	173.6	-79.9	177.5	178.3	170.1	0	108	L82 A86	L82-K84 PolarHBondContact O-N 2.77Å; K84-A86 PolarHBondContact O-N 2.79Å
85	P	33.3	Very low	39	Very low	96 Å²	96	116.5 Å²	116.5	62%	0.623	69%	0.689	S	S	*	*			trans	-59.8	109.5	-173.6	20.8	-29.5	0	0	0	108.2	G87	P85-G87 PolarHBondContact O-N 2.79Å
86	A	31.9	Very low	38.4	Very low	107 Å²	107	114.7 Å²	114.7	88%	0.884	69%	0.685	S	S	*	*	S	Bend	trans	-72.4	104.2	164.8	0	0	0	0	0	105.7	K84	K84-A86 PolarHBondContact O-N 2.79Å
87	G	29	Very low	37.3	Very low	60 Å²	60	116.2 Å²	116.2	62%	0.619	70%	0.699	S	S	*	*			trans	91.9	88.5	175.7	0	0	0	0	0	113.4	P85 S89	P85-G87 PolarHBondContact O-N 2.79Å; G87-S89 PolarHBondContact O-N 3.02Å
88	F	33.1	Very low	36	Very low	172 Å²	172	118.5 Å²	118.5	75%	0.754	72%	0.717	S	S	*	*			trans	-64.4	89.8	144.9	-125.6	-91	0	0	0	107	F90	F88-F90 HydrophobicContact CD1-CD2 4.06Å; F88-F90 HydrophobicContact CD1-CE1 4.48Å; F88-F90 AromaticContact CD1-CE2 3.6Å; F88-F90 HydrophobicContact CD1-CE2 3.6Å; F88-F90 AromaticContact CD1-CZ 3.84Å; F88-F90 HydrophobicContact CD1-CZ 3.84Å; F88-F90 HydrophobicContact CE1-CE1 4.3Å; F88-F90 HydrophobicContact CE1-CE2 4.11Å; F88-F90 AromaticContact CE1-CZ 3.84Å; F88-F90 HydrophobicContact CE1-CZ 3.84Å
89	S	27.6	Very low	34.9	Very low	107 Å²	107	117.2 Å²	117.2	75%	0.748	73%	0.729	S	S	*	*			trans	-86.1	103	163.5	61.4	0	0	0	0	107.3	G87	G87-S89 PolarHBondContact O-N 3.02Å
90	F	30.2	Very low	34.2	Very low	143 Å²	143	119.5 Å²	119.5	63%	0.627	73%	0.728	S	S	*	*			trans	-62.3	134.2	164.5	-79.5	-87.8	0	0	0	107.9	F88 S92	F88-F90 HydrophobicContact CD1-CD2 4.06Å; F88-F90 HydrophobicContact CD1-CE1 4.48Å; F88-F90 AromaticContact CD1-CE2 3.6Å; F88-F90 HydrophobicContact CD1-CE2 3.6Å; F88-F90 AromaticContact CD1-CZ 3.84Å; F88-F90 HydrophobicContact CD1-CZ 3.84Å; F88-F90 HydrophobicContact CE1-CE1 4.3Å; F88-F90 HydrophobicContact CE1-CE2 4.11Å; F88-F90 AromaticContact CE1-CZ 3.84Å; F88-F90 HydrophobicContact CE1-CZ 3.84Å; F90-S92 PolarHBondContact O-N 3.13Å; F90-S92 VanDerWaalsContact O-N 3.15Å
91	P	27.7	Very low	33.6	Very low	88 Å²	88	120.4 Å²	120.4	57%	0.571	73%	0.732	S	S	*	*			trans	-58.5	124.5	168.5	25.4	-30.8	0	0	0	107.3	G93 L94	P91-G93 PolarHBondContact O-N 3.35Å; P91-L94 HydrophobicContact CG-CD1 3.97Å
92	S	27.7	Very low	33.3	Very low	135 Å²	135	120.7 Å²	120.7	94%	0.944	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	111	169.8	-52.8	0	0	0	0	107.3	F90	F90-S92 PolarHBondContact O-N 3.13Å; F90-S92 VanDerWaalsContact O-N 3.15Å
93	G	35.7	Very low	32.9	Very low	74 Å²	74	119 Å²	119	76%	0.763	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.1	6.2	177.4	0	0	0	0	0	117.5	P91 E95	P91-G93 PolarHBondContact O-N 3.35Å; G93-E95 PolarHBondContact O-N 3.03Å; G93-E95 VanDerWaalsContact O-N 3.13Å
94	L	33.3	Very low	32.8	Very low	135 Å²	135	120.4 Å²	120.4	71%	0.707	73%	0.726	S	S	*	*			trans	-78.5	94.2	167.1	-112.9	93.4	0	0	0	110.3	P91 L96	P91-L94 HydrophobicContact CG-CD1 3.97Å; L94-L96 PolarHBondContact O-N 3.4Å
95	E	29.1	Very low	33.1	Very low	186 Å²	186	117 Å²	117	87%	0.869	72%	0.722	S	S	*	*			trans	-70.2	114.5	162.3	-70.1	-175.2	145.1	0	0	108.6	G93	G93-E95 PolarHBondContact O-N 3.03Å; G93-E95 VanDerWaalsContact O-N 3.13Å
96	L	35.1	Very low	33.4	Very low	102 Å²	102	117.9 Å²	117.9	53%	0.534	72%	0.716	S	S	.	*			trans	-66	129.6	167.4	-86	147.8	0	0	0	108.2	L94 S98 F100	L94-L96 PolarHBondContact O-N 3.4Å; L96-S98 PolarHBondContact O-N 3.37Å; L96-F100 HydrophobicContact CD2-CB 3.81Å; L96-F100 HydrophobicContact CD2-CD1 3.41Å; L96-F100 VanDerWaalsContact CD2-CD1 3.41Å; L96-F100 HydrophobicContact CD2-CE1 4.1Å; L96-F100 HydrophobicContact CD2-CG 3.71Å
97	P	31.2	Very low	33.5	Very low	99 Å²	99	121.7 Å²	121.7	64%	0.643	72%	0.716	S	S	*	*			trans	-57.7	138.2	174.5	20.3	-28.3	0	0	0	109.7	G99 F100	P97-G99 PolarHBondContact O-N 3Å; P97-F100 PolarHBondContact O-N 3.23Å
98	S	29.1	Very low	33.9	Very low	135 Å²	135	122.4 Å²	122.4	94%	0.944	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	113.6	179.4	-43.6	0	0	0	0	109.8	L96	L96-S98 PolarHBondContact O-N 3.37Å
99	G	36.3	Very low	33.9	Very low	79 Å²	79	119.2 Å²	119.2	81%	0.814	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	120	-4.4	-179.8	0	0	0	0	0	115.9	P97 Q101	P97-G99 PolarHBondContact O-N 3Å; G99-Q101 PolarHBondContact O-N 3.01Å
100	F	38	Very low	34	Very low	134 Å²	134	122.5 Å²	122.5	59%	0.588	71%	0.711	S	S	*	*			trans	-78.3	102.3	172.7	-165.4	-94.1	0	0	0	111.2	L96 P97 L102	L96-F100 HydrophobicContact CD2-CB 3.81Å; L96-F100 HydrophobicContact CD2-CD1 3.41Å; L96-F100 VanDerWaalsContact CD2-CD1 3.41Å; L96-F100 HydrophobicContact CD2-CE1 4.1Å; L96-F100 HydrophobicContact CD2-CG 3.71Å; P97-F100 PolarHBondContact O-N 3.23Å; F100-L102 HydrophobicContact CD1-CG 4.42Å; F100-L102 HydrophobicContact CE1-CG 4.12Å
101	Q	37.7	Very low	34.3	Very low	183 Å²	183	119.4 Å²	119.4	86%	0.855	72%	0.719	S	S	*	*			trans	-94.3	112.5	178	-154.6	157.6	-77.2	0	0	109.8	G99	G99-Q101 PolarHBondContact O-N 3.01Å
102	L	37.8	Very low	34.5	Very low	74 Å²	74	121.2 Å²	121.2	39%	0.387	72%	0.723	S	S	.	*			trans	-66.4	139.4	173.2	-87.5	126.2	0	0	0	110.5	F100 F106	F100-L102 HydrophobicContact CD1-CG 4.42Å; F100-L102 HydrophobicContact CE1-CG 4.12Å; L102-F106 HydrophobicContact CB-CB 4.48Å; L102-F106 HydrophobicContact CD2-CB 3.84Å; L102-F106 HydrophobicContact CD2-CD1 3.58Å; L102-F106 HydrophobicContact CD2-CD2 3.79Å; L102-F106 HydrophobicContact CD2-CE1 3.99Å; L102-F106 HydrophobicContact CD2-CE2 4.2Å; L102-F106 HydrophobicContact CD2-CG 3.45Å; L102-F106 VanDerWaalsContact CD2-CG 3.45Å; L102-F106 HydrophobicContact CD2-CZ 4.28Å
103	P	34.6	Very low	34.6	Very low	86 Å²	86	123.9 Å²	123.9	56%	0.558	72%	0.721	S	S	*	*			trans	-61.9	142.6	174.3	23.4	-30.1	0	0	0	110.2	T105 F106	P103-T105 PolarHBondContact O-N 3.21Å; P103-F106 WeakPolarHBondContact O-CB 3Å; P103-F106 PolarHBondContact O-N 3.07Å
104	S	35.4	Very low	34.5	Very low	136 Å²	136	125.7 Å²	125.7	95%	0.951	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-0.5	-173.8	28.7	0	0	0	0	115.4
105	T	41.7	Very low	34.3	Very low	127 Å²	127	124.2 Å²	124.2	78%	0.779	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-5.2	171.8	51.9	0	0	0	0	113.4	P103 Q107	P103-T105 PolarHBondContact O-N 3.21Å; T105-Q107 PolarHBondContact O-N 2.77Å; T105-Q107 VanDerWaalsContact O-N 3.17Å
106	F	39.5	Very low	34.1	Very low	114 Å²	114	118.6 Å²	118.6	50%	0.5	72%	0.72	S	S	.	*			trans	-80.4	96.3	175.9	-162.5	-94.8	0	0	0	110.1	L102 P103 L108	L102-F106 HydrophobicContact CB-CB 4.48Å; L102-F106 HydrophobicContact CD2-CB 3.84Å; L102-F106 HydrophobicContact CD2-CD1 3.58Å; L102-F106 HydrophobicContact CD2-CD2 3.79Å; L102-F106 HydrophobicContact CD2-CE1 3.99Å; L102-F106 HydrophobicContact CD2-CE2 4.2Å; L102-F106 HydrophobicContact CD2-CG 3.45Å; L102-F106 VanDerWaalsContact CD2-CG 3.45Å; L102-F106 HydrophobicContact CD2-CZ 4.28Å; P103-F106 WeakPolarHBondContact O-CB 3Å; P103-F106 PolarHBondContact O-N 3.07Å; F106-L108 HydrophobicContact CD1-CD2 4.48Å; F106-L108 HydrophobicContact CD1-CG 4.24Å; F106-L108 HydrophobicContact CE1-CD2 4.23Å; F106-L108 HydrophobicContact CE1-CG 4.45Å; F106-L108 PolarHBondContact O-N 2.03Å
107	Q	34.6	Very low	33.6	Very low	186 Å²	186	120.5 Å²	120.5	87%	0.869	74%	0.737	S	S	*	*			trans	-71.6	108.9	170.5	-81.2	-170.4	-98.6	0	0	109.7	T105	T105-Q107 PolarHBondContact O-N 2.77Å; T105-Q107 VanDerWaalsContact O-N 3.17Å
108	L	37.4	Very low	33.2	Very low	75 Å²	75	120.5 Å²	120.5	39%	0.393	75%	0.745	S	S	.	*			trans	-65.1	135.5	168	-79.2	151.4	0	0	0	109.8	F106 L112	F106-L108 HydrophobicContact CD1-CD2 4.48Å; F106-L108 HydrophobicContact CD1-CG 4.24Å; F106-L108 HydrophobicContact CE1-CD2 4.23Å; F106-L108 HydrophobicContact CE1-CG 4.45Å; F106-L108 PolarHBondContact O-N 2.03Å; L108-L112 HydrophobicContact CB-CB 4.31Å; L108-L112 HydrophobicContact CD1-CB 4.4Å; L108-L112 HydrophobicContact CD1-CD2 4.27Å; L108-L112 HydrophobicContact CD2-CB 3.81Å; L108-L112 HydrophobicContact CD2-CD2 3.26Å; L108-L112 HydrophobicContact CD2-CG 4.13Å; L108-L112 HydrophobicContact CG-CB 4.39Å; L108-L112 HydrophobicContact CG-CD2 4.35Å
109	P	31.8	Very low	33	Very low	105 Å²	105	125.1 Å²	125.1	68%	0.682	74%	0.743	S	S	*	*			trans	-62.1	147	171.8	25.1	-30.2	0	0	0	109.7	G111	P109-G111 PolarHBondContact O-N 2.99Å
110	N	30.4	Very low	32.8	Very low	177 Å²	177	126.1 Å²	126.1	95%	0.947	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.7	110.1	-177.9	-67.5	-28	0	0	0	110.6
111	G	35.7	Very low	32.3	Very low	77 Å²	77	125.4 Å²	125.4	79%	0.794	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.3	-14.4	-179.6	0	0	0	0	0	116.2	P109	P109-G111 PolarHBondContact O-N 2.99Å
112	L	33.2	Very low	31.6	Very low	127 Å²	127	123.1 Å²	123.1	67%	0.665	75%	0.746	S	S	*	*			trans	-100.7	112.9	176.3	-142.7	74.3	0	0	0	111.5	L108	L108-L112 HydrophobicContact CB-CB 4.31Å; L108-L112 HydrophobicContact CD1-CB 4.4Å; L108-L112 HydrophobicContact CD1-CD2 4.27Å; L108-L112 HydrophobicContact CD2-CB 3.81Å; L108-L112 HydrophobicContact CD2-CD2 3.26Å; L108-L112 HydrophobicContact CD2-CG 4.13Å; L108-L112 HydrophobicContact CG-CB 4.39Å; L108-L112 HydrophobicContact CG-CD2 4.35Å
113	Q	28.9	Very low	31.1	Very low	191 Å²	191	124.1 Å²	124.1	89%	0.893	77%	0.765	S	S	*	*			trans	-85.9	126	174.3	-64.6	177.3	51.4	0	0	109.1
114	S	34.5	Very low	31	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	78%	0.775	S	S	*	*			trans	-78.3	120.6	166.4	56.2	0	0	0	0	109.2	G116	S114-G116 PolarHBondContact O-N 2.95Å; S114-G116 VanDerWaalsContact O-N 3.08Å
115	A	27.7	Very low	30.5	Very low	105 Å²	105	128.1 Å²	128.1	87%	0.868	77%	0.771	S	S	*	*			trans	-73	98.4	165.9	0	0	0	0	0	107.9
116	G	25.2	Very low	30	Very low	67 Å²	67	127.4 Å²	127.4	69%	0.691	77%	0.772	S	S	*	*			trans	-76.2	119.9	173.6	0	0	0	0	0	111	S114	S114-G116 PolarHBondContact O-N 2.95Å; S114-G116 VanDerWaalsContact O-N 3.08Å
117	T	25.1	Very low	29.6	Very low	143 Å²	143	127.6 Å²	127.6	88%	0.877	78%	0.784	S	S	*	*			trans	-135.8	129.3	143.4	42.1	0	0	0	0	108.6
118	A	23.7	Very low	29.1	Very low	99 Å²	99	126 Å²	126	82%	0.818	78%	0.78	S	S	*	*			trans	-74.7	136.2	-174.3	0	0	0	0	0	111.4
119	Y	23.5	Very low	28.5	Very low	231 Å²	231	130.8 Å²	130.8	91%	0.906	80%	0.798	S	S	*	*			trans	-142.4	122.6	157.8	-128.1	-94.1	0	0	0	110
120	S	31.5	Very low	28.2	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	81%	0.807	S	S	*	*			trans	-83	147.7	166.8	178.9	0	0	0	0	108.7
121	P	29.5	Very low	27.8	Very low	119 Å²	119	135.9 Å²	135.9	77%	0.773	80%	0.801	S	S	*	*				-147.7	155	122.8	32	-13.1	0	0	0	116.4
122	T	22.8	Very low	27.4	Very low	136 Å²	136	138.1 Å²	138.1	83%	0.834	80%	0.8	S	S	*	*			trans	-63.4	148.5	168.5	-8.5	0	0	0	0	113.6
123	A	26.8	Very low	26.9	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	81%	0.808	S	S	*	*			trans	90.6	150.6	158.7	0	0	0	0	0	119.8
124	P	31.9	Very low	26.8	Very low	120 Å²	120	132.3 Å²	132.3	78%	0.779	79%	0.793	S	S	*	*			trans	-102	146.3	-146.3	38.1	-31.3	0	0	0	113.9
125	Q	25.9	Very low	26.4	Very low	185 Å²	185	135.5 Å²	135.5	86%	0.864	80%	0.801	S	S	*	*			trans	-136.8	121.8	168.9	-64.1	-166.5	1.6	0	0	111
126	S	29.5	Very low	26.3	Very low	113 Å²	113	133.7 Å²	133.7	79%	0.79	79%	0.786	S	S	*	*			trans	-65.4	151.6	147.8	44.9	0	0	0	0	108.7
127	P	31.4	Very low	26.2	Very low	118 Å²	118	134.7 Å²	134.7	77%	0.766	78%	0.778	S	S	*	*				-146.9	157.1	107.2	33	-14.8	0	0	0	115.2
128	I	25.3	Very low	26.3	Very low	153 Å²	153	134 Å²	134	79%	0.785	77%	0.768	S	S	*	*			trans	-45.8	133.4	159.9	-63.7	152.3	0	0	0	110.7
129	F	23.8	Very low	26.4	Very low	174 Å²	174	130.9 Å²	130.9	76%	0.763	74%	0.742	S	S	*	*			trans	161.6	112.4	141.8	-105.1	-85.1	0	0	0	109.2
130	F	26	Very low	26.5	Very low	201 Å²	201	125.2 Å²	125.2	88%	0.882	73%	0.728	S	S	*	*			trans	-157.9	108.4	137.1	-94.7	-70.1	0	0	0	108.8
131	K	21.7	Very low	26.2	Very low	188 Å²	188	128 Å²	128	82%	0.817	73%	0.734	S	S	*	*			trans	-75	124.5	156.5	-77.9	180	170.3	-175.5	0	106.9
132	V	26.7	Very low	26	Very low	125 Å²	125	131 Å²	131	76%	0.758	74%	0.738	S	S	*	*			trans	-139.2	111.2	150.4	180	0	0	0	0	107.8
133	V	24.2	Very low	26	Very low	140 Å²	140	128.4 Å²	128.4	85%	0.848	72%	0.721	S	S	*	*			trans	-72.7	130.3	158.6	171.7	0	0	0	0	106.5
134	G	25.9	Very low	25.8	Very low	56 Å²	56	125.8 Å²	125.8	58%	0.577	70%	0.696	S	S	*	*			trans	175.3	79.1	177.2	0	0	0	0	0	112.2	A136	G134-A136 PolarHBondContact O-N 2.96Å
135	L	25.6	Very low	25.6	Very low	178 Å²	178	125.1 Å²	125.1	93%	0.932	69%	0.69	S	S	*	*			trans	-73.8	112	169.4	-164.1	87.3	0	0	0	109.1
136	A	25.6	Very low	25.5	Very low	67 Å²	67	119.2 Å²	119.2	55%	0.554	67%	0.667	S	S	*	*			trans	-176.7	132.6	161.3	0	0	0	0	0	106.7	G134	G134-A136 PolarHBondContact O-N 2.96Å
137	V	24.8	Very low	25.3	Very low	88 Å²	88	119.6 Å²	119.6	53%	0.533	67%	0.669	S	S	.	*			cis	-158.6	126.4	39.5	171.2	0	0	0	0	107.1	Q28	Q28-V137 PolarHBondContact OE1-O 3.37Å; Q28-V137 VanDerWaalsContact OE1-O 3.05Å
138	L	26	Very low	25	Very low	128 Å²	128	116.9 Å²	116.9	67%	0.67	66%	0.657	S	S	*	*			trans	-90.7	117.9	159.9	-88.8	160.5	0	0	0	107.8	Q28	Q28-L138 HydrophobicContact CB-CD2 3.83Å; Q28-L138 VanDerWaalsContact OE1-CG 3.26Å
139	A	25.7	Very low	24.9	Very low	33 Å²	33	113.6 Å²	113.6	27%	0.273	66%	0.661	S	S	.	*			trans	-80.6	134.6	166	0	0	0	0	0	109.3	V19 F26	V19-A139 HydrophobicContact CG1-CB 4.49Å; F26-A139 HydrophobicContact CB-CB 4.4Å
140	D	25.3	Very low	24.9	Very low	113 Å²	113	111.8 Å²	111.8	60%	0.604	66%	0.658	S	S	*	*	S	Bend	trans	56.5	69	161.2	-62.4	-33.8	0	0	0	118.6
141	L	26	Very low	24.7	Very low	159 Å²	159	111.6 Å²	111.6	83%	0.832	66%	0.66	S	S	*	*			trans	-136.1	137.9	133	-102.1	119.4	0	0	0	108.5	V143	L141-V143 HydrophobicContact CB-CG2 4.26Å; L141-V143 PolarHBondContact O-N 3.14Å
142	E	25.2	Very low	24.9	Very low	182 Å²	182	106.5 Å²	106.5	85%	0.85	64%	0.644	S	S	*	*	S	Bend	trans	-63.1	70	-179.2	-65.7	163.3	123.9	0	0	112.3
143	V	23.4	Very low	24.8	Very low	80 Å²	80	104.9 Å²	104.9	49%	0.485	64%	0.639	S	S	.	*			trans	-141.5	121	171.8	-126.7	0	0	0	0	108.2	L141	L141-V143 HydrophobicContact CB-CG2 4.26Å; L141-V143 PolarHBondContact O-N 3.14Å
144	P	22.8	Very low	24.9	Very low	40 Å²	40	107.5 Å²	107.5	26%	0.26	64%	0.642	S	S	.	*			trans	-68.7	142.1	179.5	22.5	-20.7	0	0	0	109.1	S67 G69	S67-P144 WeakPolarHBondContact CB-O 3.43Å; S67-P144 WeakPolarHBondContact O-CG 3.36Å; S67-P144 PolarHBondContact OG-O 3.06Å; G69-P144 WeakPolarHBondContact O-CB 3.42Å
145	V	26.8	Very low	24.9	Very low	106 Å²	106	111.9 Å²	111.9	64%	0.642	65%	0.652	S	S	*	*			trans	-108.8	108	167.2	175.8	0	0	0	0	107.4	V71	V71-V145 WeakPolarHBondContact CG2-O 3.03Å
146	V	24.3	Very low	24.9	Very low	62 Å²	62	108.6 Å²	108.6	38%	0.376	64%	0.639	S	S	.	*			trans	-77	119.8	172.3	161.7	0	0	0	0	108.1	S67 A148	S67-V146 VanDerWaalsContact CA-CG2 3.44Å; V146-A148 HydrophobicContact CG1-CB 4.24Å; V146-A148 PolarHBondContact O-N 2.73Å
147	S	25.2	Very low	24.8	Very low	121 Å²	121	112.4 Å²	112.4	85%	0.846	65%	0.647	S	S	*	*			trans	-70	83.4	163	157.6	0	0	0	0	108.5
148	A	24.6	Very low	24.9	Very low	61 Å²	61	115.3 Å²	115.3	50%	0.504	66%	0.658	S	S	.	*			trans	-86.4	124.9	159.8	0	0	0	0	0	107.8	V146 L150	V146-A148 HydrophobicContact CG1-CB 4.24Å; V146-A148 PolarHBondContact O-N 2.73Å; A148-L150 PolarHBondContact O-N 2.62Å; A148-L150 VanDerWaalsContact O-N 3.16Å
149	G	22.4	Very low	24.8	Very low	84 Å²	84	115.4 Å²	115.4	87%	0.866	66%	0.659	S	S	*	*			trans	-56.2	119.3	169	0	0	0	0	0	109.3
150	L	24	Very low	24.8	Very low	135 Å²	135	119.5 Å²	119.5	71%	0.707	67%	0.672	S	S	*	*			trans	-117.3	110.4	172.5	-163.6	70.4	0	0	0	107.7	A148 V152	A148-L150 PolarHBondContact O-N 2.62Å; A148-L150 VanDerWaalsContact O-N 3.16Å; L150-V152 PolarHBondContact O-N 2.85Å; L150-V152 VanDerWaalsContact O-N 3.14Å
151	E	22	Very low	25	Very low	197 Å²	197	120.2 Å²	120.2	92%	0.921	68%	0.681	S	S	*	*			trans	-58	109.8	160.8	-75.6	178.5	138.7	0	0	107.7	S153	E151-S153 PolarHBondContact O-N 3.01Å
152	V	25.7	Very low	24.9	Very low	81 Å²	81	115.9 Å²	115.9	49%	0.491	66%	0.658	S	S	.	*			trans	-84.8	108.2	173.3	180	0	0	0	0	107.5	L150 M157	L150-V152 PolarHBondContact O-N 2.85Å; L150-V152 VanDerWaalsContact O-N 3.14Å; V152-M157 HydrophobicContact CB-CE 4.21Å; V152-M157 HydrophobicContact CG1-CE 4.08Å
153	S	25.9	Very low	25.1	Very low	91 Å²	91	113.2 Å²	113.2	64%	0.636	65%	0.654	S	S	*	*			trans	-41.7	138	164.4	-171.9	0	0	0	0	111.3	E151 D155	E151-S153 PolarHBondContact O-N 3.01Å; S153-D155 PolarHBondContact O-N 2.73Å
154	E	26.3	Very low	25.2	Very low	196 Å²	196	115.4 Å²	115.4	92%	0.916	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	9.4	-168.4	-77.1	-172.7	130.2	0	0	117.2
155	D	24.9	Very low	25.4	Very low	148 Å²	148	116.9 Å²	116.9	79%	0.791	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	7.3	-169.1	-70.9	-33.9	0	0	0	116.5	S153	S153-D155 PolarHBondContact O-N 2.73Å
156	T	25.5	Very low	25.4	Very low	109 Å²	109	116 Å²	116	67%	0.669	68%	0.681	S	S	*	*	S	Bend	trans	-138.4	23.9	-169.7	-24.9	0	0	0	0	117.7
157	M	24.9	Very low	25.7	Very low	147 Å²	147	119.2 Å²	119.2	72%	0.724	70%	0.695	S	S	*	*	S	Bend	trans	-111.3	25.5	-178.3	-106.9	-165.4	-76.1	0	0	116.3	V152	V152-M157 HydrophobicContact CB-CE 4.21Å; V152-M157 HydrophobicContact CG1-CE 4.08Å
158	I	26.2	Very low	25.9	Very low	148 Å²	148	117 Å²	117	76%	0.759	69%	0.692	S	S	*	*			trans	-132.8	53.5	179.2	-41.2	177.1	0	0	0	111.6
159	L	23.1	Very low	26.1	Very low	131 Å²	131	119.7 Å²	119.7	69%	0.686	71%	0.707	S	S	*	*			trans	-132.3	6.9	177.6	-106.6	156.8	0	0	0	115.7
160	E	26.3	Very low	26.2	Very low	119 Å²	119	122.5 Å²	122.5	56%	0.556	71%	0.707	S	S	*	*	S	Bend	trans	-122.2	50.7	177	-75.4	-89.9	143.8	0	0	111	F53	F53-E160 WeakPolarHBondContact CE1-OE1 3.32Å
161	T	29.4	Very low	26.4	Very low	127 Å²	127	119.8 Å²	119.8	78%	0.779	71%	0.712	S	S	*	*	S	Bend	trans	-154	18.8	152.8	-30.1	0	0	0	0	111.4
162	L	24.3	Very low	26.7	Very low	68 Å²	68	113.9 Å²	113.9	36%	0.356	70%	0.704	S	S	.	*			trans	-131.6	50.1	-177.5	-62.5	177.7	0	0	0	111.1	L165	L162-L165 HydrophobicContact CD2-CB 3.5Å; L162-L165 VanDerWaalsContact CD2-CB 3.5Å; L162-L165 HydrophobicContact CD2-CD1 4.29Å; L162-L165 HydrophobicContact CD2-CG 4.5Å; L162-L165 WeakPolarHBondContact CD2-O 3.3Å
163	V	28.6	Very low	26.7	Very low	127 Å²	127	118.7 Å²	118.7	77%	0.77	73%	0.725	S	S	*	*	S	Bend	trans	-102.4	6.2	157.9	-178.9	0	0	0	0	111.1
164	D	26	Very low	26.9	Very low	125 Å²	125	120.2 Å²	120.2	67%	0.668	74%	0.736	S	S	*	*	S	Bend	trans	-151	33.2	164.1	-116.7	-18.4	0	0	0	114.7	Y232	D164-Y232 PolarHBondContact O-OH 2.91Å
165	L	26.7	Very low	27.1	Very low	72 Å²	72	114.1 Å²	114.1	38%	0.377	73%	0.725	S	S	.	*			trans	-134.6	100.5	160.2	-74.2	174.9	0	0	0	107.4	L162 L167 Y232	L162-L165 HydrophobicContact CD2-CB 3.5Å; L162-L165 VanDerWaalsContact CD2-CB 3.5Å; L162-L165 HydrophobicContact CD2-CD1 4.29Å; L162-L165 HydrophobicContact CD2-CG 4.5Å; L162-L165 WeakPolarHBondContact CD2-O 3.3Å; L165-L167 PolarHBondContact O-N 2.93Å; L165-Y232 HydrophobicContact CD2-CE2 4.1Å
166	G	26.2	Very low	27.3	Very low	87 Å²	87	115.8 Å²	115.8	90%	0.897	73%	0.733	S	S	*	*			trans	-63.7	86.9	165.1	0	0	0	0	0	109.9
167	L	32.6	Very low	27.4	Very low	130 Å²	130	114.7 Å²	114.7	68%	0.681	74%	0.744	S	S	*	*			trans	-111.2	81.1	160.5	-74.7	172.7	0	0	0	107.3	L165 S169	L165-L167 PolarHBondContact O-N 2.93Å; L167-S169 PolarHBondContact O-N 2.85Å
168	G	27.9	Very low	27.4	Very low	75 Å²	75	110.5 Å²	110.5	77%	0.773	74%	0.739	S	S	*	*			trans	-66.6	108.1	157.2	0	0	0	0	0	108.2	T170	G168-T170 PolarHBondContact O-N 2.82Å
169	S	28.7	Very low	27.7	Very low	117 Å²	117	114 Å²	114	82%	0.818	75%	0.749	S	S	*	*			trans	-79.3	109.8	162.9	175.7	0	0	0	0	107.9	L167	L167-S169 PolarHBondContact O-N 2.85Å
170	T	26.2	Very low	27.8	Very low	142 Å²	142	111.7 Å²	111.7	87%	0.871	76%	0.756	S	S	*	*			trans	-113.9	122.5	161.3	49	0	0	0	0	108.3	G168	G168-T170 PolarHBondContact O-N 2.82Å
171	G	27.2	Very low	28	Very low	78 Å²	78	109.8 Å²	109.8	80%	0.804	77%	0.769	S	S	*	*			trans	121.7	109.3	161.9	0	0	0	0	0	115.3
172	G	27.4	Very low	27.8	Very low	74 Å²	74	111.2 Å²	111.2	76%	0.763	77%	0.767	S	S	*	*			trans	147.5	51	154	0	0	0	0	0	118
173	I	26.9	Very low	28.2	Very low	181 Å²	181	115.3 Å²	115.3	93%	0.928	79%	0.789	S	S	*	*			trans	-109.1	107.9	150.1	58.9	162.5	0	0	0	109.3
174	S	28.9	Very low	28.2	Very low	123 Å²	123	115.4 Å²	115.4	86%	0.86	79%	0.785	S	S	*	*			trans	-120.8	107.1	164.7	49.7	0	0	0	0	106.5
175	G	31.7	Very low	28.4	Very low	68 Å²	68	119.8 Å²	119.8	70%	0.701	80%	0.798	S	S	*	*			trans	160.9	72.7	176.4	0	0	0	0	0	116.6
176	L	28.6	Very low	28.3	Very low	183 Å²	183	119.5 Å²	119.5	96%	0.958	81%	0.813	S	S	*	*			trans	57.7	116.8	136	-70.7	155.3	0	0	0	122.2
177	G	28.3	Very low	28.3	Very low	87 Å²	87	122.4 Å²	122.4	90%	0.897	81%	0.808	S	S	*	*			trans	87	130.2	150.8	0	0	0	0	0	114.4
178	G	25.1	Very low	28.2	Very low	59 Å²	59	126.7 Å²	126.7	61%	0.608	82%	0.821	S	S	*	*			cis	150.3	139.4	15.2	0	0	0	0	0	106.1
179	F	32	Very low	28.1	Very low	221 Å²	221	126 Å²	126	97%	0.969	82%	0.815	S	S	*	*			trans	74.3	128.9	-178	-48.5	-80.1	0	0	0	114.6
180	G	24.6	Very low	27.8	Very low	82 Å²	82	123.8 Å²	123.8	85%	0.845	81%	0.81	S	S	*	*			cis	134.5	108.2	13.9	0	0	0	0	0	108
181	G	30.4	Very low	28	Very low	80 Å²	80	127.4 Å²	127.4	83%	0.825	81%	0.814	S	S	*	*			trans	162.4	118.2	173.4	0	0	0	0	0	114.3
182	H	26.4	Very low	27.8	Very low	157 Å²	157	127.6 Å²	127.6	73%	0.727	82%	0.816	S	S	*	*			trans	-49.6	153.4	161.8	-115.6	75.2	0	0	0	109.9
183	D	31.3	Very low	27.6	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	82%	0.815	S	S	*	*				-160.7	158.1	80.8	-54.6	-37.3	0	0	0	112.8
184	D	29.1	Very low	27.5	Very low	129 Å²	129	124.3 Å²	124.3	69%	0.69	81%	0.809	S	S	*	*			trans	-64.3	139.1	-168.7	-60.1	-70	0	0	0	117.9
185	F	29.6	Very low	27.6	Very low	217 Å²	217	126.1 Å²	126.1	95%	0.952	81%	0.808	S	S	*	*			trans	-131.4	97.4	148.4	-98.5	-83.5	0	0	0	110.6
186	G	26	Very low	27.4	Very low	66 Å²	66	131.4 Å²	131.4	68%	0.68	82%	0.817	S	S	*	*			trans	-82.4	142.4	164.8	0	0	0	0	0	112.1
187	N	26.6	Very low	27.3	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	81%	0.812	S	S	*	*			trans	68.7	98.6	143.7	-159.7	46.8	0	0	0	119.3
188	F	30.1	Very low	27.3	Very low	219 Å²	219	129.2 Å²	129.2	96%	0.961	80%	0.8	S	S	*	*			trans	-132.7	102.6	138.4	-106.2	-87.7	0	0	0	109.3
189	G	24.2	Very low	27.6	Very low	62 Å²	62	135.5 Å²	135.5	64%	0.639	81%	0.811	S	S	*	*			trans	-85.3	146.5	161.5	0	0	0	0	0	110.9
190	G	24	Very low	27.4	Very low	69 Å²	69	129 Å²	129	71%	0.711	81%	0.806	S	S	*	*			trans	102.3	77.8	150.4	0	0	0	0	0	117.6
191	F	29.3	Very low	27.9	Very low	218 Å²	218	132.9 Å²	132.9	96%	0.956	80%	0.8	S	S	*	*			trans	-145.7	98.6	137.1	-103.5	-82.2	0	0	0	108.9
192	G	22.6	Very low	28	Very low	83 Å²	83	138.6 Å²	138.6	86%	0.856	80%	0.802	S	S	*	*			trans	-78.7	127.6	166	0	0	0	0	0	109.6
193	G	24.3	Very low	28.7	Very low	72 Å²	72	137.7 Å²	137.7	74%	0.742	81%	0.809	S	S	*	*			trans	-168.5	89.2	177.6	0	0	0	0	0	109.5	L195	G193-L195 PolarHBondContact O-N 3.03Å
194	S	24.4	Very low	29.3	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	80%	0.803	S	S	*	*			trans	-28	103.9	175.5	-165.7	0	0	0	0	116
195	L	31.7	Very low	29.8	Very low	161 Å²	161	135.9 Å²	135.9	84%	0.843	81%	0.807	S	S	*	*			trans	-151.7	22.7	159.8	-163.6	59.5	0	0	0	112.7	G193	G193-L195 PolarHBondContact O-N 3.03Å
196	M	27.3	Very low	30.2	Very low	179 Å²	179	132 Å²	132	88%	0.882	80%	0.804	S	S	*	*			trans	-124.2	10.8	-175.4	-74.1	-69.2	177.6	0	0	115.4
197	D	26.8	Very low	30.9	Very low	162 Å²	162	133 Å²	133	87%	0.866	81%	0.814	S	S	*	*	S	Bend	trans	-102	81.1	172.9	-69.5	-29.3	0	0	0	110.2
198	G	27.3	Very low	31.7	Very low	62 Å²	62	129.5 Å²	129.5	64%	0.639	80%	0.801	S	S	*	*	S	Bend	trans	-166.7	-24.4	177.8	0	0	0	0	0	118.7
199	F	31.3	Very low	32.5	Very low	191 Å²	191	128.4 Å²	128.4	84%	0.838	80%	0.796	S	S	*	*			trans	-115.9	75	-175	-74.6	-77.2	0	0	0	113.1	K201	F199-K201 PolarHBondContact O-N 3Å; F199-K201 VanDerWaalsContact O-N 3.16Å
200	G	27.2	Very low	33.3	Very low	83 Å²	83	130.2 Å²	130.2	86%	0.856	79%	0.794	S	S	*	*			trans	-68.9	100.9	157.5	0	0	0	0	0	110
201	K	36.8	Very low	34.2	Very low	165 Å²	165	131.9 Å²	131.9	72%	0.717	79%	0.791	S	S	*	*			trans	-125.2	118.9	163.5	-83.8	-170.6	177.3	179	0	110.9	F199	F199-K201 PolarHBondContact O-N 3Å; F199-K201 VanDerWaalsContact O-N 3.16Å
202	K	32.3	Very low	35.3	Very low	200 Å²	200	122.6 Å²	122.6	87%	0.87	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-66.8	142	164.1	-64	178	179.8	175.7	0	108.6	G204	K202-G204 PolarHBondContact O-N 3.15Å
203	P	40.2	Very low	36.4	Very low	137 Å²	137	122.2 Å²	122.2	89%	0.89	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-63.6	123.8	179.8	23.6	-31.3	0	0	0	111.1
204	G	43.4	Very low	37.4	Very low	67 Å²	67	122.2 Å²	122.2	69%	0.691	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-82.6	154.5	177.8	0	0	0	0	0	112.6	K202	K202-G204 PolarHBondContact O-N 3.15Å
205	K	39.5	Very low	38.3	Very low	178 Å²	178	120.7 Å²	120.7	77%	0.774	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-69.6	149	-178.9	-71.9	-179.3	177.4	-177.9	0	112.2	G207 S208	K205-G207 PolarHBondContact O-N 3.2Å; K205-S208 PolarHBondContact O-N 3.27Å; K205-S208 PolarHBondContact O-OG 3.18Å
206	P	38.8	Very low	39	Very low	137 Å²	137	114.6 Å²	114.6	89%	0.89	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	133	173.6	-20.2	30.8	0	0	0	111.4
207	G	41.7	Very low	39.9	Very low	85 Å²	85	109.2 Å²	109.2	88%	0.876	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.3	-2.1	-178.5	0	0	0	0	0	115.7	K205 K209	K205-G207 PolarHBondContact O-N 3.2Å; G207-K209 PolarHBondContact O-N 3.1Å
208	S	43.3	Very low	40.7	Very low	75 Å²	75	102.8 Å²	102.8	52%	0.524	62%	0.616	S	S	.	*			trans	-74.1	123	173.5	-45.8	0	0	0	0	110.3	K205 V210	K205-S208 PolarHBondContact O-N 3.27Å; K205-S208 PolarHBondContact O-OG 3.18Å; S208-V210 PolarHBondContact O-N 3.16Å; S208-V210 VanDerWaalsContact O-N 3.16Å
209	K	45.4	Very low	41.4	Very low	197 Å²	197	107.4 Å²	107.4	86%	0.857	62%	0.616	S	S	*	*			trans	-59.2	119	167.4	-80.9	-175	177.2	-178.6	0	108.4	G207 T211	G207-K209 PolarHBondContact O-N 3.1Å; K209-T211 PolarHBondContact O-N 3.38Å; K209-T211 VanDerWaalsContact O-N 3.14Å
210	V	42.5	Very low	42.2	Very low	99 Å²	99	100.6 Å²	100.6	60%	0.6	59%	0.588	S	S	*	*			trans	-70.5	108	175.2	179	0	0	0	0	107.2	S208	S208-V210 PolarHBondContact O-N 3.16Å; S208-V210 VanDerWaalsContact O-N 3.16Å
211	T	42.9	Very low	42.7	Very low	105 Å²	105	101 Å²	101	64%	0.644	59%	0.592	S	S	*	*			trans	-100.6	133.7	170.5	41.7	0	0	0	0	110.5	K209 Y232	K209-T211 PolarHBondContact O-N 3.38Å; K209-T211 VanDerWaalsContact O-N 3.14Å; T211-Y232 CarbonylContact C-O 3.58Å; T211-Y232 WeakPolarHBondContact CA-O 2.88Å
212	G	51.6	Low	43	Very low	22 Å²	22	102.5 Å²	102.5	23%	0.227	60%	0.599	C	S	.	*			trans	-145.4	174.5	-178.9	0	0	0	0	0	111.5	K231 Y232	G212-K231 WeakPolarHBondContact O-CA 3.45Å; G212-Y232 PolarHBondContact N-O 2.96Å; G212-Y232 PolarHBondContact O-N 3.08Å
213	S	46.1	Very low	43.3	Very low	75 Å²	75	95.4 Å²	95.4	52%	0.524	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-142.7	136.3	170	60.4	0	0	0	0	110.4	Y230	S213-Y230 CarbonylContact C-O 3.44Å; S213-Y230 WeakPolarHBondContact CA-O 3.04Å; S213-Y230 WeakPolarHBondContact CB-O 3.47Å
214	Y	44.8	Very low	43.3	Very low	73 Å²	73	95.7 Å²	95.7	29%	0.286	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.6	148.4	171.2	65.7	-90.1	0	0	0	110.1	F34 T229 Y230 Y232	F34-Y214 HydrophobicContact CE2-CE2 4.36Å; F34-Y214 HydrophobicContact CZ-CE2 4.35Å; Y214-T229 WeakPolarHBondContact O-CA 3.37Å; Y214-Y230 HydrophobicContact CD2-CD2 4.24Å; Y214-Y230 HydrophobicContact CE1-CG 4.43Å; Y214-Y230 AromaticContact CE2-CD2 3.6Å; Y214-Y230 HydrophobicContact CE2-CD2 3.6Å; Y214-Y230 HydrophobicContact CE2-CE2 4.5Å; Y214-Y230 AromaticContact CE2-CG 3.8Å; Y214-Y230 HydrophobicContact CE2-CG 3.8Å; Y214-Y230 AromaticContact CZ-CG 3.71Å; Y214-Y230 PolarHBondContact N-O 2.87Å; Y214-Y230 PolarHBondContact O-N 2.8Å; Y214-Y232 AromaticContact CD1-CD1 3.64Å; Y214-Y232 HydrophobicContact CD1-CD1 3.64Å; Y214-Y232 AromaticContact CD1-CE1 3.83Å; Y214-Y232 HydrophobicContact CD1-CE1 3.83Å; Y214-Y232 HydrophobicContact CE1-CD1 4.08Å
215	T	44.2	Very low	43.5	Very low	82 Å²	82	96 Å²	96	50%	0.503	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.4	117	-178.8	-64.6	0	0	0	0	109.1	T227 Q228 T229	T215-T227 HydrophobicContact CG2-CG2 3.13Å; T215-Q228 CarbonylContact C-O 3.52Å; T215-Q228 WeakPolarHBondContact CA-O 3.34Å; T215-T229 PolarHBondContact OG1-OG1 2.89Å; T215-T229 VanDerWaalsContact OG1-OG1 3.06Å
216	L	45.5	Very low	43.8	Very low	33 Å²	33	89.9 Å²	89.9	17%	0.173	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.9	175.8	-172	75.8	0	0	0	109.2	V46 T218 T227 Q228 Y230	V46-L216 HydrophobicContact CG1-CD1 3.95Å; V46-L216 HydrophobicContact CG2-CD1 4.13Å; V46-L216 HydrophobicContact CG2-CD2 3.78Å; L216-T218 HydrophobicContact CD2-CG2 3.91Å; L216-T218 HydrophobicContact CG-CG2 4.12Å; L216-T227 CarbonylContact O-C 3.44Å; L216-T227 WeakPolarHBondContact O-CA 3.25Å; L216-Q228 PolarHBondContact N-O 3.17Å; L216-Q228 PolarHBondContact O-N 3.19Å; L216-Y230 HydrophobicContact CB-CD2 4.38Å; L216-Y230 HydrophobicContact CB-CE2 4.1Å; L216-Y230 HydrophobicContact CD2-CE2 4.39Å
217	T	45.2	Very low	44.4	Very low	66 Å²	66	87.2 Å²	87.2	41%	0.405	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.5	169.5	-61	0	0	0	0	108.9	Y219 P225 T227	T217-Y219 HydrophobicContact CG2-CE2 4.39Å; T217-P225 HydrophobicContact CG2-CB 3.92Å; T217-T227 PolarHBondContact OG1-OG1 2.82Å
218	T	44.5	Very low	44.7	Very low	26 Å²	26	85.1 Å²	85.1	16%	0.16	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	170.5	169.6	60.5	0	0	0	0	109.4	L216 P225 I226	L216-T218 HydrophobicContact CD2-CG2 3.91Å; L216-T218 HydrophobicContact CG-CG2 4.12Å; T218-P225 CarbonylContact O-C 3.58Å; T218-P225 WeakPolarHBondContact O-CA 3.37Å; T218-I226 PolarHBondContact N-O 2.98Å; T218-I226 PolarHBondContact O-N 3.3Å; T218-I226 PolarHBondContact OG1-O 3.19Å
219	Y	41.7	Very low	45.2	Very low	160 Å²	160	85.9 Å²	85.9	63%	0.627	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.3	173.3	-66.1	-95.1	0	0	0	108.8	T217 G223 K224 P225	T217-Y219 HydrophobicContact CG2-CE2 4.39Å; Y219-G223 WeakPolarHBondContact CD1-O 3.28Å; Y219-K224 CarbonylContact C-O 3.51Å; Y219-K224 WeakPolarHBondContact CA-O 3.27Å; Y219-P225 HydrophobicContact CD1-CB 4.01Å; Y219-P225 HydrophobicContact CE1-CB 3.75Å; Y219-P225 HydrophobicContact CE1-CG 4.4Å
220	D	48.5	Very low	45.2	Very low	47 Å²	47	78.5 Å²	78.5	25%	0.251	45%	0.452	S	S	.	.			trans	-69.8	171.6	174.1	75.1	7.2	0	0	0	111.4	K222 G223 K224 I226	D220-K222 PolarHBondContact O-N 3.24Å; D220-K222 VanDerWaalsContact OD1-C 3.24Å; D220-K222 VanDerWaalsContact OD1-CA 3.25Å; D220-K222 WeakPolarHBondContact OD1-CA 3.43Å; D220-K222 WeakPolarHBondContact OD1-CB 3.41Å; D220-K222 PolarHBondContact OD1-N 2.84Å; D220-G223 PolarHBondContact O-N 3.24Å; D220-G223 PolarHBondContact OD1-N 2.84Å; D220-K224 PolarHBondContact N-O 3.05Å; D220-K224 WeakPolarHBondContact OD1-CB 3.36Å; D220-K224 PolarHBondContact OD1-N 2.98Å; D220-K224 WeakPolarHBondContact OD2-CB 3.25Å; D220-I226 HydrophobicContact CB-CD1 3.71Å; D220-I226 HydrophobicContact CB-CG1 4.44Å
221	G	37.3	Very low	45.9	Very low	91 Å²	91	82.9 Å²	82.9	94%	0.938	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	1.1	177	0	0	0	0	0	115
222	K	43.7	Very low	46.3	Very low	198 Å²	198	84 Å²	84	86%	0.861	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	7.7	174.1	-57.7	-178.6	-178.8	-178.8	0	112	D220 K224	D220-K222 PolarHBondContact O-N 3.24Å; D220-K222 VanDerWaalsContact OD1-C 3.24Å; D220-K222 VanDerWaalsContact OD1-CA 3.25Å; D220-K222 WeakPolarHBondContact OD1-CA 3.43Å; D220-K222 WeakPolarHBondContact OD1-CB 3.41Å; D220-K222 PolarHBondContact OD1-N 2.84Å; K222-K224 VanDerWaalsContact C-N 3.33Å
223	G	39	Very low	46.1	Very low	51 Å²	51	87.1 Å²	87.1	53%	0.526	47%	0.467	S	S	.	.	S	Bend	trans	77.6	10.6	-179.6	0	0	0	0	0	114.7	Y219 D220	Y219-G223 WeakPolarHBondContact CD1-O 3.28Å; D220-G223 PolarHBondContact O-N 3.24Å; D220-G223 PolarHBondContact OD1-N 2.84Å
224	K	39.9	Very low	46.1	Very low	143 Å²	143	87.7 Å²	87.7	62%	0.622	46%	0.464	S	S	*	.			trans	-79.8	130.6	175.1	-174.7	-174.2	175	-176.6	0	109.9	Y219 D220 K222	Y219-K224 CarbonylContact C-O 3.51Å; Y219-K224 WeakPolarHBondContact CA-O 3.27Å; D220-K224 PolarHBondContact N-O 3.05Å; D220-K224 WeakPolarHBondContact OD1-CB 3.36Å; D220-K224 PolarHBondContact OD1-N 2.98Å; D220-K224 WeakPolarHBondContact OD2-CB 3.25Å; K222-K224 VanDerWaalsContact C-N 3.33Å
225	P	46.7	Very low	46.1	Very low	73 Å²	73	88.6 Å²	88.6	47%	0.474	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	135.4	177.2	26.6	-32.9	0	0	0	111.5	T217 T218 Y219	T217-P225 HydrophobicContact CG2-CB 3.92Å; T218-P225 CarbonylContact O-C 3.58Å; T218-P225 WeakPolarHBondContact O-CA 3.37Å; Y219-P225 HydrophobicContact CD1-CB 4.01Å; Y219-P225 HydrophobicContact CE1-CB 3.75Å; Y219-P225 HydrophobicContact CE1-CG 4.4Å
226	I	46	Very low	46.3	Very low	50 Å²	50	88.9 Å²	88.9	26%	0.256	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	106.8	172	-62.8	175.7	0	0	0	107.3	L3 T218 D220	L3-I226 HydrophobicContact CD1-CD1 3.3Å; T218-I226 PolarHBondContact N-O 2.98Å; T218-I226 PolarHBondContact O-N 3.3Å; T218-I226 PolarHBondContact OG1-O 3.19Å; D220-I226 HydrophobicContact CB-CD1 3.71Å; D220-I226 HydrophobicContact CB-CG1 4.44Å
227	T	52.6	Low	46.3	Very low	80 Å²	80	92.4 Å²	92.4	49%	0.491	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.6	-178.3	-57.7	0	0	0	0	110.6	T215 L216 T217	T215-T227 HydrophobicContact CG2-CG2 3.13Å; L216-T227 CarbonylContact O-C 3.44Å; L216-T227 WeakPolarHBondContact O-CA 3.25Å; T217-T227 PolarHBondContact OG1-OG1 2.82Å
228	Q	47.5	Very low	46.4	Very low	42 Å²	42	94.2 Å²	94.2	20%	0.196	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.7	178.3	-67	-179.5	-17.5	0	0	109.6	N42 T215 L216 Y230	N42-Q228 PolarHBondContact O-NE2 2.93Å; T215-Q228 CarbonylContact C-O 3.52Å; T215-Q228 WeakPolarHBondContact CA-O 3.34Å; L216-Q228 PolarHBondContact N-O 3.17Å; L216-Q228 PolarHBondContact O-N 3.19Å; Q228-Y230 HydrophobicContact CB-CD2 4.4Å; Q228-Y230 HydrophobicContact CB-CE2 3.61Å; Q228-Y230 PolarHBondContact OE1-OH 2.94Å
229	T	52.9	Low	46.5	Very low	90 Å²	90	99.1 Å²	99.1	55%	0.552	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.8	177.1	-57.9	0	0	0	0	109.9	Y214 T215	Y214-T229 WeakPolarHBondContact O-CA 3.37Å; T215-T229 PolarHBondContact OG1-OG1 2.89Å; T215-T229 VanDerWaalsContact OG1-OG1 3.06Å
230	Y	45.9	Very low	46.9	Very low	42 Å²	42	94.4 Å²	94.4	17%	0.165	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.2	-179.8	-67.1	-91.8	0	0	0	109.1	Y43 S213 Y214 L216 Q228	Y43-Y230 HydrophobicContact CD1-CE1 4.02Å; Y43-Y230 WeakPolarHBondContact CD1-OH 3.44Å; Y43-Y230 AromaticContact CE1-CE1 3.87Å; Y43-Y230 HydrophobicContact CE1-CE1 3.87Å; S213-Y230 CarbonylContact C-O 3.44Å; S213-Y230 WeakPolarHBondContact CA-O 3.04Å; S213-Y230 WeakPolarHBondContact CB-O 3.47Å; Y214-Y230 HydrophobicContact CD2-CD2 4.24Å; Y214-Y230 HydrophobicContact CE1-CG 4.43Å; Y214-Y230 AromaticContact CE2-CD2 3.6Å; Y214-Y230 HydrophobicContact CE2-CD2 3.6Å; Y214-Y230 HydrophobicContact CE2-CE2 4.5Å; Y214-Y230 AromaticContact CE2-CG 3.8Å; Y214-Y230 HydrophobicContact CE2-CG 3.8Å; Y214-Y230 AromaticContact CZ-CG 3.71Å; Y214-Y230 PolarHBondContact N-O 2.87Å; Y214-Y230 PolarHBondContact O-N 2.8Å; L216-Y230 HydrophobicContact CB-CD2 4.38Å; L216-Y230 HydrophobicContact CB-CE2 4.1Å; L216-Y230 HydrophobicContact CD2-CE2 4.39Å; Q228-Y230 HydrophobicContact CB-CD2 4.4Å; Q228-Y230 HydrophobicContact CB-CE2 3.61Å; Q228-Y230 PolarHBondContact OE1-OH 2.94Å
231	K	57.8	Low	46.8	Very low	191 Å²	191	98.3 Å²	98.3	83%	0.83	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	139.6	173.8	-63.9	-176.2	180	-179.4	0	109.2	G212	G212-K231 WeakPolarHBondContact O-CA 3.45Å
232	Y	51.8	Low	47.6	Very low	129 Å²	129	99 Å²	99	51%	0.506	50%	0.498	S	S	.	.			trans	-129	0	172.6	62.1	-90	0	0	0	110.6	D164 L165 T211 G212 Y214	D164-Y232 PolarHBondContact O-OH 2.91Å; L165-Y232 HydrophobicContact CD2-CE2 4.1Å; T211-Y232 CarbonylContact C-O 3.58Å; T211-Y232 WeakPolarHBondContact CA-O 2.88Å; G212-Y232 PolarHBondContact N-O 2.96Å; G212-Y232 PolarHBondContact O-N 3.08Å; Y214-Y232 AromaticContact CD1-CD1 3.64Å; Y214-Y232 HydrophobicContact CD1-CD1 3.64Å; Y214-Y232 AromaticContact CD1-CE1 3.83Å; Y214-Y232 HydrophobicContact CD1-CE1 3.83Å; Y214-Y232 HydrophobicContact CE1-CD1 4.08Å

Retrieved 232 of 232 residues in 157.9 ms (Link to these results)

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