A0A087X7I0_POEFO Loading...

Uridine phosphorylase

Catalyzes the reversible phosphorylytic cleavage of uridine to uracil and ribose-1-phosphate which can then be utilized as carbon and energy sources or in the rescue of pyrimidine bases for nucleotide synthesis. Shows broad substrate specificity and can also accept deoxyuridine and other analogous compounds.

AlphaFold DB , UniProt , Accession A0A087X7I0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 320 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.4	Very low	36.9	Very low	238 Å²	238	152.5 Å²	152.5	100%	1.172	82%	0.823	S	S	*	*				0	108.7	0	-78.4	171.7	175.6	0	0	107.5
2	N	33.2	Very low	36.8	Very low	170 Å²	170	150 Å²	150	91%	0.909	81%	0.809	S	S	*	*			trans	-165.2	106	145.4	-98.1	-6.5	0	0	0	106.9
3	S	34	Very low	36.6	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	81%	0.808	S	S	*	*			trans	-71.9	144.3	-179.5	44.6	0	0	0	0	111.2
4	A	40.8	Very low	36.5	Very low	85 Å²	85	154.8 Å²	154.8	70%	0.702	81%	0.811	S	S	*	*			trans	-56.5	144.5	169.4	0	0	0	0	0	112.6
5	F	34.3	Very low	36.5	Very low	204 Å²	204	156 Å²	156	90%	0.895	81%	0.811	S	S	*	*			trans	-124.4	92.9	151.6	-96.7	-88.6	0	0	0	106.8
6	F	39.1	Very low	36.6	Very low	199 Å²	199	156.9 Å²	156.9	87%	0.873	81%	0.807	S	S	*	*			trans	-84.4	115.2	159.3	-99.4	-92.8	0	0	0	106.7
7	S	34.5	Very low	36.8	Very low	85 Å²	85	158.9 Å²	158.9	59%	0.594	81%	0.812	S	S	*	*			trans	-75.8	129.7	173.7	-176.1	0	0	0	0	109.5	M9	S7-M9 PolarHBondContact O-N 3.06Å
8	P	38.1	Very low	36.8	Very low	121 Å²	121	161.5 Å²	161.5	79%	0.786	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	36.1	-177.3	34	-34.1	0	0	0	113.3
9	M	39.3	Very low	37.1	Very low	153 Å²	153	162.6 Å²	162.6	75%	0.754	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-5.7	-177	-81.2	-174.9	173.4	0	0	115.3	S7	S7-M9 PolarHBondContact O-N 3.06Å
10	D	35.9	Very low	37.8	Very low	149 Å²	149	164.3 Å²	164.3	80%	0.797	82%	0.823	S	S	*	*	S	Bend	trans	-104.3	3.9	-174.8	-91.2	-25.3	0	0	0	115.4
11	M	32.7	Very low	38.9	Very low	167 Å²	167	161.8 Å²	161.8	82%	0.823	82%	0.821	S	S	*	*	S	Bend	trans	-100.4	-13.1	177.9	-91.9	179.8	47.3	0	0	114.5
12	D	36	Very low	40.5	Very low	122 Å²	122	153.6 Å²	153.6	65%	0.652	79%	0.787	S	S	*	*	S	Bend	trans	-99.5	4.6	-170.2	-132.7	6.2	0	0	0	113.9
13	Q	34.1	Very low	43	Very low	170 Å²	170	147.9 Å²	147.9	79%	0.794	76%	0.761	S	S	*	*	S	Bend	trans	-106.6	-3.8	177.7	-71.6	-169.3	-2.6	0	0	114.5
14	K	36.2	Very low	45.7	Very low	197 Å²	197	145.4 Å²	145.4	86%	0.857	74%	0.742	S	S	*	*	S	Bend	trans	-99	-2.8	178.1	-84.1	-176.4	177	176	0	115.2
15	E	35.9	Very low	48.2	Very low	173 Å²	173	141.7 Å²	141.7	81%	0.808	71%	0.71	S	S	*	*	S	Bend	trans	-114.8	11.1	-178.1	-73.9	-171.2	155.7	0	0	114.9
16	K	38.2	Very low	50.9	Low	171 Å²	171	137.5 Å²	137.5	74%	0.743	69%	0.689	S	S	*	*	S	Bend	trans	-116.3	17.4	-177.2	-88	-176.5	179.2	171.8	0	117.8
17	Q	39.1	Very low	53.6	Low	190 Å²	190	129.8 Å²	129.8	89%	0.888	66%	0.658	S	S	*	*			trans	-138.2	70.1	169.4	-75.2	-174.6	-4	0	0	112
18	K	37	Very low	56.4	Low	206 Å²	206	132.9 Å²	132.9	90%	0.896	66%	0.663	S	S	*	*			trans	-132.6	28.2	156.3	-114.2	-174	-174.8	-177.5	0	111.3	Q20	K18-Q20 PolarHBondContact O-N 3.29Å
19	E	42.5	Very low	59.2	Low	183 Å²	183	130.6 Å²	130.6	86%	0.855	64%	0.644	S	S	*	*	S	Bend	trans	-65.7	112.7	150.7	-81.9	-179.9	158.2	0	0	105.8	S21	E19-S21 VanDerWaalsContact C-N 3.31Å; E19-S21 PolarHBondContact O-N 3.12Å
20	Q	51.8	Low	61.8	Low	196 Å²	196	128.1 Å²	128.1	92%	0.916	64%	0.64	S	S	*	*			trans	-57.9	99.3	170.2	-82.6	172.7	-20.2	0	0	107.3	K18 S22	K18-Q20 PolarHBondContact O-N 3.29Å; Q20-S22 PolarHBondContact O-N 3.34Å
21	S	60.4	Low	64.8	Low	111 Å²	111	127.4 Å²	127.4	78%	0.776	63%	0.631	S	S	*	*			trans	-62.6	112.2	172.5	61.9	0	0	0	0	107.2	E19 S23	E19-S21 VanDerWaalsContact C-N 3.31Å; E19-S21 PolarHBondContact O-N 3.12Å; S21-S23 PolarHBondContact O-N 3.03Å
22	S	77.1	Confident	67.8	Low	66 Å²	66	119.9 Å²	119.9	46%	0.462	60%	0.595	S	S	.	*			trans	-54.7	130.6	177	58.6	0	0	0	0	109.9	Q20 P24 D139	Q20-S22 PolarHBondContact O-N 3.34Å; S22-P24 VanDerWaalsContact O-CD 3.26Å; S22-P24 WeakPolarHBondContact O-CD 3.38Å; S22-D139 WeakPolarHBondContact CA-OD1 3.4Å
23	S	85.4	Confident	70.3	Confident	51 Å²	51	120.5 Å²	120.5	36%	0.357	60%	0.598	S	S	.	*			trans	-83.9	112.5	178.3	59.7	0	0	0	0	110.3	S21 T138 D139	S21-S23 PolarHBondContact O-N 3.03Å; S23-T138 CarbonylContact O-C 3.41Å; S23-T138 VanDerWaalsContact O-CA 3.28Å; S23-T138 WeakPolarHBondContact O-CA 3.17Å; S23-D139 PolarHBondContact N-OD1 3.17Å; S23-D139 PolarHBondContact O-N 2.91Å; S23-D139 PolarHBondContact OG-OD1 3.22Å
24	P	90.8	Very high	73.2	Confident	54 Å²	54	116.7 Å²	116.7	35%	0.351	60%	0.595	S	S	.	*	B	Isolated β-bridge	trans	-76.9	162.5	177.1	33.8	-35.7	0	0	0	111.2	S22 Y26	S22-P24 VanDerWaalsContact O-CD 3.26Å; S22-P24 WeakPolarHBondContact O-CD 3.38Å; P24-Y26 HydrophobicContact CG-CD1 4.44Å; P24-Y26 HydrophobicContact CG-CE1 3.71Å
25	I	93.3	Very high	76	Confident	8 Å²	8	111.5 Å²	111.5	4%	0.041	58%	0.576	C	S	.	*	P	Polyproline II helix	trans	-81.4	120.6	170.7	-52.6	-47.1	0	0	0	109.6	I129 L132 H133 V140 L269	I25-I129 HydrophobicContact CG2-CG2 3.96Å; I25-L132 HydrophobicContact CG1-CB 4.05Å; I25-H133 HydrophobicContact CG2-CB 4.48Å; I25-H133 PolarHBondContact O-ND1 2.81Å; I25-V140 HydrophobicContact CD1-CB 4.09Å; I25-V140 HydrophobicContact CD1-CG2 4.1Å; I25-L269 HydrophobicContact CD1-CD2 3.37Å; I25-L269 HydrophobicContact CD1-CG 3.99Å; I25-L269 HydrophobicContact CG1-CD2 4.48Å
26	Y	92.4	Very high	78.8	Confident	116 Å²	116	112.4 Å²	112.4	46%	0.455	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-87.5	137.3	179.3	-55.6	-69.2	0	0	0	111.5	P24 S267	P24-Y26 HydrophobicContact CG-CD1 4.44Å; P24-Y26 HydrophobicContact CG-CE1 3.71Å; Y26-S267 PolarHBondContact N-O 2.89Å; Y26-S267 WeakPolarHBondContact O-CA 3.44Å; Y26-S267 WeakPolarHBondContact O-CB 3.17Å
27	V	94.4	Very high	81.5	Confident	37 Å²	37	108 Å²	108	22%	0.224	56%	0.562	C	S	.	*			trans	-120.8	120.9	169.6	-69.3	0	0	0	0	108.5	N29 L32 I129 H133	V27-N29 VanDerWaalsContact C-N 3.3Å; V27-N29 PolarHBondContact O-N 2.88Å; V27-L32 HydrophobicContact CB-CD2 4.28Å; V27-L32 HydrophobicContact CG1-CD2 4.34Å; V27-L32 HydrophobicContact CG2-CD2 3.93Å; V27-I129 HydrophobicContact CG1-CG2 3.99Å; V27-H133 HydrophobicContact CG1-CB 3.77Å
28	H	93.1	Very high	84.4	Confident	149 Å²	149	99.5 Å²	99.5	69%	0.69	52%	0.523	S	S	*	.			trans	-93.9	58.5	179.3	-66.4	-59.9	0	0	0	111.2	L266	H28-L266 PolarHBondContact CD2-O 3.17Å; H28-L266 PolarHBondContact NE2-O 3.43Å
29	N	96.7	Very high	87.3	Confident	73 Å²	73	95.4 Å²	95.4	39%	0.39	51%	0.509	S	S	.	.			trans	-144.9	99.1	178.3	-177.8	7.5	0	0	0	111.1	V27 H31 L32	V27-N29 VanDerWaalsContact C-N 3.3Å; V27-N29 PolarHBondContact O-N 2.88Å; N29-H31 PolarHBondContact O-N 3.1Å; N29-H31 VanDerWaalsContact O-N 3.13Å; N29-H31 WeakPolarHBondContact OD1-CB 3.43Å; N29-H31 PolarHBondContact OD1-CD2 3.01Å; N29-H31 PolarHBondContact OD1-N 2.96Å; N29-H31 VanDerWaalsContact OD1-N 3.09Å; N29-L32 HydrophobicContact CB-CB 4.5Å; N29-L32 WeakPolarHBondContact O-CB 3.31Å; N29-L32 PolarHBondContact O-N 3.22Å; N29-L32 VanDerWaalsContact O-N 3.11Å
30	P	95.5	Very high	89.9	Confident	102 Å²	102	86.7 Å²	86.7	66%	0.662	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.6	-178.7	29.3	-36.1	0	0	0	113.2	L32	P30-L32 VanDerWaalsContact C-N 3.28Å
31	H	97.7	Very high	92.2	Very high	134 Å²	134	84.8 Å²	84.8	62%	0.62	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.2	177.5	-55.3	-63.6	0	0	0	112.8	N29 A34	N29-H31 PolarHBondContact O-N 3.1Å; N29-H31 VanDerWaalsContact O-N 3.13Å; N29-H31 WeakPolarHBondContact OD1-CB 3.43Å; N29-H31 PolarHBondContact OD1-CD2 3.01Å; N29-H31 PolarHBondContact OD1-N 2.96Å; N29-H31 VanDerWaalsContact OD1-N 3.09Å; H31-A34 PolarHBondContact O-N 3.46Å
32	L	95.5	Very high	94	Very high	9 Å²	9	81.7 Å²	81.7	5%	0.047	43%	0.428	C	S	.	.	S	Bend	trans	-65.7	-42.9	-178.8	-170.2	65.3	0	0	0	111.5	V27 N29 P30 A34 L35 D38 K130	V27-L32 HydrophobicContact CB-CD2 4.28Å; V27-L32 HydrophobicContact CG1-CD2 4.34Å; V27-L32 HydrophobicContact CG2-CD2 3.93Å; N29-L32 HydrophobicContact CB-CB 4.5Å; N29-L32 WeakPolarHBondContact O-CB 3.31Å; N29-L32 PolarHBondContact O-N 3.22Å; N29-L32 VanDerWaalsContact O-N 3.11Å; P30-L32 VanDerWaalsContact C-N 3.28Å; L32-A34 PolarHBondContact O-N 3Å; L32-L35 HydrophobicContact CD1-CD1 3.99Å; L32-L35 WeakPolarHBondContact O-CB 3.37Å; L32-L35 PolarHBondContact O-N 3.38Å; L32-L35 VanDerWaalsContact O-N 3.12Å; L32-D38 HydrophobicContact CD1-CB 4.43Å; L32-D38 WeakPolarHBondContact CD1-OD2 3.48Å; L32-K130 HydrophobicContact CD1-CD 3.77Å; L32-K130 HydrophobicContact CD2-CD 4.32Å; L32-K130 HydrophobicContact CD2-CG 4.24Å
33	D	90.1	Very high	95	Very high	135 Å²	135	78.6 Å²	78.6	72%	0.722	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21	-179.7	-62.5	-23.7	0	0	0	113.2
34	A	94.6	Very high	95.6	Very high	89 Å²	89	79 Å²	79	74%	0.736	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-9.5	178.5	0	0	0	0	0	113.1	H31 L32	H31-A34 PolarHBondContact O-N 3.46Å; L32-A34 PolarHBondContact O-N 3Å
35	L	94.9	Very high	96	Very high	89 Å²	89	76.7 Å²	76.7	47%	0.466	39%	0.393	S	S	.	.			trans	-73	132.2	177.6	-63.3	-176.9	0	0	0	110.1	L32 D38	L32-L35 HydrophobicContact CD1-CD1 3.99Å; L32-L35 WeakPolarHBondContact O-CB 3.37Å; L32-L35 PolarHBondContact O-N 3.38Å; L32-L35 VanDerWaalsContact O-N 3.12Å; L35-D38 HydrophobicContact CD1-CB 4.06Å
36	K	95	Very high	96.2	Very high	191 Å²	191	76.4 Å²	76.4	83%	0.83	39%	0.393	S	S	*	.	S	Bend	trans	-64.6	-48.4	169.3	-178.3	-173.3	171.9	-170.8	0	110.7
37	D	95.1	Very high	96.5	Very high	79 Å²	79	73.3 Å²	73.3	42%	0.422	39%	0.386	S	S	.	.	S	Bend	trans	-136.1	132.9	178	-64.5	-58.5	0	0	0	108.2	T47 G48	D37-T47 WeakPolarHBondContact CA-OG1 3.46Å; D37-G48 WeakPolarHBondContact OD1-CA 3.49Å; D37-G48 PolarHBondContact OD1-N 3.09Å
38	D	98.2	Very high	96.6	Very high	11 Å²	11	74.2 Å²	74.2	6%	0.059	40%	0.403	C	S	.	.			trans	-103.4	121	172.9	-174.6	24	0	0	0	109.7	L32 L35 G46 T47 K130 H134	L32-D38 HydrophobicContact CD1-CB 4.43Å; L32-D38 WeakPolarHBondContact CD1-OD2 3.48Å; L35-D38 HydrophobicContact CD1-CB 4.06Å; D38-G46 CarbonylContact O-C 3.58Å; D38-G46 WeakPolarHBondContact O-CA 3.45Å; D38-T47 HydrophobicContact CB-CG2 4.08Å; D38-T47 PolarHBondContact N-OG1 3.37Å; D38-T47 PolarHBondContact O-N 3.48Å; D38-K130 IonicContact OD1-NZ 2.79Å; D38-K130 PolarHBondContact OD1-NZ 3.19Å; D38-K130 WeakPolarHBondContact OD2-CD 3.25Å; D38-K130 WeakPolarHBondContact OD2-CE 3.39Å; D38-K130 IonicContact OD2-NZ 2.89Å; D38-K130 PolarHBondContact OD2-NZ 2.94Å; D38-H134 IonicContact OD2-CD2 3.15Å; D38-H134 IonicContact OD2-CE1 3.25Å; D38-H134 IonicContact OD2-NE2 2.88Å; D38-H134 PolarHBondContact OD2-NE2 3.42Å
39	I	98.3	Very high	96.8	Very high	120 Å²	120	71.2 Å²	71.2	62%	0.615	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	119.1	-179.7	-58.4	173.7	0	0	0	108.2	Y41	I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 3.28Å
40	L	98.4	Very high	96.9	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	77.5	171.2	-51.5	-177.1	0	0	0	107.6	H42 F43 S44 L45 E127 K130 L131	L40-H42 VanDerWaalsContact C-N 3.33Å; L40-H42 PolarHBondContact O-N 2.96Å; L40-F43 HydrophobicContact CB-CB 4.36Å; L40-F43 HydrophobicContact CB-CD2 4.44Å; L40-F43 CarbonylContact O-C 3.59Å; L40-F43 PolarHBondContact O-N 3.43Å; L40-F43 VanDerWaalsContact O-N 3.11Å; L40-S44 PolarHBondContact O-N 3.1Å; L40-L45 CarbonylContact C-O 3.54Å; L40-L45 WeakPolarHBondContact CA-O 3.45Å; L40-L45 HydrophobicContact CB-CB 4.22Å; L40-L45 HydrophobicContact CD1-CB 4.32Å; L40-L45 PolarHBondContact N-O 2.95Å; L40-L45 PolarHBondContact O-N 2.7Å; L40-E127 WeakPolarHBondContact CA-OE2 3.36Å; L40-E127 HydrophobicContact CB-CB 4.32Å; L40-E127 HydrophobicContact CB-CG 4.4Å; L40-E127 HydrophobicContact CD2-CB 4.19Å; L40-E127 HydrophobicContact CD2-CG 4.29Å; L40-K130 HydrophobicContact CD2-CB 4.06Å; L40-K130 VanDerWaalsContact CD2-CE 3.49Å; L40-L131 HydrophobicContact CD1-CB 3.69Å; L40-L131 HydrophobicContact CD1-CD1 4.01Å; L40-L131 HydrophobicContact CD1-CG 4.28Å
41	Y	98.4	Very high	97	Very high	156 Å²	156	70.7 Å²	70.7	61%	0.612	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-56.9	-44.2	-166.8	177.8	-95.2	0	0	0	112.8	I39 F43 S44 E127	I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 3.28Å; Y41-F43 PolarHBondContact O-N 3.37Å; Y41-S44 PolarHBondContact O-N 2.91Å; Y41-E127 PolarHBondContact N-OE1 3.5Å; Y41-E127 PolarHBondContact N-OE2 3.15Å
42	H	98.7	Very high	97.1	Very high	47 Å²	47	64.5 Å²	64.5	22%	0.218	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-77.4	-10.3	-176.2	-56	82.5	0	0	0	113	L40 T98 R100 Y101 I123 E127	L40-H42 VanDerWaalsContact C-N 3.33Å; L40-H42 PolarHBondContact O-N 2.96Å; H42-T98 WeakPolarHBondContact O-CG2 3.2Å; H42-R100 HydrophobicContact CB-CB 4.25Å; H42-Y101 HydrophobicContact CB-CD2 3.8Å; H42-Y101 HydrophobicContact CB-CE2 3.59Å; H42-I123 HydrophobicContact CB-CG2 4.14Å; H42-I123 VanDerWaalsContact CG-CG2 3.49Å; H42-I123 WeakPolarHBondContact ND1-CG2 3.39Å; H42-E127 IonicContact CE1-OE1 3.78Å; H42-E127 IonicContact CG-OE1 3.57Å; H42-E127 PolarHBondContact N-OE1 3.47Å; H42-E127 VanDerWaalsContact N-OE1 3.12Å; H42-E127 PolarHBondContact N-OE2 3.41Å; H42-E127 IonicContact ND1-OE1 2.73Å; H42-E127 PolarHBondContact ND1-OE1 3.02Å
43	F	98.7	Very high	97.2	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-101.2	-9.4	168.7	-65.6	-27.4	0	0	0	114	L40 Y41 L45 C95 Y101 M103 V112 M124 E127 L128 L131	L40-F43 HydrophobicContact CB-CB 4.36Å; L40-F43 HydrophobicContact CB-CD2 4.44Å; L40-F43 CarbonylContact O-C 3.59Å; L40-F43 PolarHBondContact O-N 3.43Å; L40-F43 VanDerWaalsContact O-N 3.11Å; Y41-F43 PolarHBondContact O-N 3.37Å; F43-L45 HydrophobicContact CB-CB 4.29Å; F43-L45 HydrophobicContact CB-CD1 4.06Å; F43-L45 HydrophobicContact CB-CG 4.07Å; F43-L45 PolarHBondContact O-N 3.17Å; F43-C95 PolarHBondContact O-SG 2.71Å; F43-C95 VanDerWaalsContact O-SG 3.34Å; F43-Y101 AromaticContact CD1-CD2 3.9Å; F43-Y101 HydrophobicContact CD1-CD2 3.9Å; F43-Y101 HydrophobicContact CD1-CG 4.4Å; F43-Y101 AromaticContact CE1-CD2 3.59Å; F43-Y101 HydrophobicContact CE1-CD2 3.59Å; F43-Y101 AromaticContact CE1-CG 3.95Å; F43-Y101 HydrophobicContact CE1-CG 3.95Å; F43-M103 HydrophobicContact CD1-CE 4.07Å; F43-M103 HydrophobicContact CD2-CE 3.82Å; F43-M103 HydrophobicContact CE1-CE 3.97Å; F43-M103 HydrophobicContact CE2-CE 3.68Å; F43-M103 HydrophobicContact CG-CE 4.02Å; F43-M103 HydrophobicContact CZ-CE 3.77Å; F43-V112 HydrophobicContact CE1-CG1 4.02Å; F43-V112 HydrophobicContact CZ-CG1 4.1Å; F43-M124 HydrophobicContact CE1-CG 4.07Å; F43-M124 HydrophobicContact CZ-CG 3.9Å; F43-M124 HydrophobicContact CZ-SD 4.29Å; F43-E127 HydrophobicContact CD2-CB 3.79Å; F43-E127 HydrophobicContact CE2-CB 3.64Å; F43-E127 HydrophobicContact CZ-CB 4.32Å; F43-E127 PolarHBondContact N-OE2 3.45Å; F43-L128 HydrophobicContact CE2-CB 4.09Å; F43-L128 HydrophobicContact CZ-CB 4.21Å; F43-L131 HydrophobicContact CD2-CD1 4.42Å
44	S	98.1	Very high	97.6	Very high	60 Å²	60	64 Å²	64	42%	0.42	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	35.3	-170	-153	0	0	0	0	112.6	L40 Y41	L40-S44 PolarHBondContact O-N 3.1Å; Y41-S44 PolarHBondContact O-N 2.91Å
45	L	98.5	Very high	97.8	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	165.6	178.5	-64.2	176.2	0	0	0	110.4	L40 F43 H50 F56 I94 L131	L40-L45 CarbonylContact C-O 3.54Å; L40-L45 WeakPolarHBondContact CA-O 3.45Å; L40-L45 HydrophobicContact CB-CB 4.22Å; L40-L45 HydrophobicContact CD1-CB 4.32Å; L40-L45 PolarHBondContact N-O 2.95Å; L40-L45 PolarHBondContact O-N 2.7Å; F43-L45 HydrophobicContact CB-CB 4.29Å; F43-L45 HydrophobicContact CB-CD1 4.06Å; F43-L45 HydrophobicContact CB-CG 4.07Å; F43-L45 PolarHBondContact O-N 3.17Å; L45-H50 WeakPolarHBondContact CD2-NE2 2.81Å; L45-F56 HydrophobicContact CD1-CE2 4.22Å; L45-F56 HydrophobicContact CD1-CZ 4.07Å; L45-I94 HydrophobicContact CD1-CG2 4.3Å; L45-I94 HydrophobicContact CD2-CG2 4.38Å; L45-L131 HydrophobicContact CD1-CD1 3.6Å
46	G	97.9	Very high	97.9	Very high	3 Å²	3	58.6 Å²	58.6	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	157.3	174.7	0	0	0	0	0	113.2	D38 G48 S49 H50	D38-G46 CarbonylContact O-C 3.58Å; D38-G46 WeakPolarHBondContact O-CA 3.45Å; G46-G48 VanDerWaalsContact C-N 3.3Å; G46-G48 PolarHBondContact O-N 2.91Å; G46-S49 PolarHBondContact N-OG 3.29Å; G46-S49 PolarHBondContact O-N 2.91Å; G46-S49 PolarHBondContact O-OG 3.39Å; G46-H50 PolarHBondContact N-ND1 3.04Å; G46-H50 WeakPolarHBondContact O-CB 3.33Å; G46-H50 PolarHBondContact O-N 3.44Å
47	T	98.1	Very high	98.1	Very high	51 Å²	51	50.8 Å²	50.8	31%	0.313	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-31.4	-176	57.4	0	0	0	0	113	D37 D38 L52 H134	D37-T47 WeakPolarHBondContact CA-OG1 3.46Å; D38-T47 HydrophobicContact CB-CG2 4.08Å; D38-T47 PolarHBondContact N-OG1 3.37Å; D38-T47 PolarHBondContact O-N 3.48Å; T47-L52 HydrophobicContact CG2-CD1 4Å; T47-H134 HydrophobicContact CG2-CB 4.31Å
48	G	97.2	Very high	98.2	Very high	56 Å²	56	50.6 Å²	50.6	58%	0.577	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-19.2	176.9	0	0	0	0	0	114.4	D37 G46	D37-G48 WeakPolarHBondContact OD1-CA 3.49Å; D37-G48 PolarHBondContact OD1-N 3.09Å; G46-G48 VanDerWaalsContact C-N 3.3Å; G46-G48 PolarHBondContact O-N 2.91Å
49	S	97.4	Very high	98.2	Very high	85 Å²	85	50 Å²	50	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-18.3	-177.3	50.1	0	0	0	0	113.8	G46	G46-S49 PolarHBondContact N-OG 3.29Å; G46-S49 PolarHBondContact O-N 2.91Å; G46-S49 PolarHBondContact O-OG 3.39Å
50	H	98.3	Very high	98.2	Very high	60 Å²	60	46.5 Å²	46.5	28%	0.278	28%	0.278	S	S	.	.	S	Bend	trans	-139.1	141.9	-173.1	-59.9	82.4	0	0	0	111.9	L45 G46 L52 M55	L45-H50 WeakPolarHBondContact CD2-NE2 2.81Å; G46-H50 PolarHBondContact N-ND1 3.04Å; G46-H50 WeakPolarHBondContact O-CB 3.33Å; G46-H50 PolarHBondContact O-N 3.44Å; H50-L52 VanDerWaalsContact C-N 3.32Å; H50-L52 HydrophobicContact CB-CD2 3.8Å; H50-L52 HydrophobicContact CB-CG 4.46Å; H50-L52 PolarHBondContact O-N 3.24Å; H50-M55 HydrophobicContact CB-SD 3.86Å
51	N	98.3	Very high	98.2	Very high	105 Å²	105	46.7 Å²	46.7	56%	0.561	28%	0.279	S	S	*	.			trans	-81.8	79.4	169.6	-172.1	-16.5	0	0	0	110	P53 A54 M55	N51-P53 WeakPolarHBondContact OD1-CD 3.24Å; N51-A54 HydrophobicContact CB-CB 4.09Å; N51-A54 VanDerWaalsContact CG-CB 3.44Å; N51-A54 PolarHBondContact O-N 2.91Å; N51-A54 VanDerWaalsContact O-N 3.12Å; N51-A54 WeakPolarHBondContact OD1-CB 3.2Å; N51-A54 PolarHBondContact OD1-N 2.96Å; N51-M55 WeakPolarHBondContact O-CG 3.45Å; N51-M55 PolarHBondContact O-N 3.38Å
52	L	98.4	Very high	98.2	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-57.5	-41.2	-176.4	-56.3	-179.2	0	0	0	113.7	T47 H50 A54 M55 F56 H134 A135	T47-L52 HydrophobicContact CG2-CD1 4Å; H50-L52 VanDerWaalsContact C-N 3.32Å; H50-L52 HydrophobicContact CB-CD2 3.8Å; H50-L52 HydrophobicContact CB-CG 4.46Å; H50-L52 PolarHBondContact O-N 3.24Å; L52-A54 VanDerWaalsContact C-N 3.35Å; L52-A54 PolarHBondContact O-N 3.48Å; L52-M55 PolarHBondContact O-N 3.48Å; L52-F56 HydrophobicContact CB-CD2 4.46Å; L52-F56 HydrophobicContact CD2-CD2 4.16Å; L52-F56 HydrophobicContact CD2-CE2 3.9Å; L52-F56 PolarHBondContact O-N 2.93Å; L52-H134 HydrophobicContact CB-CB 4.48Å; L52-H134 HydrophobicContact CD1-CB 3.72Å; L52-A135 HydrophobicContact CB-CB 4.44Å; L52-A135 WeakPolarHBondContact O-CB 3.41Å
53	P	98.4	Very high	98.2	Very high	58 Å²	58	37.1 Å²	37.1	38%	0.377	24%	0.24	S	C	.	.	H	α-helix	trans	-57.1	-43.7	172.8	-27.3	35.1	0	0	0	113.8	N51 M55 G57	N51-P53 WeakPolarHBondContact OD1-CD 3.24Å; P53-M55 VanDerWaalsContact C-N 3.35Å; P53-G57 WeakPolarHBondContact O-CA 3.35Å; P53-G57 PolarHBondContact O-N 3.19Å
54	A	98.3	Very high	98.2	Very high	75 Å²	75	37.1 Å²	37.1	62%	0.62	24%	0.24	S	C	*	.	H	α-helix	trans	-69.6	-33.6	178.7	0	0	0	0	0	112.5	N51 L52	N51-A54 HydrophobicContact CB-CB 4.09Å; N51-A54 VanDerWaalsContact CG-CB 3.44Å; N51-A54 PolarHBondContact O-N 2.91Å; N51-A54 VanDerWaalsContact O-N 3.12Å; N51-A54 WeakPolarHBondContact OD1-CB 3.2Å; N51-A54 PolarHBondContact OD1-N 2.96Å; L52-A54 VanDerWaalsContact C-N 3.35Å; L52-A54 PolarHBondContact O-N 3.48Å
55	M	98.1	Very high	98.3	Very high	66 Å²	66	34.2 Å²	34.2	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-78.8	-35.3	-177.9	-69.2	174.7	70.2	0	0	113.4	H50 N51 L52 P53 I94 K105	H50-M55 HydrophobicContact CB-SD 3.86Å; N51-M55 WeakPolarHBondContact O-CG 3.45Å; N51-M55 PolarHBondContact O-N 3.38Å; L52-M55 PolarHBondContact O-N 3.48Å; P53-M55 VanDerWaalsContact C-N 3.35Å; M55-I94 HydrophobicContact CE-CG2 4.36Å; M55-K105 WeakPolarHBondContact O-CD 3.21Å; M55-K105 WeakPolarHBondContact O-CE 3.33Å
56	F	98.5	Very high	98.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-132.2	-5.8	-166.5	-55.4	-76.1	0	0	0	115.2	L45 L52 D58 V59 I94 M103 K105 L110 L131 A135 C137	L45-F56 HydrophobicContact CD1-CE2 4.22Å; L45-F56 HydrophobicContact CD1-CZ 4.07Å; L52-F56 HydrophobicContact CB-CD2 4.46Å; L52-F56 HydrophobicContact CD2-CD2 4.16Å; L52-F56 HydrophobicContact CD2-CE2 3.9Å; L52-F56 PolarHBondContact O-N 2.93Å; F56-D58 PolarHBondContact O-N 3.4Å; F56-V59 HydrophobicContact CB-CG2 4.21Å; F56-V59 HydrophobicContact CD1-CG2 4.44Å; F56-V59 VanDerWaalsContact O-CB 3.29Å; F56-V59 WeakPolarHBondContact O-CB 3.45Å; F56-V59 VanDerWaalsContact O-CG2 3.24Å; F56-V59 WeakPolarHBondContact O-CG2 3.4Å; F56-V59 PolarHBondContact O-N 2.82Å; F56-I94 HydrophobicContact CE1-CD1 4.16Å; F56-I94 HydrophobicContact CZ-CG2 4.06Å; F56-M103 HydrophobicContact CE1-SD 3.96Å; F56-M103 HydrophobicContact CZ-SD 4.17Å; F56-K105 HydrophobicContact CD1-CD 4.16Å; F56-L110 HydrophobicContact CD1-CD1 4.09Å; F56-L110 HydrophobicContact CE1-CD1 3.93Å; F56-L131 HydrophobicContact CB-CD2 4.08Å; F56-L131 HydrophobicContact CD1-CD2 4.05Å; F56-L131 HydrophobicContact CD2-CD1 4.18Å; F56-L131 HydrophobicContact CD2-CD2 3.87Å; F56-L131 HydrophobicContact CD2-CG 4.07Å; F56-L131 HydrophobicContact CE1-CD2 4.44Å; F56-L131 HydrophobicContact CE2-CD1 3.82Å; F56-L131 HydrophobicContact CE2-CD2 4.29Å; F56-L131 HydrophobicContact CE2-CG 4.22Å; F56-L131 HydrophobicContact CG-CD2 3.74Å; F56-L131 HydrophobicContact CG-CG 4.45Å; F56-L131 HydrophobicContact CZ-CD1 4.01Å; F56-A135 HydrophobicContact CB-CB 3.69Å; F56-C137 PolarHBondContact O-SG 3.32Å
57	G	98.2	Very high	98.3	Very high	27 Å²	27	36.8 Å²	36.8	28%	0.278	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.9	-173.8	0	0	0	0	0	115	P53 A135	P53-G57 WeakPolarHBondContact O-CA 3.35Å; P53-G57 PolarHBondContact O-N 3.19Å; G57-A135 WeakPolarHBondContact CA-O 3.4Å
58	D	97.3	Very high	98.2	Very high	74 Å²	74	37.4 Å²	37.4	40%	0.396	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-4.5	175.6	69.8	-39.8	0	0	0	114	F56 K60 K105 P108	F56-D58 PolarHBondContact O-N 3.4Å; D58-K60 PolarHBondContact O-N 3.27Å; D58-K105 WeakPolarHBondContact OD1-CE 3.29Å; D58-K105 IonicContact OD1-NZ 3.69Å; D58-K105 PolarHBondContact OD1-NZ 3.07Å; D58-K105 IonicContact OD2-NZ 3.95Å; D58-K105 PolarHBondContact OD2-NZ 2.69Å; D58-P108 WeakPolarHBondContact O-CB 3.49Å
59	V	98.4	Very high	98.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.248	C	C	.	.			trans	-63.6	128.3	180	173	0	0	0	0	110.5	F56 V62 K105 L110 L132	F56-V59 HydrophobicContact CB-CG2 4.21Å; F56-V59 HydrophobicContact CD1-CG2 4.44Å; F56-V59 VanDerWaalsContact O-CB 3.29Å; F56-V59 WeakPolarHBondContact O-CB 3.45Å; F56-V59 VanDerWaalsContact O-CG2 3.24Å; F56-V59 WeakPolarHBondContact O-CG2 3.4Å; F56-V59 PolarHBondContact O-N 2.82Å; V59-V62 HydrophobicContact CG1-CG2 3.83Å; V59-K105 HydrophobicContact CG2-CD 4.34Å; V59-L110 HydrophobicContact CG1-CB 4Å; V59-L110 HydrophobicContact CG2-CB 4.21Å; V59-L132 HydrophobicContact CB-CD2 4.41Å; V59-L132 HydrophobicContact CG1-CD2 4.05Å
60	K	98.2	Very high	98.1	Very high	45 Å²	45	40 Å²	40	20%	0.196	22%	0.224	C	C	.	.			trans	-123.9	-21.2	175.1	-61.8	-63.3	172.4	179.4	0	113.2	D58 P108 T138 D139 V140 T141	D58-K60 PolarHBondContact O-N 3.27Å; K60-P108 HydrophobicContact CB-CB 4.23Å; K60-P108 HydrophobicContact CG-CB 4.32Å; K60-P108 PolarHBondContact N-O 3.28Å; K60-T138 WeakPolarHBondContact CD-O 3.28Å; K60-T138 PolarHBondContact NZ-O 2.8Å; K60-T138 PolarHBondContact NZ-OG1 2.77Å; K60-T138 VanDerWaalsContact NZ-OG1 3.09Å; K60-D139 IonicContact NZ-OD2 2.88Å; K60-V140 WeakPolarHBondContact O-CA 3.32Å; K60-T141 PolarHBondContact O-N 3.42Å
61	F	98.8	Very high	98	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.022	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133	176.1	-61.1	-79.6	0	0	0	110.1	P108 V109 L110 T141 Y308 I309 Q312 L313	F61-P108 PolarHBondContact N-O 3.15Å; F61-V109 HydrophobicContact CB-CG1 4.49Å; F61-V109 HydrophobicContact CB-CG2 4.35Å; F61-V109 CarbonylContact O-C 3.55Å; F61-V109 WeakPolarHBondContact O-CA 3.46Å; F61-L110 PolarHBondContact O-N 2.94Å; F61-T141 CarbonylContact C-O 3.47Å; F61-T141 WeakPolarHBondContact CA-O 3.47Å; F61-T141 HydrophobicContact CD1-CG2 4.44Å; F61-Y308 HydrophobicContact CE1-CE1 4.05Å; F61-I309 HydrophobicContact CB-CD1 4.06Å; F61-I309 HydrophobicContact CB-CG1 4.23Å; F61-I309 HydrophobicContact CD1-CG1 3.88Å; F61-I309 HydrophobicContact CD2-CG1 4.35Å; F61-I309 HydrophobicContact CD2-CG2 3.88Å; F61-I309 HydrophobicContact CE1-CG1 4.35Å; F61-I309 HydrophobicContact CE2-CG2 4.15Å; F61-I309 HydrophobicContact CG-CD1 4.27Å; F61-I309 HydrophobicContact CG-CG1 3.88Å; F61-I309 HydrophobicContact CG-CG2 4.24Å; F61-Q312 HydrophobicContact CE1-CB 4.38Å; F61-Q312 HydrophobicContact CE1-CG 4.5Å; F61-Q312 HydrophobicContact CZ-CB 3.66Å; F61-Q312 HydrophobicContact CZ-CG 4.24Å; F61-L313 HydrophobicContact CE2-CD2 3.91Å; F61-L313 HydrophobicContact CE2-CG 4.09Å
62	V	98.9	Very high	97.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.5	170.2	-175.1	0	0	0	0	108.3	V59 V64 L110 V112 L128 L132 V140 T141 I142 I143	V59-V62 HydrophobicContact CG1-CG2 3.83Å; V62-V64 HydrophobicContact CG1-CG1 3.79Å; V62-L110 CarbonylContact C-O 3.57Å; V62-L110 VanDerWaalsContact CA-O 3.28Å; V62-L110 WeakPolarHBondContact CA-O 3.41Å; V62-L110 HydrophobicContact CG1-CB 4.47Å; V62-L110 HydrophobicContact CG2-CB 4.23Å; V62-L110 HydrophobicContact CG2-CD2 4.43Å; V62-V112 HydrophobicContact CG1-CG2 4.25Å; V62-L128 HydrophobicContact CG1-CD1 4.39Å; V62-L128 HydrophobicContact CG1-CD2 3.87Å; V62-L132 HydrophobicContact CG2-CD1 4.2Å; V62-L132 HydrophobicContact CG2-CD2 4.3Å; V62-V140 HydrophobicContact CG2-CG1 3.76Å; V62-T141 PolarHBondContact N-O 3Å; V62-I142 HydrophobicContact CB-CB 4.23Å; V62-I142 HydrophobicContact CB-CD1 4.37Å; V62-I142 HydrophobicContact CB-CG1 3.95Å; V62-I142 HydrophobicContact CG1-CD1 4.22Å; V62-I142 HydrophobicContact CG1-CG1 4.17Å; V62-I142 CarbonylContact O-C 3.59Å; V62-I142 VanDerWaalsContact O-CA 3.27Å; V62-I142 WeakPolarHBondContact O-CA 3.44Å; V62-I143 PolarHBondContact O-N 3.39Å
63	C	98.9	Very high	97.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.3	170.9	-65.4	0	0	0	0	109.3	M71 F74 L110 S111 V112 I143 V305	C63-M71 HydrophobicContact CB-CE 4.12Å; C63-M71 WeakPolarHBondContact O-CE 3.23Å; C63-F74 HydrophobicContact CB-CD1 3.88Å; C63-F74 HydrophobicContact CB-CE1 3.35Å; C63-F74 HydrophobicContact CB-CZ 3.91Å; C63-F74 WeakPolarHBondContact SG-CE1 3.43Å; C63-F74 WeakPolarHBondContact SG-CZ 3.41Å; C63-L110 PolarHBondContact N-O 2.87Å; C63-S111 CarbonylContact O-C 3.5Å; C63-S111 WeakPolarHBondContact O-CA 3.36Å; C63-V112 PolarHBondContact O-N 3.29Å; C63-I143 WeakPolarHBondContact CA-O 3.34Å; C63-V305 VanDerWaalsContact SG-CG1 3.55Å
64	V	98.9	Very high	97.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.5	179.8	-53	0	0	0	0	111.3	V62 V112 M124 L128 I142 I143 R144 I145 F260	V62-V64 HydrophobicContact CG1-CG1 3.79Å; V64-V112 VanDerWaalsContact CA-O 3.24Å; V64-V112 WeakPolarHBondContact CA-O 3.43Å; V64-V112 HydrophobicContact CG1-CB 4.18Å; V64-M124 HydrophobicContact CB-CE 3.96Å; V64-M124 HydrophobicContact CG1-CE 3.81Å; V64-M124 HydrophobicContact CG1-SD 4.39Å; V64-M124 HydrophobicContact CG2-CE 4.28Å; V64-L128 HydrophobicContact CG1-CD2 4.26Å; V64-I142 HydrophobicContact CG1-CD1 4.19Å; V64-I142 HydrophobicContact CG1-CG1 4.42Å; V64-I143 PolarHBondContact N-O 2.83Å; V64-R144 HydrophobicContact CG2-CB 3.92Å; V64-R144 HydrophobicContact CG2-CG 4.38Å; V64-R144 CarbonylContact O-C 3.59Å; V64-R144 WeakPolarHBondContact O-CA 3.32Å; V64-I145 PolarHBondContact O-N 2.81Å; V64-F260 HydrophobicContact CG2-CD2 4.27Å; V64-F260 HydrophobicContact CG2-CE2 3.8Å
65	G	98.8	Very high	97.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	166.4	179.3	0	0	0	0	0	112.4	M71 V112 S113 H114 I145	G65-M71 WeakPolarHBondContact CA-SD 3.49Å; G65-M71 PolarHBondContact N-SD 2.91Å; G65-V112 PolarHBondContact N-O 2.87Å; G65-S113 CarbonylContact O-C 3.6Å; G65-S113 WeakPolarHBondContact O-CA 3.32Å; G65-H114 VanDerWaalsContact CA-CD2 3.47Å; G65-H114 WeakPolarHBondContact CA-CD2 3.45Å; G65-H114 WeakPolarHBondContact CA-NE2 3.36Å; G65-H114 PolarHBondContact N-CD2 2.91Å; G65-H114 VanDerWaalsContact N-CD2 3.32Å; G65-H114 PolarHBondContact O-CD2 3.41Å; G65-H114 VanDerWaalsContact O-CD2 3.25Å; G65-H114 PolarHBondContact O-N 3.18Å; G65-H114 PolarHBondContact O-NE2 2.99Å; G65-I145 WeakPolarHBondContact CA-O 3.44Å
66	G	98.4	Very high	97.2	Very high	15 Å²	15	31.8 Å²	31.8	16%	0.155	17%	0.165	C	C	.	.	S	Bend	trans	-68	-54.5	-168	0	0	0	0	0	114.2	H114 G115	G66-H114 VanDerWaalsContact CA-CE1 3.47Å; G66-H114 WeakPolarHBondContact CA-CE1 3.32Å; G66-H114 PolarHBondContact N-CE1 3.43Å; G66-H114 PolarHBondContact N-NE2 2.65Å; G66-G115 WeakPolarHBondContact CA-O 3.34Å; G66-G115 WeakPolarHBondContact O-CA 3.27Å; G66-G115 PolarHBondContact O-N 2.93Å
67	S	97.8	Very high	96.9	Very high	47 Å²	47	34.3 Å²	34.3	33%	0.329	18%	0.177	S	C	.	.			trans	-82.7	128.5	-172.6	170.2	0	0	0	0	112.6	W69 R70 M71	S67-W69 PolarHBondContact O-N 3.13Å; S67-W69 PolarHBondContact OG-N 3.14Å; S67-R70 PolarHBondContact O-N 3.21Å; S67-R70 VanDerWaalsContact O-N 3.12Å; S67-R70 PolarHBondContact OG-N 3.48Å; S67-M71 WeakPolarHBondContact O-CG 3.33Å; S67-M71 PolarHBondContact O-N 2.64Å
68	P	97.3	Very high	96.7	Very high	64 Å²	64	33.1 Å²	33.1	42%	0.416	16%	0.164	S	C	.	.	H	α-helix	trans	-53.2	-39.1	170.3	-27.6	35.6	0	0	0	113.7	M71 K72 A102	P68-M71 PolarHBondContact O-N 2.84Å; P68-K72 PolarHBondContact O-N 2.84Å; P68-A102 HydrophobicContact CB-CB 3.88Å
69	W	95.2	Very high	96.4	Very high	167 Å²	167	29.7 Å²	29.7	63%	0.633	15%	0.146	S	C	*	.	H	α-helix	trans	-65	-43.2	177.9	178.1	86.2	0	0	0	111.6	S67 M71 K72 S73	S67-W69 PolarHBondContact O-N 3.13Å; S67-W69 PolarHBondContact OG-N 3.14Å; W69-M71 VanDerWaalsContact C-N 3.31Å; W69-M71 PolarHBondContact O-N 3.03Å; W69-K72 PolarHBondContact O-N 3.26Å; W69-S73 WeakPolarHBondContact O-CB 3.31Å; W69-S73 PolarHBondContact O-N 2.84Å
70	R	95.9	Very high	96	Very high	28 Å²	28	33.4 Å²	33.4	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-40.7	176.6	-172.4	-177.7	-62.2	171.3	1.6	111.3	S67 S73 F74	S67-R70 PolarHBondContact O-N 3.21Å; S67-R70 VanDerWaalsContact O-N 3.12Å; S67-R70 PolarHBondContact OG-N 3.48Å; R70-S73 PolarHBondContact O-N 3.31Å; R70-F74 WeakPolarHBondContact O-CB 3.35Å; R70-F74 PolarHBondContact O-N 2.75Å
71	M	98.2	Very high	95.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-73.1	-29.7	-180	-60.5	-41.9	-64.1	0	0	112.8	C63 G65 S67 P68 W69 F74 T75 S111 I145	C63-M71 HydrophobicContact CB-CE 4.12Å; C63-M71 WeakPolarHBondContact O-CE 3.23Å; G65-M71 WeakPolarHBondContact CA-SD 3.49Å; G65-M71 PolarHBondContact N-SD 2.91Å; S67-M71 WeakPolarHBondContact O-CG 3.33Å; S67-M71 PolarHBondContact O-N 2.64Å; P68-M71 PolarHBondContact O-N 2.84Å; W69-M71 VanDerWaalsContact C-N 3.31Å; W69-M71 PolarHBondContact O-N 3.03Å; M71-F74 HydrophobicContact CE-CD1 4.36Å; M71-T75 PolarHBondContact O-N 3.01Å; M71-T75 PolarHBondContact O-OG1 2.96Å; M71-S111 WeakPolarHBondContact CB-OG 3.35Å; M71-S111 VanDerWaalsContact CE-OG 3.23Å; M71-S111 WeakPolarHBondContact CE-OG 3.35Å; M71-S111 PolarHBondContact O-OG 3.47Å; M71-I145 HydrophobicContact CE-CD1 4Å; M71-I145 HydrophobicContact CE-CG1 4.21Å; M71-I145 HydrophobicContact SD-CD1 4.07Å; M71-I145 HydrophobicContact SD-CG1 4.18Å
72	K	95.9	Very high	95	Very high	83 Å²	83	35.4 Å²	35.4	36%	0.361	19%	0.187	S	C	.	.	H	α-helix	trans	-65.8	-49.8	167.5	-170.3	179.9	176.9	-174.9	0	111.3	P68 W69 F74 T75 E76 Y104	P68-K72 PolarHBondContact O-N 2.84Å; W69-K72 PolarHBondContact O-N 3.26Å; K72-F74 VanDerWaalsContact C-N 3.28Å; K72-F74 PolarHBondContact O-N 3.42Å; K72-T75 WeakPolarHBondContact O-CA 3.46Å; K72-T75 VanDerWaalsContact O-CB 3.23Å; K72-T75 WeakPolarHBondContact O-CB 3.4Å; K72-T75 PolarHBondContact O-N 3.23Å; K72-E76 VanDerWaalsContact CE-OE1 3.31Å; K72-E76 WeakPolarHBondContact CE-OE1 3.34Å; K72-E76 PolarHBondContact O-N 2.87Å; K72-Y104 HydrophobicContact CB-CD2 4.43Å; K72-Y104 HydrophobicContact CB-CE1 4.32Å; K72-Y104 HydrophobicContact CB-CE2 3.73Å; K72-Y104 HydrophobicContact CD-CE1 4.34Å; K72-Y104 HydrophobicContact CG-CE1 4.03Å; K72-Y104 HydrophobicContact CG-CE2 4.32Å
73	S	93.9	Very high	94.2	Very high	24 Å²	24	39.6 Å²	39.6	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-39.6	177.5	179.8	0	0	0	0	112.2	W69 R70 T75 E76 F77	W69-S73 WeakPolarHBondContact O-CB 3.31Å; W69-S73 PolarHBondContact O-N 2.84Å; R70-S73 PolarHBondContact O-N 3.31Å; S73-T75 VanDerWaalsContact C-N 3.28Å; S73-T75 PolarHBondContact O-N 2.59Å; S73-E76 PolarHBondContact O-N 3.42Å; S73-F77 WeakPolarHBondContact O-CB 3.39Å; S73-F77 PolarHBondContact O-N 2.76Å
74	F	96.1	Very high	92.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-37.3	172.7	176.3	-104.5	0	0	0	112.4	C63 R70 M71 K72 F77 I78 V109 I145 Q302 V305 I309	C63-F74 HydrophobicContact CB-CD1 3.88Å; C63-F74 HydrophobicContact CB-CE1 3.35Å; C63-F74 HydrophobicContact CB-CZ 3.91Å; C63-F74 WeakPolarHBondContact SG-CE1 3.43Å; C63-F74 WeakPolarHBondContact SG-CZ 3.41Å; R70-F74 WeakPolarHBondContact O-CB 3.35Å; R70-F74 PolarHBondContact O-N 2.75Å; M71-F74 HydrophobicContact CE-CD1 4.36Å; K72-F74 VanDerWaalsContact C-N 3.28Å; K72-F74 PolarHBondContact O-N 3.42Å; F74-F77 HydrophobicContact CD2-CD1 4.35Å; F74-F77 HydrophobicContact CE2-CD1 4.43Å; F74-F77 PolarHBondContact O-N 2.96Å; F74-I78 HydrophobicContact CE1-CB 4.39Å; F74-I78 HydrophobicContact CE1-CG2 4.32Å; F74-I78 HydrophobicContact CZ-CB 4.17Å; F74-I78 HydrophobicContact CZ-CG1 4.31Å; F74-I78 WeakPolarHBondContact O-CB 3.42Å; F74-I78 WeakPolarHBondContact O-CG2 3.32Å; F74-I78 PolarHBondContact O-N 2.83Å; F74-V109 HydrophobicContact CE1-CG1 4.16Å; F74-I145 HydrophobicContact CB-CD1 4.33Å; F74-I145 HydrophobicContact CD2-CD1 4.01Å; F74-I145 HydrophobicContact CG-CD1 4.03Å; F74-Q302 VanDerWaalsContact CA-OE1 3.22Å; F74-Q302 HydrophobicContact CB-CG 4.3Å; F74-Q302 HydrophobicContact CD2-CB 3.84Å; F74-Q302 HydrophobicContact CD2-CG 3.84Å; F74-Q302 HydrophobicContact CE2-CB 4.46Å; F74-Q302 HydrophobicContact CG-CG 4.5Å; F74-V305 HydrophobicContact CZ-CG1 4.37Å; F74-I309 HydrophobicContact CZ-CD1 4.25Å
75	T	95.2	Very high	91.4	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-45.6	178.3	-53.6	0	0	0	0	111.2	M71 K72 S73 F77 I78 A79 Y91 Y104 V106 S111	M71-T75 PolarHBondContact O-N 3.01Å; M71-T75 PolarHBondContact O-OG1 2.96Å; K72-T75 WeakPolarHBondContact O-CA 3.46Å; K72-T75 VanDerWaalsContact O-CB 3.23Å; K72-T75 WeakPolarHBondContact O-CB 3.4Å; K72-T75 PolarHBondContact O-N 3.23Å; S73-T75 VanDerWaalsContact C-N 3.28Å; S73-T75 PolarHBondContact O-N 2.59Å; T75-F77 VanDerWaalsContact C-N 3.32Å; T75-F77 PolarHBondContact O-N 3.17Å; T75-I78 WeakPolarHBondContact O-CG2 3.48Å; T75-I78 PolarHBondContact O-N 2.86Å; T75-A79 WeakPolarHBondContact O-CB 3.24Å; T75-A79 PolarHBondContact O-N 2.9Å; T75-Y91 HydrophobicContact CG2-CD1 3.81Å; T75-Y91 HydrophobicContact CG2-CE1 4.47Å; T75-Y91 HydrophobicContact CG2-CG 3.89Å; T75-Y104 WeakPolarHBondContact OG1-CB 3.49Å; T75-V106 HydrophobicContact CG2-CG2 3.43Å; T75-V106 VanDerWaalsContact CG2-CG2 3.43Å; T75-S111 WeakPolarHBondContact OG1-CB 3.44Å; T75-S111 PolarHBondContact OG1-OG 2.87Å
76	E	92.6	Very high	89.9	Confident	86 Å²	86	51 Å²	51	40%	0.402	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-43.3	175.5	-67.4	164.3	175.4	0	0	110.9	K72 S73 A80 Y91	K72-E76 VanDerWaalsContact CE-OE1 3.31Å; K72-E76 WeakPolarHBondContact CE-OE1 3.34Å; K72-E76 PolarHBondContact O-N 2.87Å; S73-E76 PolarHBondContact O-N 3.42Å; E76-A80 PolarHBondContact O-N 2.86Å; E76-Y91 HydrophobicContact CB-CE2 4.39Å; E76-Y91 HydrophobicContact CG-CD2 3.72Å; E76-Y91 HydrophobicContact CG-CE2 3.84Å
77	F	92.3	Very high	88	Confident	54 Å²	54	56.3 Å²	56.3	24%	0.237	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-50.8	175.8	171.3	-103.5	0	0	0	112.3	S73 F74 T75 A79 A80 E81 Q302 I303	S73-F77 WeakPolarHBondContact O-CB 3.39Å; S73-F77 PolarHBondContact O-N 2.76Å; F74-F77 HydrophobicContact CD2-CD1 4.35Å; F74-F77 HydrophobicContact CE2-CD1 4.43Å; F74-F77 PolarHBondContact O-N 2.96Å; T75-F77 VanDerWaalsContact C-N 3.32Å; T75-F77 PolarHBondContact O-N 3.17Å; F77-A79 VanDerWaalsContact C-N 3.31Å; F77-A79 PolarHBondContact O-N 2.85Å; F77-A80 PolarHBondContact O-N 2.91Å; F77-E81 HydrophobicContact CD1-CG 4.44Å; F77-E81 HydrophobicContact CD2-CG 4.25Å; F77-E81 HydrophobicContact CE1-CG 3.94Å; F77-E81 HydrophobicContact CE2-CG 3.71Å; F77-E81 HydrophobicContact CZ-CG 3.53Å; F77-E81 PolarHBondContact O-N 3.06Å; F77-Q302 VanDerWaalsContact CE1-O 3.32Å; F77-Q302 WeakPolarHBondContact CE1-O 3.25Å; F77-I303 HydrophobicContact CE2-CG1 4.44Å; F77-I303 HydrophobicContact CZ-CB 4.49Å; F77-I303 HydrophobicContact CZ-CG1 4.19Å
78	I	93.3	Very high	86.4	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-69.4	-31.8	-175.7	-161.8	58.3	0	0	0	112	F74 T75 E81 L82 V109 G306 I309	F74-I78 HydrophobicContact CE1-CB 4.39Å; F74-I78 HydrophobicContact CE1-CG2 4.32Å; F74-I78 HydrophobicContact CZ-CB 4.17Å; F74-I78 HydrophobicContact CZ-CG1 4.31Å; F74-I78 WeakPolarHBondContact O-CB 3.42Å; F74-I78 WeakPolarHBondContact O-CG2 3.32Å; F74-I78 PolarHBondContact O-N 2.83Å; T75-I78 WeakPolarHBondContact O-CG2 3.48Å; T75-I78 PolarHBondContact O-N 2.86Å; I78-E81 HydrophobicContact CD1-CB 4.36Å; I78-E81 PolarHBondContact O-N 2.83Å; I78-L82 HydrophobicContact CD1-CD1 4.08Å; I78-L82 HydrophobicContact CD1-CD2 4.46Å; I78-L82 HydrophobicContact CD1-CG 4.02Å; I78-L82 HydrophobicContact CG1-CD1 3.75Å; I78-L82 HydrophobicContact CG1-CG 4.08Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 VanDerWaalsContact O-CG 3.26Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 2.84Å; I78-V109 HydrophobicContact CG1-CG1 4.42Å; I78-V109 HydrophobicContact CG1-CG2 4.27Å; I78-V109 HydrophobicContact CG2-CG1 4.34Å; I78-G306 VanDerWaalsContact CD1-CA 3.47Å; I78-I309 HydrophobicContact CD1-CB 4.41Å; I78-I309 HydrophobicContact CD1-CG2 4.39Å
79	A	92.3	Very high	85.3	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.025	33%	0.328	C	S	.	.	H	α-helix	trans	-62.6	-46	173.8	0	0	0	0	0	112.1	T75 F77 L82 A83 Y91 V106	T75-A79 WeakPolarHBondContact O-CB 3.24Å; T75-A79 PolarHBondContact O-N 2.9Å; F77-A79 VanDerWaalsContact C-N 3.31Å; F77-A79 PolarHBondContact O-N 2.85Å; A79-L82 PolarHBondContact O-N 2.96Å; A79-A83 PolarHBondContact O-N 2.81Å; A79-Y91 HydrophobicContact CB-CE1 3.74Å; A79-Y91 HydrophobicContact CB-CE2 4.49Å; A79-Y91 VanDerWaalsContact CB-CZ 3.49Å; A79-Y91 WeakPolarHBondContact CB-OH 2.94Å; A79-V106 HydrophobicContact CB-CG1 3.83Å; A79-V106 HydrophobicContact CB-CG2 4.13Å
80	A	89.6	Confident	84.7	Confident	77 Å²	77	62.5 Å²	62.5	64%	0.636	34%	0.338	S	S	*	.	H	α-helix	trans	-62.6	-42.2	174.9	0	0	0	0	0	111.7	E76 F77 L82 A83	E76-A80 PolarHBondContact O-N 2.86Å; F77-A80 PolarHBondContact O-N 2.91Å; A80-L82 PolarHBondContact O-N 3.43Å; A80-A83 PolarHBondContact O-N 3.08Å
81	E	89.2	Confident	84.3	Confident	65 Å²	65	62.7 Å²	62.7	30%	0.304	34%	0.339	S	S	.	.	H	α-helix	trans	-66.4	-35.5	-179	-82.8	-58.6	143.6	0	0	114	F77 I78 K310	F77-E81 HydrophobicContact CD1-CG 4.44Å; F77-E81 HydrophobicContact CD2-CG 4.25Å; F77-E81 HydrophobicContact CE1-CG 3.94Å; F77-E81 HydrophobicContact CE2-CG 3.71Å; F77-E81 HydrophobicContact CZ-CG 3.53Å; F77-E81 PolarHBondContact O-N 3.06Å; I78-E81 HydrophobicContact CD1-CB 4.36Å; I78-E81 PolarHBondContact O-N 2.83Å; E81-K310 WeakPolarHBondContact O-CE 3.13Å; E81-K310 PolarHBondContact O-NZ 3.29Å; E81-K310 IonicContact OE2-NZ 3.17Å; E81-K310 PolarHBondContact OE2-NZ 3.4Å
82	L	87.5	Confident	84	Confident	27 Å²	27	67.1 Å²	67.1	14%	0.141	37%	0.367	C	S	.	.	H	α-helix	trans	-89.9	-12.8	-178	-61.4	-178.5	0	0	0	113	I78 A79 A80 M84 V109 I309 K310 L313	I78-L82 HydrophobicContact CD1-CD1 4.08Å; I78-L82 HydrophobicContact CD1-CD2 4.46Å; I78-L82 HydrophobicContact CD1-CG 4.02Å; I78-L82 HydrophobicContact CG1-CD1 3.75Å; I78-L82 HydrophobicContact CG1-CG 4.08Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 VanDerWaalsContact O-CG 3.26Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 2.84Å; A79-L82 PolarHBondContact O-N 2.96Å; A80-L82 PolarHBondContact O-N 3.43Å; L82-M84 HydrophobicContact CB-CB 4.47Å; L82-M84 HydrophobicContact CB-CE 3.66Å; L82-M84 HydrophobicContact CB-CG 3.77Å; L82-M84 HydrophobicContact CB-SD 4.01Å; L82-M84 HydrophobicContact CD1-CE 3.27Å; L82-M84 HydrophobicContact CD1-SD 4.15Å; L82-M84 HydrophobicContact CG-CE 4.09Å; L82-M84 WeakPolarHBondContact O-CG 3.35Å; L82-M84 PolarHBondContact O-N 3.15Å; L82-M84 VanDerWaalsContact O-N 3.15Å; L82-V109 HydrophobicContact CD1-CG2 3.94Å; L82-I309 HydrophobicContact CD1-CG2 4.18Å; L82-I309 HydrophobicContact CD2-CG2 4.48Å; L82-K310 HydrophobicContact CD2-CB 3.82Å; L82-K310 HydrophobicContact CD2-CG 4.07Å; L82-L313 HydrophobicContact CD1-CD1 3.76Å; L82-L313 HydrophobicContact CD2-CD1 3.89Å; L82-L313 HydrophobicContact CG-CD1 4.47Å
83	A	82	Confident	84.1	Confident	88 Å²	88	65.3 Å²	65.3	73%	0.727	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	31.8	-177	0	0	0	0	0	113.4	A79 A80	A79-A83 PolarHBondContact O-N 2.81Å; A80-A83 PolarHBondContact O-N 3.08Å
84	M	68.8	Low	84.3	Confident	77 Å²	77	66.5 Å²	66.5	38%	0.379	37%	0.366	S	S	.	.			trans	-90.1	-14.6	-174.2	-68.5	-175.2	-47.3	0	0	113.6	L82 V106	L82-M84 HydrophobicContact CB-CB 4.47Å; L82-M84 HydrophobicContact CB-CE 3.66Å; L82-M84 HydrophobicContact CB-CG 3.77Å; L82-M84 HydrophobicContact CB-SD 4.01Å; L82-M84 HydrophobicContact CD1-CE 3.27Å; L82-M84 HydrophobicContact CD1-SD 4.15Å; L82-M84 HydrophobicContact CG-CE 4.09Å; L82-M84 WeakPolarHBondContact O-CG 3.35Å; L82-M84 PolarHBondContact O-N 3.15Å; L82-M84 VanDerWaalsContact O-N 3.15Å; M84-V106 HydrophobicContact CE-CG1 3.94Å
85	E	68.9	Low	84.3	Confident	71 Å²	71	66.5 Å²	66.5	33%	0.332	37%	0.366	S	S	.	.	S	Bend	trans	-138.3	159.5	-175.9	-65.9	-176.1	-167.9	0	0	111.6	Y91 V106	E85-Y91 WeakPolarHBondContact OE2-CE1 3.15Å; E85-V106 HydrophobicContact CG-CG1 4.34Å
86	D	66.7	Low	84.2	Confident	94 Å²	94	70.2 Å²	70.2	50%	0.503	40%	0.397	S	S	.	.			trans	-59.3	130.9	174.6	-174.4	-24.7	0	0	0	109.3	K88 S89	D86-K88 PolarHBondContact O-N 3.04Å; D86-K88 WeakPolarHBondContact OD1-CB 3.46Å; D86-K88 PolarHBondContact OD1-N 3.13Å; D86-S89 WeakPolarHBondContact O-CB 3.19Å; D86-S89 PolarHBondContact O-N 2.97Å; D86-S89 PolarHBondContact O-OG 3.42Å; D86-S89 VanDerWaalsContact O-OG 3.11Å
87	P	58.4	Low	84.3	Confident	125 Å²	125	69.1 Å²	69.1	81%	0.812	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-17.6	173.3	-26.4	33.5	0	0	0	114.9
88	K	65.1	Low	84.4	Confident	185 Å²	185	68.1 Å²	68.1	80%	0.804	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-1.9	175.9	-61.2	-179.6	-178.6	176.7	0	114.1	D86 E90	D86-K88 PolarHBondContact O-N 3.04Å; D86-K88 WeakPolarHBondContact OD1-CB 3.46Å; D86-K88 PolarHBondContact OD1-N 3.13Å; K88-E90 PolarHBondContact O-N 2.76Å
89	S	73.9	Confident	84.4	Confident	43 Å²	43	74.9 Å²	74.9	30%	0.301	44%	0.443	S	S	.	.			trans	-59.3	133.5	176.2	-70.1	0	0	0	0	110.5	D86	D86-S89 WeakPolarHBondContact O-CB 3.19Å; D86-S89 PolarHBondContact O-N 2.97Å; D86-S89 PolarHBondContact O-OG 3.42Å; D86-S89 VanDerWaalsContact O-OG 3.11Å
90	E	83.2	Confident	84.6	Confident	180 Å²	180	81.9 Å²	81.9	84%	0.841	47%	0.469	S	S	*	.			trans	-78.3	138.1	165.1	-65.4	-171.9	170	0	0	109.1	K88 P92	K88-E90 PolarHBondContact O-N 2.76Å; E90-P92 WeakPolarHBondContact O-CD 3.48Å
91	Y	87.8	Confident	85.1	Confident	33 Å²	33	78.8 Å²	78.8	13%	0.129	44%	0.44	C	S	.	.			trans	-99.5	88	171.4	-54	-72.6	0	0	0	108.5	T75 E76 A79 E85 Y104 V106	T75-Y91 HydrophobicContact CG2-CD1 3.81Å; T75-Y91 HydrophobicContact CG2-CE1 4.47Å; T75-Y91 HydrophobicContact CG2-CG 3.89Å; E76-Y91 HydrophobicContact CB-CE2 4.39Å; E76-Y91 HydrophobicContact CG-CD2 3.72Å; E76-Y91 HydrophobicContact CG-CE2 3.84Å; A79-Y91 HydrophobicContact CB-CE1 3.74Å; A79-Y91 HydrophobicContact CB-CE2 4.49Å; A79-Y91 VanDerWaalsContact CB-CZ 3.49Å; A79-Y91 WeakPolarHBondContact CB-OH 2.94Å; E85-Y91 WeakPolarHBondContact OE2-CE1 3.15Å; Y91-Y104 WeakPolarHBondContact O-CD1 3.28Å; Y91-V106 HydrophobicContact CD1-CG2 3.46Å; Y91-V106 VanDerWaalsContact CD1-CG2 3.46Å; Y91-V106 HydrophobicContact CE1-CG2 3.38Å
92	P	92.1	Very high	85.5	Confident	93 Å²	93	76 Å²	76	60%	0.604	43%	0.428	S	S	*	.			trans	-65.2	141.5	-177.3	28	-35.7	0	0	0	110.2	E90 I94	E90-P92 WeakPolarHBondContact O-CD 3.48Å; P92-I94 PolarHBondContact O-N 3.3Å; P92-I94 VanDerWaalsContact O-N 3.13Å
93	N	97.2	Very high	86	Confident	45 Å²	45	74.7 Å²	74.7	24%	0.241	42%	0.421	C	S	.	.			trans	-68.2	110.5	168.3	178.4	15.4	0	0	0	108.6	C95 A96 A102 M103 Y104	N93-C95 PolarHBondContact O-N 2.97Å; N93-C95 PolarHBondContact OD1-N 3.23Å; N93-A96 VanDerWaalsContact O-CB 3.23Å; N93-A96 WeakPolarHBondContact O-CB 3.34Å; N93-A96 PolarHBondContact O-N 3.42Å; N93-A102 WeakPolarHBondContact OD1-CA 3.34Å; N93-M103 CarbonylContact C-O 3.4Å; N93-M103 WeakPolarHBondContact CA-O 3.42Å; N93-M103 PolarHBondContact OD1-N 2.96Å; N93-M103 PolarHBondContact OD1-O 3.02Å; N93-Y104 HydrophobicContact CB-CE1 3.91Å
94	I	97.9	Very high	86.8	Confident	49 Å²	49	71.5 Å²	71.5	25%	0.251	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.3	179.2	-63.4	169.4	0	0	0	110.8	L45 M55 F56 P92 A96 M103 K105	L45-I94 HydrophobicContact CD1-CG2 4.3Å; L45-I94 HydrophobicContact CD2-CG2 4.38Å; M55-I94 HydrophobicContact CE-CG2 4.36Å; F56-I94 HydrophobicContact CE1-CD1 4.16Å; F56-I94 HydrophobicContact CZ-CG2 4.06Å; P92-I94 PolarHBondContact O-N 3.3Å; P92-I94 VanDerWaalsContact O-N 3.13Å; I94-A96 VanDerWaalsContact C-N 3.31Å; I94-A96 PolarHBondContact O-N 3.23Å; I94-M103 HydrophobicContact CB-CB 4.2Å; I94-M103 HydrophobicContact CB-CG 4.29Å; I94-M103 HydrophobicContact CD1-CG 4.19Å; I94-M103 HydrophobicContact CG2-SD 4.38Å; I94-M103 PolarHBondContact N-O 2.83Å; I94-K105 HydrophobicContact CD1-CB 3.77Å
95	C	97.3	Very high	88.1	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	24.1	177	-63.8	0	0	0	0	113	F43 N93 G97 T98 Y101 M103	F43-C95 PolarHBondContact O-SG 2.71Å; F43-C95 VanDerWaalsContact O-SG 3.34Å; N93-C95 PolarHBondContact O-N 2.97Å; N93-C95 PolarHBondContact OD1-N 3.23Å; C95-G97 PolarHBondContact O-N 3.36Å; C95-T98 HydrophobicContact CB-CG2 4.04Å; C95-T98 WeakPolarHBondContact O-CG2 3.34Å; C95-T98 PolarHBondContact O-N 3.26Å; C95-Y101 WeakPolarHBondContact CB-O 3.45Å; C95-M103 VanDerWaalsContact SG-CB 3.55Å
96	A	93.1	Very high	89.3	Confident	79 Å²	79	67 Å²	67	65%	0.653	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.9	-176	0	0	0	0	0	115.1	N93 I94 T98	N93-A96 VanDerWaalsContact O-CB 3.23Å; N93-A96 WeakPolarHBondContact O-CB 3.34Å; N93-A96 PolarHBondContact O-N 3.42Å; I94-A96 VanDerWaalsContact C-N 3.31Å; I94-A96 PolarHBondContact O-N 3.23Å; A96-T98 PolarHBondContact O-N 3.44Å
97	G	92.8	Very high	90.6	Very high	63 Å²	63	63.5 Å²	63.5	65%	0.649	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	1.6	172.1	0	0	0	0	0	114.9	C95	C95-G97 PolarHBondContact O-N 3.36Å
98	T	95.1	Very high	92.4	Very high	33 Å²	33	58.6 Å²	58.6	20%	0.202	32%	0.322	C	S	.	.			trans	-151.7	162.1	-179.8	-174.8	0	0	0	0	111.4	H42 C95 A96 R100	H42-T98 WeakPolarHBondContact O-CG2 3.2Å; C95-T98 HydrophobicContact CB-CG2 4.04Å; C95-T98 WeakPolarHBondContact O-CG2 3.34Å; C95-T98 PolarHBondContact O-N 3.26Å; A96-T98 PolarHBondContact O-N 3.44Å; T98-R100 WeakPolarHBondContact OG1-CG 3.48Å; T98-R100 PolarHBondContact OG1-N 2.77Å
99	D	93.7	Very high	94	Very high	142 Å²	142	49.9 Å²	49.9	76%	0.759	29%	0.285	S	S	*	.	S	Bend	trans	-106.7	1.7	175.3	65.9	-11.6	0	0	0	113
100	R	96.9	Very high	95.2	Very high	151 Å²	151	47.9 Å²	47.9	57%	0.57	27%	0.271	S	S	*	.	S	Bend	trans	-70.3	-48.9	-174.7	-61.9	-56.4	-172.2	-179.2	-0.3	112.6	H42 T98	H42-R100 HydrophobicContact CB-CB 4.25Å; T98-R100 WeakPolarHBondContact OG1-CG 3.48Å; T98-R100 PolarHBondContact OG1-N 2.77Å
101	Y	98.7	Very high	95.9	Very high	12 Å²	12	39.4 Å²	39.4	5%	0.047	23%	0.231	C	C	.	.			trans	-140.3	148.9	176.2	-55.4	-63.1	0	0	0	109.9	H42 F43 C95 S113 S120 I123 M124	H42-Y101 HydrophobicContact CB-CD2 3.8Å; H42-Y101 HydrophobicContact CB-CE2 3.59Å; F43-Y101 AromaticContact CD1-CD2 3.9Å; F43-Y101 HydrophobicContact CD1-CD2 3.9Å; F43-Y101 HydrophobicContact CD1-CG 4.4Å; F43-Y101 AromaticContact CE1-CD2 3.59Å; F43-Y101 HydrophobicContact CE1-CD2 3.59Å; F43-Y101 AromaticContact CE1-CG 3.95Å; F43-Y101 HydrophobicContact CE1-CG 3.95Å; C95-Y101 WeakPolarHBondContact CB-O 3.45Å; Y101-S113 WeakPolarHBondContact CD1-O 3.1Å; Y101-S120 PolarHBondContact OH-O 3.31Å; Y101-I123 HydrophobicContact CE2-CG2 4.02Å; Y101-I123 WeakPolarHBondContact OH-CB 3.45Å; Y101-M124 HydrophobicContact CD1-CB 4.28Å; Y101-M124 HydrophobicContact CD1-CG 4.31Å; Y101-M124 HydrophobicContact CD2-CB 4.33Å; Y101-M124 HydrophobicContact CD2-CG 4.48Å; Y101-M124 HydrophobicContact CE1-CB 3.89Å; Y101-M124 HydrophobicContact CE1-CG 4.4Å; Y101-M124 HydrophobicContact CE2-CB 3.95Å; Y101-M124 HydrophobicContact CG-CB 4.5Å; Y101-M124 HydrophobicContact CG-CG 4.35Å
102	A	98.6	Very high	96.4	Very high	5 Å²	5	37.8 Å²	37.8	4%	0.041	23%	0.225	C	C	.	.			trans	-102.7	143	167.5	0	0	0	0	0	110.1	P68 N93 Y104 V112 S113	P68-A102 HydrophobicContact CB-CB 3.88Å; N93-A102 WeakPolarHBondContact OD1-CA 3.34Å; A102-Y104 HydrophobicContact CB-CE2 3.8Å; A102-V112 WeakPolarHBondContact O-CA 3.32Å; A102-S113 PolarHBondContact N-OG 3.38Å; A102-S113 PolarHBondContact O-N 3.44Å; A102-S113 PolarHBondContact O-OG 2.87Å
103	M	98.8	Very high	96.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	134.3	-180	-178	179.2	-62.4	0	0	109.8	F43 F56 N93 I94 C95 L110 S111 V112 L131	F43-M103 HydrophobicContact CD1-CE 4.07Å; F43-M103 HydrophobicContact CD2-CE 3.82Å; F43-M103 HydrophobicContact CE1-CE 3.97Å; F43-M103 HydrophobicContact CE2-CE 3.68Å; F43-M103 HydrophobicContact CG-CE 4.02Å; F43-M103 HydrophobicContact CZ-CE 3.77Å; F56-M103 HydrophobicContact CE1-SD 3.96Å; F56-M103 HydrophobicContact CZ-SD 4.17Å; N93-M103 CarbonylContact C-O 3.4Å; N93-M103 WeakPolarHBondContact CA-O 3.42Å; N93-M103 PolarHBondContact OD1-N 2.96Å; N93-M103 PolarHBondContact OD1-O 3.02Å; I94-M103 HydrophobicContact CB-CB 4.2Å; I94-M103 HydrophobicContact CB-CG 4.29Å; I94-M103 HydrophobicContact CD1-CG 4.19Å; I94-M103 HydrophobicContact CG2-SD 4.38Å; I94-M103 PolarHBondContact N-O 2.83Å; C95-M103 VanDerWaalsContact SG-CB 3.55Å; M103-L110 HydrophobicContact CG-CD1 3.75Å; M103-L110 HydrophobicContact CG-CG 4.29Å; M103-L110 HydrophobicContact SD-CD1 3.89Å; M103-L110 HydrophobicContact SD-CD2 4.24Å; M103-L110 HydrophobicContact SD-CG 4.42Å; M103-S111 CarbonylContact C-O 3.54Å; M103-S111 WeakPolarHBondContact CA-O 3.3Å; M103-V112 HydrophobicContact CE-CG1 4.04Å; M103-V112 HydrophobicContact CE-CG2 4.03Å; M103-V112 HydrophobicContact CG-CG2 4.16Å; M103-L131 HydrophobicContact CE-CD1 4.37Å; M103-L131 HydrophobicContact SD-CD1 4.48Å
104	Y	97.9	Very high	96.8	Very high	21 Å²	21	31.3 Å²	31.3	8%	0.082	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	149.8	179	-48.8	-87	0	0	0	109.3	K72 T75 Y91 N93 A102 S111	K72-Y104 HydrophobicContact CB-CD2 4.43Å; K72-Y104 HydrophobicContact CB-CE1 4.32Å; K72-Y104 HydrophobicContact CB-CE2 3.73Å; K72-Y104 HydrophobicContact CD-CE1 4.34Å; K72-Y104 HydrophobicContact CG-CE1 4.03Å; K72-Y104 HydrophobicContact CG-CE2 4.32Å; T75-Y104 WeakPolarHBondContact OG1-CB 3.49Å; Y91-Y104 WeakPolarHBondContact O-CD1 3.28Å; N93-Y104 HydrophobicContact CB-CE1 3.91Å; A102-Y104 HydrophobicContact CB-CE2 3.8Å; Y104-S111 PolarHBondContact N-O 3.39Å; Y104-S111 PolarHBondContact O-N 2.93Å
105	K	96.3	Very high	96.9	Very high	52 Å²	52	30.1 Å²	30.1	23%	0.226	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.9	-178.5	-172.6	179.6	-177.6	-71.3	0	110.2	M55 F56 D58 V59 I94 G107 V109 L110	M55-K105 WeakPolarHBondContact O-CD 3.21Å; M55-K105 WeakPolarHBondContact O-CE 3.33Å; F56-K105 HydrophobicContact CD1-CD 4.16Å; D58-K105 WeakPolarHBondContact OD1-CE 3.29Å; D58-K105 IonicContact OD1-NZ 3.69Å; D58-K105 PolarHBondContact OD1-NZ 3.07Å; D58-K105 IonicContact OD2-NZ 3.95Å; D58-K105 PolarHBondContact OD2-NZ 2.69Å; V59-K105 HydrophobicContact CG2-CD 4.34Å; I94-K105 HydrophobicContact CD1-CB 3.77Å; K105-G107 PolarHBondContact NZ-O 2.82Å; K105-V109 WeakPolarHBondContact CA-O 3.48Å; K105-L110 HydrophobicContact CB-CD1 3.91Å; K105-L110 HydrophobicContact CD-CD1 4.46Å; K105-L110 HydrophobicContact CG-CD1 4.2Å
106	V	94.4	Very high	96.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	114	174.2	172.5	0	0	0	0	108.5	T75 A79 M84 E85 Y91 V109	T75-V106 HydrophobicContact CG2-CG2 3.43Å; T75-V106 VanDerWaalsContact CG2-CG2 3.43Å; A79-V106 HydrophobicContact CB-CG1 3.83Å; A79-V106 HydrophobicContact CB-CG2 4.13Å; M84-V106 HydrophobicContact CE-CG1 3.94Å; E85-V106 HydrophobicContact CG-CG1 4.34Å; Y91-V106 HydrophobicContact CD1-CG2 3.46Å; Y91-V106 VanDerWaalsContact CD1-CG2 3.46Å; Y91-V106 HydrophobicContact CE1-CG2 3.38Å; V106-V109 PolarHBondContact N-O 2.84Å; V106-V109 WeakPolarHBondContact O-CB 3.49Å; V106-V109 PolarHBondContact O-N 3.02Å
107	G	93.5	Very high	97.2	Very high	22 Å²	22	34.3 Å²	34.3	23%	0.227	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	-127.5	-170.2	0	0	0	0	0	112	K105 V109	K105-G107 PolarHBondContact NZ-O 2.82Å; G107-V109 VanDerWaalsContact C-N 3.25Å; G107-V109 PolarHBondContact O-N 3.31Å
108	P	96.7	Very high	97.5	Very high	21 Å²	21	32.3 Å²	32.3	14%	0.136	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	8.6	-179.5	36	-37.5	0	0	0	114.5	D58 K60 F61 L313	D58-P108 WeakPolarHBondContact O-CB 3.49Å; K60-P108 HydrophobicContact CB-CB 4.23Å; K60-P108 HydrophobicContact CG-CB 4.32Å; K60-P108 PolarHBondContact N-O 3.28Å; F61-P108 PolarHBondContact N-O 3.15Å; P108-L313 HydrophobicContact CG-CD1 4.09Å; P108-L313 HydrophobicContact CG-CD2 3.9Å
109	V	98.1	Very high	97.7	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.8	-178	-172.4	0	0	0	0	110.3	F61 F74 I78 L82 K105 V106 G107 I309	F61-V109 HydrophobicContact CB-CG1 4.49Å; F61-V109 HydrophobicContact CB-CG2 4.35Å; F61-V109 CarbonylContact O-C 3.55Å; F61-V109 WeakPolarHBondContact O-CA 3.46Å; F74-V109 HydrophobicContact CE1-CG1 4.16Å; I78-V109 HydrophobicContact CG1-CG1 4.42Å; I78-V109 HydrophobicContact CG1-CG2 4.27Å; I78-V109 HydrophobicContact CG2-CG1 4.34Å; L82-V109 HydrophobicContact CD1-CG2 3.94Å; K105-V109 WeakPolarHBondContact CA-O 3.48Å; V106-V109 PolarHBondContact N-O 2.84Å; V106-V109 WeakPolarHBondContact O-CB 3.49Å; V106-V109 PolarHBondContact O-N 3.02Å; G107-V109 VanDerWaalsContact C-N 3.25Å; G107-V109 PolarHBondContact O-N 3.31Å; V109-I309 HydrophobicContact CG1-CD1 4.3Å; V109-I309 HydrophobicContact CG2-CG2 3.87Å
110	L	98.8	Very high	97.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.8	173.1	-168.9	69.7	0	0	0	109.9	F56 V59 F61 V62 C63 M103 K105 V112 L128	F56-L110 HydrophobicContact CD1-CD1 4.09Å; F56-L110 HydrophobicContact CE1-CD1 3.93Å; V59-L110 HydrophobicContact CG1-CB 4Å; V59-L110 HydrophobicContact CG2-CB 4.21Å; F61-L110 PolarHBondContact O-N 2.94Å; V62-L110 CarbonylContact C-O 3.57Å; V62-L110 VanDerWaalsContact CA-O 3.28Å; V62-L110 WeakPolarHBondContact CA-O 3.41Å; V62-L110 HydrophobicContact CG1-CB 4.47Å; V62-L110 HydrophobicContact CG2-CB 4.23Å; V62-L110 HydrophobicContact CG2-CD2 4.43Å; C63-L110 PolarHBondContact N-O 2.87Å; M103-L110 HydrophobicContact CG-CD1 3.75Å; M103-L110 HydrophobicContact CG-CG 4.29Å; M103-L110 HydrophobicContact SD-CD1 3.89Å; M103-L110 HydrophobicContact SD-CD2 4.24Å; M103-L110 HydrophobicContact SD-CG 4.42Å; K105-L110 HydrophobicContact CB-CD1 3.91Å; K105-L110 HydrophobicContact CD-CD1 4.46Å; K105-L110 HydrophobicContact CG-CD1 4.2Å; L110-V112 HydrophobicContact CD2-CG2 4.09Å; L110-V112 HydrophobicContact CG-CG2 3.97Å; L110-L128 HydrophobicContact CD2-CD1 3.84Å
111	S	98.7	Very high	98	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.014	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.9	179.9	-176.2	0	0	0	0	109.6	C63 M71 T75 M103 Y104	C63-S111 CarbonylContact O-C 3.5Å; C63-S111 WeakPolarHBondContact O-CA 3.36Å; M71-S111 WeakPolarHBondContact CB-OG 3.35Å; M71-S111 VanDerWaalsContact CE-OG 3.23Å; M71-S111 WeakPolarHBondContact CE-OG 3.35Å; M71-S111 PolarHBondContact O-OG 3.47Å; T75-S111 WeakPolarHBondContact OG1-CB 3.44Å; T75-S111 PolarHBondContact OG1-OG 2.87Å; M103-S111 CarbonylContact C-O 3.54Å; M103-S111 WeakPolarHBondContact CA-O 3.3Å; Y104-S111 PolarHBondContact N-O 3.39Å; Y104-S111 PolarHBondContact O-N 2.93Å
112	V	98.9	Very high	98	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.2	-173.2	-162.7	0	0	0	0	111.6	F43 V62 C63 V64 G65 A102 M103 L110 M124 L128	F43-V112 HydrophobicContact CE1-CG1 4.02Å; F43-V112 HydrophobicContact CZ-CG1 4.1Å; V62-V112 HydrophobicContact CG1-CG2 4.25Å; C63-V112 PolarHBondContact O-N 3.29Å; V64-V112 VanDerWaalsContact CA-O 3.24Å; V64-V112 WeakPolarHBondContact CA-O 3.43Å; V64-V112 HydrophobicContact CG1-CB 4.18Å; G65-V112 PolarHBondContact N-O 2.87Å; A102-V112 WeakPolarHBondContact O-CA 3.32Å; M103-V112 HydrophobicContact CE-CG1 4.04Å; M103-V112 HydrophobicContact CE-CG2 4.03Å; M103-V112 HydrophobicContact CG-CG2 4.16Å; L110-V112 HydrophobicContact CD2-CG2 4.09Å; L110-V112 HydrophobicContact CG-CG2 3.97Å; V112-M124 HydrophobicContact CB-SD 4.37Å; V112-M124 HydrophobicContact CG1-CG 3.93Å; V112-M124 HydrophobicContact CG1-SD 3.92Å; V112-L128 HydrophobicContact CG2-CD1 4.37Å
113	S	98.9	Very high	98	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	149.5	172	74	0	0	0	0	111.6	G65 Y101 A102	G65-S113 CarbonylContact O-C 3.6Å; G65-S113 WeakPolarHBondContact O-CA 3.32Å; Y101-S113 WeakPolarHBondContact CD1-O 3.1Å; A102-S113 PolarHBondContact N-OG 3.38Å; A102-S113 PolarHBondContact O-N 3.44Å; A102-S113 PolarHBondContact O-OG 2.87Å
114	H	98.8	Very high	98	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.154	C	C	.	.			trans	-134.4	8.1	-179.2	68.4	59	0	0	0	115.4	G65 G66 S120 I121 M124 R144	G65-H114 VanDerWaalsContact CA-CD2 3.47Å; G65-H114 WeakPolarHBondContact CA-CD2 3.45Å; G65-H114 WeakPolarHBondContact CA-NE2 3.36Å; G65-H114 PolarHBondContact N-CD2 2.91Å; G65-H114 VanDerWaalsContact N-CD2 3.32Å; G65-H114 PolarHBondContact O-CD2 3.41Å; G65-H114 VanDerWaalsContact O-CD2 3.25Å; G65-H114 PolarHBondContact O-N 3.18Å; G65-H114 PolarHBondContact O-NE2 2.99Å; G66-H114 VanDerWaalsContact CA-CE1 3.47Å; G66-H114 WeakPolarHBondContact CA-CE1 3.32Å; G66-H114 PolarHBondContact N-CE1 3.43Å; G66-H114 PolarHBondContact N-NE2 2.65Å; H114-S120 CarbonylContact O-C 3.57Å; H114-S120 VanDerWaalsContact O-CB 3.32Å; H114-S120 WeakPolarHBondContact O-CB 3.47Å; H114-S120 PolarHBondContact O-OG 2.99Å; H114-I121 HydrophobicContact CB-CB 4.16Å; H114-I121 HydrophobicContact CB-CG1 3.92Å; H114-M124 HydrophobicContact CB-CB 4.08Å; H114-M124 HydrophobicContact CB-CE 3.7Å; H114-M124 HydrophobicContact CB-CG 3.96Å; H114-R144 PolarHBondContact CE1-NH1 2.91Å; H114-R144 PolarHBondContact NE2-NH1 3.34Å
115	G	98.6	Very high	98.1	Very high	25 Å²	25	24.8 Å²	24.8	26%	0.258	15%	0.15	S	C	.	.			trans	66	-148.6	-177.9	0	0	0	0	0	113	G66	G66-G115 WeakPolarHBondContact CA-O 3.34Å; G66-G115 WeakPolarHBondContact O-CA 3.27Å; G66-G115 PolarHBondContact O-N 2.93Å
116	M	98.8	Very high	98.2	Very high	160 Å²	160	27.3 Å²	27.3	79%	0.788	16%	0.162	S	C	*	.	S	Bend	trans	-123.8	141.7	-177.3	-66.4	-177.7	-66.9	0	0	111.8	S120 E256	M116-S120 VanDerWaalsContact O-CB 3.3Å; M116-S120 WeakPolarHBondContact O-CB 3.38Å; M116-E256 WeakPolarHBondContact CA-OE1 3.24Å
117	G	98.7	Very high	98.4	Very high	7 Å²	7	28 Å²	28	7%	0.072	17%	0.166	C	C	.	.	S	Bend	trans	86	157.3	174.8	0	0	0	0	0	114.6	P119 S120 I121 M255 E256	G117-P119 VanDerWaalsContact C-CD 3.48Å; G117-S120 PolarHBondContact O-N 3.32Å; G117-S120 VanDerWaalsContact O-N 3.13Å; G117-I121 PolarHBondContact O-N 2.91Å; G117-M255 CarbonylContact C-O 3.43Å; G117-M255 WeakPolarHBondContact CA-O 3.48Å; G117-E256 PolarHBondContact N-OE1 2.95Å
118	I	98.8	Very high	98.7	Very high	21 Å²	21	27 Å²	27	11%	0.108	16%	0.155	C	C	.	.	H	α-helix	trans	-45.5	-49.3	177.1	-70.9	174.9	0	0	0	112.7	S120 I121 A122 F173 L217 M255 S258 V259	I118-S120 PolarHBondContact O-N 3.09Å; I118-I121 WeakPolarHBondContact O-CG2 3.48Å; I118-A122 VanDerWaalsContact O-CB 3.24Å; I118-A122 WeakPolarHBondContact O-CB 3.41Å; I118-A122 PolarHBondContact O-N 2.92Å; I118-F173 HydrophobicContact CD1-CE2 4.25Å; I118-F173 HydrophobicContact CG2-CE2 3.76Å; I118-F173 HydrophobicContact CG2-CZ 4.11Å; I118-L217 HydrophobicContact CB-CD2 4.24Å; I118-L217 HydrophobicContact CD1-CD2 3.69Å; I118-L217 HydrophobicContact CD1-CG 4.43Å; I118-L217 HydrophobicContact CG1-CD2 4.37Å; I118-M255 WeakPolarHBondContact CG1-O 3.21Å; I118-M255 PolarHBondContact N-O 3.39Å; I118-S258 WeakPolarHBondContact CD1-OG 3.48Å; I118-V259 HydrophobicContact CB-CG1 4.15Å; I118-V259 HydrophobicContact CG1-CG1 4.07Å; I118-V259 HydrophobicContact CG2-CB 3.98Å; I118-V259 HydrophobicContact CG2-CG1 3.87Å; I118-V259 HydrophobicContact CG2-CG2 4.45Å
119	P	98.8	Very high	98.8	Very high	91 Å²	91	26.4 Å²	26.4	59%	0.591	15%	0.151	S	C	*	.	H	α-helix	trans	-62.1	-40.7	-177.6	-24.7	35.8	0	0	0	113.3	G117 I123	G117-P119 VanDerWaalsContact C-CD 3.48Å; P119-I123 WeakPolarHBondContact O-CG1 3.12Å; P119-I123 PolarHBondContact O-N 3.31Å
120	S	98.9	Very high	98.8	Very high	30 Å²	30	28.3 Å²	28.3	21%	0.21	16%	0.159	C	C	.	.	H	α-helix	trans	-68.9	-46.1	-177.8	-171.8	0	0	0	0	111.3	Y101 H114 M116 G117 I118 A122 M124	Y101-S120 PolarHBondContact OH-O 3.31Å; H114-S120 CarbonylContact O-C 3.57Å; H114-S120 VanDerWaalsContact O-CB 3.32Å; H114-S120 WeakPolarHBondContact O-CB 3.47Å; H114-S120 PolarHBondContact O-OG 2.99Å; M116-S120 VanDerWaalsContact O-CB 3.3Å; M116-S120 WeakPolarHBondContact O-CB 3.38Å; G117-S120 PolarHBondContact O-N 3.32Å; G117-S120 VanDerWaalsContact O-N 3.13Å; I118-S120 PolarHBondContact O-N 3.09Å; S120-A122 VanDerWaalsContact C-N 3.35Å; S120-A122 PolarHBondContact O-N 3.21Å; S120-M124 PolarHBondContact O-N 2.97Å
121	I	98.9	Very high	98.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-70	-31.5	178.2	-166.6	171.9	0	0	0	112.4	H114 G117 I118 M124 L125 E256 V259 F260	H114-I121 HydrophobicContact CB-CB 4.16Å; H114-I121 HydrophobicContact CB-CG1 3.92Å; G117-I121 PolarHBondContact O-N 2.91Å; I118-I121 WeakPolarHBondContact O-CG2 3.48Å; I121-M124 HydrophobicContact CG1-CE 3.86Å; I121-M124 PolarHBondContact O-N 3.46Å; I121-L125 HydrophobicContact CD1-CD1 4.39Å; I121-L125 HydrophobicContact CG1-CD1 3.9Å; I121-L125 HydrophobicContact CG1-CG 4.08Å; I121-L125 WeakPolarHBondContact O-CB 3.4Å; I121-L125 VanDerWaalsContact O-CG 3.26Å; I121-L125 WeakPolarHBondContact O-CG 3.19Å; I121-L125 PolarHBondContact O-N 2.87Å; I121-E256 HydrophobicContact CB-CB 4.4Å; I121-E256 HydrophobicContact CB-CG 4.16Å; I121-E256 HydrophobicContact CD1-CB 3.83Å; I121-E256 HydrophobicContact CD1-CG 4.27Å; I121-E256 HydrophobicContact CG2-CB 3.91Å; I121-E256 HydrophobicContact CG2-CG 3.92Å; I121-V259 HydrophobicContact CG2-CG1 3.38Å; I121-F260 HydrophobicContact CD1-CB 4.18Å; I121-F260 HydrophobicContact CD1-CD2 4.12Å
122	A	98.9	Very high	98.8	Very high	19 Å²	19	28.2 Å²	28.2	16%	0.157	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-41.9	179	0	0	0	0	0	112.5	I118 S120 L125 H126 V259 M263	I118-A122 VanDerWaalsContact O-CB 3.24Å; I118-A122 WeakPolarHBondContact O-CB 3.41Å; I118-A122 PolarHBondContact O-N 2.92Å; S120-A122 VanDerWaalsContact C-N 3.35Å; S120-A122 PolarHBondContact O-N 3.21Å; A122-L125 PolarHBondContact O-N 2.95Å; A122-H126 PolarHBondContact O-CD2 3.16Å; A122-H126 VanDerWaalsContact O-CD2 3.28Å; A122-H126 PolarHBondContact O-N 3.23Å; A122-V259 HydrophobicContact CB-CG2 3.93Å; A122-M263 HydrophobicContact CB-SD 4.22Å
123	I	98.9	Very high	98.8	Very high	65 Å²	65	31 Å²	31	33%	0.333	17%	0.171	S	C	.	.	H	α-helix	trans	-60.9	-51.5	174.8	-66.9	166.8	0	0	0	110	H42 Y101 P119 L125 H126 E127	H42-I123 HydrophobicContact CB-CG2 4.14Å; H42-I123 VanDerWaalsContact CG-CG2 3.49Å; H42-I123 WeakPolarHBondContact ND1-CG2 3.39Å; Y101-I123 HydrophobicContact CE2-CG2 4.02Å; Y101-I123 WeakPolarHBondContact OH-CB 3.45Å; P119-I123 WeakPolarHBondContact O-CG1 3.12Å; P119-I123 PolarHBondContact O-N 3.31Å; I123-L125 VanDerWaalsContact C-N 3.32Å; I123-L125 PolarHBondContact O-N 2.77Å; I123-H126 PolarHBondContact O-N 3.27Å; I123-E127 PolarHBondContact O-N 3.37Å
124	M	98.9	Very high	98.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-54.8	-48	177.7	-176.1	-74	-67.7	0	0	111	F43 V64 Y101 V112 H114 S120 I121 H126 E127 L128	F43-M124 HydrophobicContact CE1-CG 4.07Å; F43-M124 HydrophobicContact CZ-CG 3.9Å; F43-M124 HydrophobicContact CZ-SD 4.29Å; V64-M124 HydrophobicContact CB-CE 3.96Å; V64-M124 HydrophobicContact CG1-CE 3.81Å; V64-M124 HydrophobicContact CG1-SD 4.39Å; V64-M124 HydrophobicContact CG2-CE 4.28Å; Y101-M124 HydrophobicContact CD1-CB 4.28Å; Y101-M124 HydrophobicContact CD1-CG 4.31Å; Y101-M124 HydrophobicContact CD2-CB 4.33Å; Y101-M124 HydrophobicContact CD2-CG 4.48Å; Y101-M124 HydrophobicContact CE1-CB 3.89Å; Y101-M124 HydrophobicContact CE1-CG 4.4Å; Y101-M124 HydrophobicContact CE2-CB 3.95Å; Y101-M124 HydrophobicContact CG-CB 4.5Å; Y101-M124 HydrophobicContact CG-CG 4.35Å; V112-M124 HydrophobicContact CB-SD 4.37Å; V112-M124 HydrophobicContact CG1-CG 3.93Å; V112-M124 HydrophobicContact CG1-SD 3.92Å; H114-M124 HydrophobicContact CB-CB 4.08Å; H114-M124 HydrophobicContact CB-CE 3.7Å; H114-M124 HydrophobicContact CB-CG 3.96Å; S120-M124 PolarHBondContact O-N 2.97Å; I121-M124 HydrophobicContact CG1-CE 3.86Å; I121-M124 PolarHBondContact O-N 3.46Å; M124-H126 PolarHBondContact O-N 2.93Å; M124-E127 PolarHBondContact O-N 3.09Å; M124-L128 HydrophobicContact CE-CD2 4.46Å; M124-L128 WeakPolarHBondContact O-CB 3.32Å; M124-L128 PolarHBondContact O-N 2.91Å; M124-L128 HydrophobicContact SD-CB 3.98Å; M124-L128 HydrophobicContact SD-CD2 3.71Å; M124-L128 HydrophobicContact SD-CG 4.46Å
125	L	98.9	Very high	98.7	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-41.7	-179.6	-75.1	169.7	0	0	0	112.4	I121 A122 I123 E127 L128 I129 I142 F260 M263	I121-L125 HydrophobicContact CD1-CD1 4.39Å; I121-L125 HydrophobicContact CG1-CD1 3.9Å; I121-L125 HydrophobicContact CG1-CG 4.08Å; I121-L125 WeakPolarHBondContact O-CB 3.4Å; I121-L125 VanDerWaalsContact O-CG 3.26Å; I121-L125 WeakPolarHBondContact O-CG 3.19Å; I121-L125 PolarHBondContact O-N 2.87Å; A122-L125 PolarHBondContact O-N 2.95Å; I123-L125 VanDerWaalsContact C-N 3.32Å; I123-L125 PolarHBondContact O-N 2.77Å; L125-E127 PolarHBondContact O-N 3.42Å; L125-L128 HydrophobicContact CD2-CD2 4.49Å; L125-L128 PolarHBondContact O-N 2.73Å; L125-I129 HydrophobicContact CB-CD1 4.33Å; L125-I129 VanDerWaalsContact O-CB 3.3Å; L125-I129 WeakPolarHBondContact O-CB 3.26Å; L125-I129 VanDerWaalsContact O-CD1 3.28Å; L125-I129 WeakPolarHBondContact O-CD1 3.4Å; L125-I129 WeakPolarHBondContact O-CG1 3.5Å; L125-I129 PolarHBondContact O-N 2.85Å; L125-I142 HydrophobicContact CD2-CD1 4.02Å; L125-F260 HydrophobicContact CD1-CB 4.32Å; L125-F260 HydrophobicContact CD1-CD2 4.17Å; L125-F260 HydrophobicContact CD2-CD2 4.13Å; L125-F260 HydrophobicContact CD2-CE2 4.43Å; L125-M263 HydrophobicContact CB-CE 3.68Å; L125-M263 HydrophobicContact CB-SD 3.93Å; L125-M263 HydrophobicContact CD1-CB 4.3Å; L125-M263 HydrophobicContact CD1-SD 4.07Å
126	H	98.9	Very high	98.7	Very high	105 Å²	105	41.5 Å²	41.5	49%	0.486	21%	0.205	S	C	.	.	H	α-helix	trans	-58.1	-48.4	177.4	-92.9	-65	0	0	0	111.7	A122 I123 M124 K130 M263	A122-H126 PolarHBondContact O-CD2 3.16Å; A122-H126 VanDerWaalsContact O-CD2 3.28Å; A122-H126 PolarHBondContact O-N 3.23Å; I123-H126 PolarHBondContact O-N 3.27Å; M124-H126 PolarHBondContact O-N 2.93Å; H126-K130 WeakPolarHBondContact O-CG 3.24Å; H126-K130 PolarHBondContact O-N 2.69Å; H126-M263 HydrophobicContact CB-CE 4.24Å; H126-M263 WeakPolarHBondContact CD2-CE 3.07Å
127	E	98.9	Very high	98.7	Very high	17 Å²	17	34 Å²	34	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-71.8	-36.5	179.4	-67.9	-169.2	-172.8	0	0	112.3	L40 Y41 H42 F43 I123 M124 L125 K130 L131	L40-E127 WeakPolarHBondContact CA-OE2 3.36Å; L40-E127 HydrophobicContact CB-CB 4.32Å; L40-E127 HydrophobicContact CB-CG 4.4Å; L40-E127 HydrophobicContact CD2-CB 4.19Å; L40-E127 HydrophobicContact CD2-CG 4.29Å; Y41-E127 PolarHBondContact N-OE1 3.5Å; Y41-E127 PolarHBondContact N-OE2 3.15Å; H42-E127 IonicContact CE1-OE1 3.78Å; H42-E127 IonicContact CG-OE1 3.57Å; H42-E127 PolarHBondContact N-OE1 3.47Å; H42-E127 VanDerWaalsContact N-OE1 3.12Å; H42-E127 PolarHBondContact N-OE2 3.41Å; H42-E127 IonicContact ND1-OE1 2.73Å; H42-E127 PolarHBondContact ND1-OE1 3.02Å; F43-E127 HydrophobicContact CD2-CB 3.79Å; F43-E127 HydrophobicContact CE2-CB 3.64Å; F43-E127 HydrophobicContact CZ-CB 4.32Å; F43-E127 PolarHBondContact N-OE2 3.45Å; I123-E127 PolarHBondContact O-N 3.37Å; M124-E127 PolarHBondContact O-N 3.09Å; L125-E127 PolarHBondContact O-N 3.42Å; E127-K130 PolarHBondContact O-N 2.96Å; E127-L131 WeakPolarHBondContact O-CB 3.31Å; E127-L131 PolarHBondContact O-N 3.42Å
128	L	98.9	Very high	98.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.2	-45.6	177.8	174.5	64.5	0	0	0	112	F43 V62 V64 L110 V112 M124 L125 K130 L131 L132 I142	F43-L128 HydrophobicContact CE2-CB 4.09Å; F43-L128 HydrophobicContact CZ-CB 4.21Å; V62-L128 HydrophobicContact CG1-CD1 4.39Å; V62-L128 HydrophobicContact CG1-CD2 3.87Å; V64-L128 HydrophobicContact CG1-CD2 4.26Å; L110-L128 HydrophobicContact CD2-CD1 3.84Å; V112-L128 HydrophobicContact CG2-CD1 4.37Å; M124-L128 HydrophobicContact CE-CD2 4.46Å; M124-L128 WeakPolarHBondContact O-CB 3.32Å; M124-L128 PolarHBondContact O-N 2.91Å; M124-L128 HydrophobicContact SD-CB 3.98Å; M124-L128 HydrophobicContact SD-CD2 3.71Å; M124-L128 HydrophobicContact SD-CG 4.46Å; L125-L128 HydrophobicContact CD2-CD2 4.49Å; L125-L128 PolarHBondContact O-N 2.73Å; L128-K130 VanDerWaalsContact C-N 3.32Å; L128-K130 PolarHBondContact O-N 2.64Å; L128-L131 WeakPolarHBondContact O-CB 3.34Å; L128-L131 PolarHBondContact O-N 3.12Å; L128-L132 HydrophobicContact CD1-CD1 4.27Å; L128-L132 HydrophobicContact CD1-CG 4.2Å; L128-L132 HydrophobicContact CG-CD1 4.24Å; L128-L132 VanDerWaalsContact O-CG 3.32Å; L128-L132 WeakPolarHBondContact O-CG 3.45Å; L128-L132 PolarHBondContact O-N 3.03Å; L128-I142 HydrophobicContact CD2-CD1 3.86Å
129	I	98.9	Very high	98.5	Very high	9 Å²	9	37.3 Å²	37.3	5%	0.046	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-44.5	177.9	-71.4	158.3	0	0	0	109.8	I25 V27 L125 L132 H133 M263 S267 L269	I25-I129 HydrophobicContact CG2-CG2 3.96Å; V27-I129 HydrophobicContact CG1-CG2 3.99Å; L125-I129 HydrophobicContact CB-CD1 4.33Å; L125-I129 VanDerWaalsContact O-CB 3.3Å; L125-I129 WeakPolarHBondContact O-CB 3.26Å; L125-I129 VanDerWaalsContact O-CD1 3.28Å; L125-I129 WeakPolarHBondContact O-CD1 3.4Å; L125-I129 WeakPolarHBondContact O-CG1 3.5Å; L125-I129 PolarHBondContact O-N 2.85Å; I129-L132 PolarHBondContact O-N 3.23Å; I129-H133 VanDerWaalsContact O-CB 3.32Å; I129-H133 WeakPolarHBondContact O-CB 3.35Å; I129-H133 PolarHBondContact O-N 2.58Å; I129-M263 HydrophobicContact CD1-CB 4.32Å; I129-M263 HydrophobicContact CD1-CE 4.18Å; I129-S267 VanDerWaalsContact CD1-OG 3.26Å; I129-S267 WeakPolarHBondContact CD1-OG 3.32Å; I129-S267 WeakPolarHBondContact CG2-OG 3.46Å; I129-L269 HydrophobicContact CG1-CD1 3.92Å
130	K	98.8	Very high	98.5	Very high	43 Å²	43	33.1 Å²	33.1	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-42.5	174.4	-70.9	-167.9	-54.3	159.4	0	111.9	L32 D38 L40 H126 E127 L128 L132 H133 H134	L32-K130 HydrophobicContact CD1-CD 3.77Å; L32-K130 HydrophobicContact CD2-CD 4.32Å; L32-K130 HydrophobicContact CD2-CG 4.24Å; D38-K130 IonicContact OD1-NZ 2.79Å; D38-K130 PolarHBondContact OD1-NZ 3.19Å; D38-K130 WeakPolarHBondContact OD2-CD 3.25Å; D38-K130 WeakPolarHBondContact OD2-CE 3.39Å; D38-K130 IonicContact OD2-NZ 2.89Å; D38-K130 PolarHBondContact OD2-NZ 2.94Å; L40-K130 HydrophobicContact CD2-CB 4.06Å; L40-K130 VanDerWaalsContact CD2-CE 3.49Å; H126-K130 WeakPolarHBondContact O-CG 3.24Å; H126-K130 PolarHBondContact O-N 2.69Å; E127-K130 PolarHBondContact O-N 2.96Å; L128-K130 VanDerWaalsContact C-N 3.32Å; L128-K130 PolarHBondContact O-N 2.64Å; K130-L132 PolarHBondContact O-N 2.72Å; K130-H133 WeakPolarHBondContact O-CB 3.39Å; K130-H133 PolarHBondContact O-N 3.3Å; K130-H134 WeakPolarHBondContact O-CB 3.5Å; K130-H134 PolarHBondContact O-CD2 3.46Å; K130-H134 VanDerWaalsContact O-CG 3.28Å; K130-H134 PolarHBondContact O-N 2.84Å
131	L	98.8	Very high	98.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.8	-49.7	176.5	179.2	146.1	0	0	0	111.6	L40 F43 L45 F56 M103 E127 L128 H133 H134 A135	L40-L131 HydrophobicContact CD1-CB 3.69Å; L40-L131 HydrophobicContact CD1-CD1 4.01Å; L40-L131 HydrophobicContact CD1-CG 4.28Å; F43-L131 HydrophobicContact CD2-CD1 4.42Å; L45-L131 HydrophobicContact CD1-CD1 3.6Å; F56-L131 HydrophobicContact CB-CD2 4.08Å; F56-L131 HydrophobicContact CD1-CD2 4.05Å; F56-L131 HydrophobicContact CD2-CD1 4.18Å; F56-L131 HydrophobicContact CD2-CD2 3.87Å; F56-L131 HydrophobicContact CD2-CG 4.07Å; F56-L131 HydrophobicContact CE1-CD2 4.44Å; F56-L131 HydrophobicContact CE2-CD1 3.82Å; F56-L131 HydrophobicContact CE2-CD2 4.29Å; F56-L131 HydrophobicContact CE2-CG 4.22Å; F56-L131 HydrophobicContact CG-CD2 3.74Å; F56-L131 HydrophobicContact CG-CG 4.45Å; F56-L131 HydrophobicContact CZ-CD1 4.01Å; M103-L131 HydrophobicContact CE-CD1 4.37Å; M103-L131 HydrophobicContact SD-CD1 4.48Å; E127-L131 WeakPolarHBondContact O-CB 3.31Å; E127-L131 PolarHBondContact O-N 3.42Å; L128-L131 WeakPolarHBondContact O-CB 3.34Å; L128-L131 PolarHBondContact O-N 3.12Å; L131-H133 VanDerWaalsContact C-N 3.31Å; L131-H133 PolarHBondContact O-N 2.98Å; L131-H134 PolarHBondContact O-N 3.33Å; L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 2.8Å
132	L	98.7	Very high	98.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-38	178.6	-64.4	172.2	0	0	0	111.7	I25 V59 V62 L128 I129 K130 R136 C137 V140 L269	I25-L132 HydrophobicContact CG1-CB 4.05Å; V59-L132 HydrophobicContact CB-CD2 4.41Å; V59-L132 HydrophobicContact CG1-CD2 4.05Å; V62-L132 HydrophobicContact CG2-CD1 4.2Å; V62-L132 HydrophobicContact CG2-CD2 4.3Å; L128-L132 HydrophobicContact CD1-CD1 4.27Å; L128-L132 HydrophobicContact CD1-CG 4.2Å; L128-L132 HydrophobicContact CG-CD1 4.24Å; L128-L132 VanDerWaalsContact O-CG 3.32Å; L128-L132 WeakPolarHBondContact O-CG 3.45Å; L128-L132 PolarHBondContact O-N 3.03Å; I129-L132 PolarHBondContact O-N 3.23Å; K130-L132 PolarHBondContact O-N 2.72Å; L132-R136 PolarHBondContact O-N 2.9Å; L132-C137 HydrophobicContact CB-CB 4.24Å; L132-C137 HydrophobicContact CD2-CB 4.31Å; L132-C137 WeakPolarHBondContact O-CB 3.42Å; L132-C137 PolarHBondContact O-N 2.77Å; L132-V140 HydrophobicContact CD1-CG1 4.28Å; L132-L269 HydrophobicContact CD1-CD2 4.48Å
133	H	98.2	Very high	98.5	Very high	58 Å²	58	31.4 Å²	31.4	27%	0.269	15%	0.145	S	C	.	.	H	α-helix	trans	-63.1	-52	174.6	175.6	80.5	0	0	0	111.8	I25 V27 I129 K130 L131 A135 R136	I25-H133 HydrophobicContact CG2-CB 4.48Å; I25-H133 PolarHBondContact O-ND1 2.81Å; V27-H133 HydrophobicContact CG1-CB 3.77Å; I129-H133 VanDerWaalsContact O-CB 3.32Å; I129-H133 WeakPolarHBondContact O-CB 3.35Å; I129-H133 PolarHBondContact O-N 2.58Å; K130-H133 WeakPolarHBondContact O-CB 3.39Å; K130-H133 PolarHBondContact O-N 3.3Å; L131-H133 VanDerWaalsContact C-N 3.31Å; L131-H133 PolarHBondContact O-N 2.98Å; H133-A135 VanDerWaalsContact C-N 3.26Å; H133-A135 PolarHBondContact O-N 3.01Å; H133-R136 WeakPolarHBondContact O-CA 3.31Å; H133-R136 PolarHBondContact O-N 2.82Å
134	H	98.3	Very high	98.5	Very high	42 Å²	42	28.6 Å²	28.6	19%	0.194	13%	0.13	C	C	.	.	H	α-helix	trans	-62.4	-33.6	177.8	-69.8	-47.5	0	0	0	112.4	D38 T47 L52 K130 L131 R136	D38-H134 IonicContact OD2-CD2 3.15Å; D38-H134 IonicContact OD2-CE1 3.25Å; D38-H134 IonicContact OD2-NE2 2.88Å; D38-H134 PolarHBondContact OD2-NE2 3.42Å; T47-H134 HydrophobicContact CG2-CB 4.31Å; L52-H134 HydrophobicContact CB-CB 4.48Å; L52-H134 HydrophobicContact CD1-CB 3.72Å; K130-H134 WeakPolarHBondContact O-CB 3.5Å; K130-H134 PolarHBondContact O-CD2 3.46Å; K130-H134 VanDerWaalsContact O-CG 3.28Å; K130-H134 PolarHBondContact O-N 2.84Å; L131-H134 PolarHBondContact O-N 3.33Å; H134-R136 PolarHBondContact O-N 3.24Å
135	A	98.3	Very high	98.5	Very high	2 Å²	2	28.7 Å²	28.7	2%	0.017	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-5.3	174.3	0	0	0	0	0	113.9	L52 F56 G57 L131 H133 C137	L52-A135 HydrophobicContact CB-CB 4.44Å; L52-A135 WeakPolarHBondContact O-CB 3.41Å; F56-A135 HydrophobicContact CB-CB 3.69Å; G57-A135 WeakPolarHBondContact CA-O 3.4Å; L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 2.8Å; H133-A135 VanDerWaalsContact C-N 3.26Å; H133-A135 PolarHBondContact O-N 3.01Å; A135-C137 VanDerWaalsContact C-N 3.25Å; A135-C137 PolarHBondContact O-N 2.79Å
136	R	97.7	Very high	98.5	Very high	203 Å²	203	28.8 Å²	28.8	77%	0.766	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	34.8	-178.4	-51.3	179	-176.9	-180	-0.4	112.9	L132 H133 H134	L132-R136 PolarHBondContact O-N 2.9Å; H133-R136 WeakPolarHBondContact O-CA 3.31Å; H133-R136 PolarHBondContact O-N 2.82Å; H134-R136 PolarHBondContact O-N 3.24Å
137	C	98.3	Very high	98.5	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.02	12%	0.121	C	C	.	.			trans	-65.3	149.6	175.5	-59.9	0	0	0	0	110.9	F56 L132 A135 V140	F56-C137 PolarHBondContact O-SG 3.32Å; L132-C137 HydrophobicContact CB-CB 4.24Å; L132-C137 HydrophobicContact CD2-CB 4.31Å; L132-C137 WeakPolarHBondContact O-CB 3.42Å; L132-C137 PolarHBondContact O-N 2.77Å; A135-C137 VanDerWaalsContact C-N 3.25Å; A135-C137 PolarHBondContact O-N 2.79Å; C137-V140 HydrophobicContact CB-CG2 3.63Å
138	T	97.8	Very high	98.5	Very high	36 Å²	36	25.4 Å²	25.4	22%	0.221	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-138.4	154.2	177.9	49.8	0	0	0	0	109.8	S23 K60 V140	S23-T138 CarbonylContact O-C 3.41Å; S23-T138 VanDerWaalsContact O-CA 3.28Å; S23-T138 WeakPolarHBondContact O-CA 3.17Å; K60-T138 WeakPolarHBondContact CD-O 3.28Å; K60-T138 PolarHBondContact NZ-O 2.8Å; K60-T138 PolarHBondContact NZ-OG1 2.77Å; K60-T138 VanDerWaalsContact NZ-OG1 3.09Å; T138-V140 PolarHBondContact O-N 3.29Å
139	D	96.8	Very high	98.5	Very high	60 Å²	60	25.6 Å²	25.6	32%	0.321	12%	0.122	S	C	.	.	S	Bend	trans	54.7	37.1	175.4	-44.8	-57.3	0	0	0	113.3	S22 S23 K60	S22-D139 WeakPolarHBondContact CA-OD1 3.4Å; S23-D139 PolarHBondContact N-OD1 3.17Å; S23-D139 PolarHBondContact O-N 2.91Å; S23-D139 PolarHBondContact OG-OD1 3.22Å; K60-D139 IonicContact NZ-OD2 2.88Å
140	V	98.4	Very high	98.5	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.024	12%	0.12	C	C	.	.			trans	-80.8	129.3	-178.8	-177.5	0	0	0	0	109.8	I25 K60 V62 L132 C137 T138 L269	I25-V140 HydrophobicContact CD1-CB 4.09Å; I25-V140 HydrophobicContact CD1-CG2 4.1Å; K60-V140 WeakPolarHBondContact O-CA 3.32Å; V62-V140 HydrophobicContact CG2-CG1 3.76Å; L132-V140 HydrophobicContact CD1-CG1 4.28Å; C137-V140 HydrophobicContact CB-CG2 3.63Å; T138-V140 PolarHBondContact O-N 3.29Å; V140-L269 HydrophobicContact CB-CD2 3.8Å; V140-L269 HydrophobicContact CG1-CD2 3.97Å
141	T	98.8	Very high	98.5	Very high	11 Å²	11	23.3 Å²	23.3	7%	0.067	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.3	166.8	-62.1	0	0	0	0	109.5	K60 F61 V62 I143 L192 R270	K60-T141 PolarHBondContact O-N 3.42Å; F61-T141 CarbonylContact C-O 3.47Å; F61-T141 WeakPolarHBondContact CA-O 3.47Å; F61-T141 HydrophobicContact CD1-CG2 4.44Å; V62-T141 PolarHBondContact N-O 3Å; T141-I143 HydrophobicContact CG2-CD1 4.16Å; T141-I143 HydrophobicContact CG2-CG1 4.02Å; T141-L192 HydrophobicContact CG2-CD1 4.24Å; T141-L192 HydrophobicContact CG2-CD2 3.67Å; T141-R270 CarbonylContact C-O 3.55Å; T141-R270 WeakPolarHBondContact CA-O 3.46Å
142	I	98.9	Very high	98.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.3	177.6	-174.7	170.4	0	0	0	110.8	V62 V64 L125 L128 F260 C264 L269 R270 A271 A272	V62-I142 HydrophobicContact CB-CB 4.23Å; V62-I142 HydrophobicContact CB-CD1 4.37Å; V62-I142 HydrophobicContact CB-CG1 3.95Å; V62-I142 HydrophobicContact CG1-CD1 4.22Å; V62-I142 HydrophobicContact CG1-CG1 4.17Å; V62-I142 CarbonylContact O-C 3.59Å; V62-I142 VanDerWaalsContact O-CA 3.27Å; V62-I142 WeakPolarHBondContact O-CA 3.44Å; V64-I142 HydrophobicContact CG1-CD1 4.19Å; V64-I142 HydrophobicContact CG1-CG1 4.42Å; L125-I142 HydrophobicContact CD2-CD1 4.02Å; L128-I142 HydrophobicContact CD2-CD1 3.86Å; I142-F260 HydrophobicContact CD1-CE2 3.81Å; I142-F260 HydrophobicContact CD1-CZ 4.4Å; I142-F260 HydrophobicContact CG1-CE2 3.81Å; I142-F260 HydrophobicContact CG1-CZ 3.96Å; I142-F260 HydrophobicContact CG2-CE2 4.46Å; I142-F260 HydrophobicContact CG2-CZ 4.08Å; I142-C264 HydrophobicContact CG2-CB 4.37Å; I142-C264 VanDerWaalsContact CG2-SG 3.56Å; I142-L269 HydrophobicContact CG2-CB 3.98Å; I142-L269 HydrophobicContact CG2-CD1 4.32Å; I142-L269 HydrophobicContact CG2-CD2 4.48Å; I142-R270 PolarHBondContact N-O 2.62Å; I142-A271 HydrophobicContact CG2-CB 3.69Å; I142-A271 VanDerWaalsContact O-CA 3.23Å; I142-A271 WeakPolarHBondContact O-CA 3.37Å; I142-A272 PolarHBondContact O-N 2.95Å; I142-A272 VanDerWaalsContact O-N 3.11Å
143	I	98.9	Very high	98.4	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.1	-177.7	-54.5	172.8	0	0	0	109.5	V62 C63 V64 T141 I145 L196 A272 V274 V305 Y308	V62-I143 PolarHBondContact O-N 3.39Å; C63-I143 WeakPolarHBondContact CA-O 3.34Å; V64-I143 PolarHBondContact N-O 2.83Å; T141-I143 HydrophobicContact CG2-CD1 4.16Å; T141-I143 HydrophobicContact CG2-CG1 4.02Å; I143-I145 HydrophobicContact CG2-CG2 4.43Å; I143-L196 HydrophobicContact CD1-CD2 4.44Å; I143-A272 WeakPolarHBondContact CA-O 3.37Å; I143-A272 HydrophobicContact CG1-CB 4.45Å; I143-A272 HydrophobicContact CG2-CB 4.45Å; I143-V274 HydrophobicContact CG2-CG2 3.89Å; I143-V305 HydrophobicContact CB-CG1 4.38Å; I143-V305 HydrophobicContact CD1-CG1 3.92Å; I143-V305 HydrophobicContact CD1-CG2 4.43Å; I143-V305 HydrophobicContact CG2-CG1 4.39Å; I143-V305 HydrophobicContact CG2-CG2 3.71Å; I143-Y308 HydrophobicContact CD1-CD1 4.01Å; I143-Y308 HydrophobicContact CD1-CE1 4.06Å
144	R	98.9	Very high	98.4	Very high	6 Å²	6	28.4 Å²	28.4	2%	0.023	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.7	169.1	173.6	178.7	154.7	69.1	4.3	109.5	V64 H114 E254 E256 F260 A272 V273 V274	V64-R144 HydrophobicContact CG2-CB 3.92Å; V64-R144 HydrophobicContact CG2-CG 4.38Å; V64-R144 CarbonylContact O-C 3.59Å; V64-R144 WeakPolarHBondContact O-CA 3.32Å; H114-R144 PolarHBondContact CE1-NH1 2.91Å; H114-R144 PolarHBondContact NE2-NH1 3.34Å; R144-E254 IonicContact CZ-OE2 2.93Å; R144-E254 IonicContact NE-OE2 2.77Å; R144-E254 PolarHBondContact NE-OE2 3.36Å; R144-E254 IonicContact NH2-OE2 3.02Å; R144-E254 PolarHBondContact NH2-OE2 2.93Å; R144-E256 VanDerWaalsContact CZ-CB 3.48Å; R144-E256 IonicContact CZ-OE2 3.02Å; R144-E256 VanDerWaalsContact CZ-OE2 3.25Å; R144-E256 IonicContact NH1-OE2 2.91Å; R144-E256 IonicContact NH2-OE2 3.8Å; R144-E256 PolarHBondContact NH2-OE2 3.22Å; R144-F260 HydrophobicContact CB-CD1 4.38Å; R144-F260 HydrophobicContact CB-CD2 4.27Å; R144-F260 HydrophobicContact CB-CE1 4.13Å; R144-F260 HydrophobicContact CB-CE2 4.02Å; R144-F260 HydrophobicContact CB-CG 4.44Å; R144-F260 HydrophobicContact CB-CZ 3.94Å; R144-A272 PolarHBondContact N-O 2.82Å; R144-V273 HydrophobicContact CB-CB 4.49Å; R144-V273 HydrophobicContact CB-CG1 4.34Å; R144-V273 HydrophobicContact CB-CG2 4.16Å; R144-V273 HydrophobicContact CG-CG1 4.27Å; R144-V274 PolarHBondContact O-N 3.03Å
145	I	98.9	Very high	98.4	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.2	171.9	52	169.6	0	0	0	110.4	V64 G65 M71 F74 I143 V274 P301 Q302 V305	V64-I145 PolarHBondContact O-N 2.81Å; G65-I145 WeakPolarHBondContact CA-O 3.44Å; M71-I145 HydrophobicContact CE-CD1 4Å; M71-I145 HydrophobicContact CE-CG1 4.21Å; M71-I145 HydrophobicContact SD-CD1 4.07Å; M71-I145 HydrophobicContact SD-CG1 4.18Å; F74-I145 HydrophobicContact CB-CD1 4.33Å; F74-I145 HydrophobicContact CD2-CD1 4.01Å; F74-I145 HydrophobicContact CG-CD1 4.03Å; I143-I145 HydrophobicContact CG2-CG2 4.43Å; I145-V274 WeakPolarHBondContact CA-O 3.43Å; I145-P301 HydrophobicContact CB-CB 4.01Å; I145-P301 HydrophobicContact CG2-CB 3.98Å; I145-Q302 HydrophobicContact CD1-CG 3.83Å; I145-V305 HydrophobicContact CG2-CB 4.18Å; I145-V305 HydrophobicContact CG2-CG2 3.6Å
146	G	98.6	Very high	98.4	Very high	3 Å²	3	28 Å²	28	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	-178.5	-167.7	0	0	0	0	0	115.4	V274 C275 V276	G146-V274 PolarHBondContact N-O 3.31Å; G146-C275 WeakPolarHBondContact O-CA 3.2Å; G146-V276 PolarHBondContact O-N 2.96Å
147	T	98.8	Very high	98.5	Very high	41 Å²	41	18.5 Å²	18.5	25%	0.252	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	153.1	171.5	43.8	0	0	0	0	108.5	V276 L278 Q298	T147-V276 CarbonylContact C-O 3.58Å; T147-V276 WeakPolarHBondContact CA-O 3.24Å; T147-V276 HydrophobicContact CG2-CG1 3.83Å; T147-L278 HydrophobicContact CG2-CD1 3.89Å; T147-L278 HydrophobicContact CG2-CD2 3.97Å; T147-L278 HydrophobicContact CG2-CG 4.07Å; T147-Q298 HydrophobicContact CG2-CG 3.87Å
148	S	98.9	Very high	98.5	Very high	9 Å²	9	18.4 Å²	18.4	6%	0.063	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	164.2	-175.9	56.5	0	0	0	0	111.5	N252 I253 V276 T277 L278	S148-N252 VanDerWaalsContact CB-ND2 3.34Å; S148-N252 WeakPolarHBondContact CB-ND2 3.48Å; S148-N252 PolarHBondContact OG-ND2 2.97Å; S148-I253 VanDerWaalsContact CA-O 3.26Å; S148-I253 WeakPolarHBondContact CA-O 3.32Å; S148-I253 WeakPolarHBondContact CB-O 3.26Å; S148-V276 PolarHBondContact N-O 2.77Å; S148-V276 PolarHBondContact OG-O 3.29Å; S148-T277 CarbonylContact O-C 3.59Å; S148-T277 WeakPolarHBondContact O-CA 3.19Å; S148-L278 PolarHBondContact O-N 3.35Å
149	G	98.9	Very high	98.6	Very high	4 Å²	4	16.7 Å²	16.7	4%	0.041	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.7	162.9	0	0	0	0	0	109.6	N252 I253	G149-N252 CarbonylContact O-C 3.54Å; G149-N252 WeakPolarHBondContact O-CA 3.29Å; G149-N252 WeakPolarHBondContact O-CB 3.28Å; G149-I253 PolarHBondContact N-O 3.37Å; G149-I253 PolarHBondContact O-N 3.2Å
150	G	98.8	Very high	98.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	156.6	174.4	0	0	0	0	0	111.8	C251 T277 L279 R281	G150-C251 CarbonylContact C-O 3.42Å; G150-C251 WeakPolarHBondContact CA-O 3.48Å; G150-T277 VanDerWaalsContact CA-CG2 3.46Å; G150-L279 WeakPolarHBondContact CA-O 3.38Å; G150-L279 PolarHBondContact N-O 3.41Å; G150-R281 WeakPolarHBondContact O-CB 3.48Å; G150-R281 PolarHBondContact O-N 2.88Å
151	I	98.8	Very high	98.7	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.021	8%	0.083	C	C	.	.	S	Bend	trans	-120	103.8	172.5	-53.6	-178.4	0	0	0	108.3	L153 L242 A245 K246 V250 C251 I253 L282	I151-L153 VanDerWaalsContact C-N 3.27Å; I151-L153 PolarHBondContact O-N 3.05Å; I151-L242 HydrophobicContact CD1-CD2 4.23Å; I151-A245 HydrophobicContact CD1-CB 3.85Å; I151-K246 HydrophobicContact CG2-CB 3.93Å; I151-K246 HydrophobicContact CG2-CG 4.45Å; I151-V250 HydrophobicContact CD1-CB 4.31Å; I151-V250 HydrophobicContact CD1-CG1 3.79Å; I151-C251 PolarHBondContact N-O 3.09Å; I151-I253 HydrophobicContact CD1-CD1 3.88Å; I151-I253 HydrophobicContact CD1-CG1 3.86Å; I151-I253 HydrophobicContact CG1-CD1 4.14Å; I151-I253 HydrophobicContact CG1-CG1 4.11Å; I151-L282 HydrophobicContact CG2-CD1 4.19Å; I151-L282 HydrophobicContact CG2-CD2 4.27Å; I151-L282 HydrophobicContact CG2-CG 4.11Å
152	G	98.1	Very high	98.7	Very high	31 Å²	31	16.8 Å²	16.8	32%	0.32	10%	0.095	S	C	.	.	S	Bend	trans	67	28	-177.6	0	0	0	0	0	113.9	D280	G152-D280 PolarHBondContact N-OD1 2.96Å
153	L	98.4	Very high	98.7	Very high	25 Å²	25	18.3 Å²	18.3	13%	0.131	10%	0.102	C	C	.	.	S	Bend	trans	-119.3	144.4	175.3	-66.4	-178.8	0	0	0	109.9	I151 T157 V159 V209 C251 T277 D280	I151-L153 VanDerWaalsContact C-N 3.27Å; I151-L153 PolarHBondContact O-N 3.05Å; L153-T157 HydrophobicContact CD1-CG2 4.07Å; L153-V159 HydrophobicContact CD1-CG2 3.69Å; L153-V209 HydrophobicContact CD1-CG2 4.04Å; L153-C251 HydrophobicContact CD1-CB 3.95Å; L153-T277 HydrophobicContact CD1-CG2 4.2Å; L153-D280 WeakPolarHBondContact O-CB 3.19Å
154	E	97.9	Very high	98.7	Very high	110 Å²	110	18.2 Å²	18.2	51%	0.514	10%	0.102	S	C	.	.			trans	-65	141	174	-70.6	-57.2	133.9	0	0	111	G156 T157 T277 K283	E154-G156 PolarHBondContact O-N 3.16Å; E154-T157 WeakPolarHBondContact O-CB 3.33Å; E154-T157 PolarHBondContact O-N 2.73Å; E154-T157 VanDerWaalsContact O-N 3.16Å; E154-T157 PolarHBondContact O-OG1 3.38Å; E154-T277 PolarHBondContact O-OG1 3Å; E154-K283 IonicContact OE1-NZ 2.59Å; E154-K283 PolarHBondContact OE1-NZ 3.16Å; E154-K283 IonicContact OE2-NZ 2.76Å
155	P	98.5	Very high	98.7	Very high	35 Å²	35	18.1 Å²	18.1	23%	0.227	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	136.2	176.7	-24.9	34.4	0	0	0	111.9	Y297	P155-Y297 HydrophobicContact CB-CE2 3.74Å; P155-Y297 PolarHBondContact O-OH 2.98Å
156	G	98.4	Very high	98.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-9.8	-176.1	0	0	0	0	0	113.8	E154 V158 V276 T277 R300	E154-G156 PolarHBondContact O-N 3.16Å; G156-V158 PolarHBondContact O-N 2.91Å; G156-V276 WeakPolarHBondContact O-CG2 3.39Å; G156-T277 WeakPolarHBondContact CA-O 3.37Å; G156-T277 PolarHBondContact N-O 3.23Å; G156-T277 PolarHBondContact N-OG1 3.42Å; G156-R300 WeakPolarHBondContact O-CD 3.34Å; G156-R300 PolarHBondContact O-NH1 3.04Å
157	T	98.9	Very high	98.6	Very high	4 Å²	4	21.4 Å²	21.4	3%	0.025	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-59.3	134.3	173.8	-57.8	0	0	0	0	110.2	L153 E154 E207 V209 T277	L153-T157 HydrophobicContact CD1-CG2 4.07Å; E154-T157 WeakPolarHBondContact O-CB 3.33Å; E154-T157 PolarHBondContact O-N 2.73Å; E154-T157 VanDerWaalsContact O-N 3.16Å; E154-T157 PolarHBondContact O-OG1 3.38Å; T157-E207 HydrophobicContact CG2-CB 4.31Å; T157-E207 HydrophobicContact CG2-CG 4.09Å; T157-V209 HydrophobicContact CG2-CG1 4.35Å; T157-V209 HydrophobicContact CG2-CG2 4.12Å; T157-T277 PolarHBondContact N-OG1 2.91Å; T157-T277 PolarHBondContact O-N 2.79Å; T157-T277 PolarHBondContact O-OG1 2.6Å
158	V	98.9	Very high	98.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.1	174.5	177.5	0	0	0	0	109.3	G156 F206 E207 T208 V209 V274 C275 V276 R300 L304	G156-V158 PolarHBondContact O-N 2.91Å; V158-F206 HydrophobicContact CB-CD2 4.26Å; V158-F206 HydrophobicContact CB-CE2 4.36Å; V158-F206 HydrophobicContact CG2-CD2 3.63Å; V158-F206 HydrophobicContact CG2-CE2 3.78Å; V158-F206 HydrophobicContact CG2-CG 4.48Å; V158-E207 PolarHBondContact N-O 3.2Å; V158-T208 HydrophobicContact CB-CG2 4.27Å; V158-T208 HydrophobicContact CG1-CG2 4.22Å; V158-T208 CarbonylContact O-C 3.49Å; V158-T208 WeakPolarHBondContact O-CA 3.28Å; V158-V209 PolarHBondContact O-N 2.93Å; V158-V274 HydrophobicContact CG1-CG1 3.56Å; V158-C275 CarbonylContact C-O 3.5Å; V158-C275 WeakPolarHBondContact CA-O 3.41Å; V158-V276 HydrophobicContact CG2-CB 4.44Å; V158-V276 HydrophobicContact CG2-CG2 4.39Å; V158-R300 HydrophobicContact CG2-CB 3.58Å; V158-L304 HydrophobicContact CG1-CD2 4.11Å
159	V	98.9	Very high	98.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.7	173.7	-177.1	0	0	0	0	108.5	L153 V209 C251 N252 C275 T277	L153-V159 HydrophobicContact CD1-CG2 3.69Å; V159-V209 WeakPolarHBondContact CA-O 3.44Å; V159-V209 HydrophobicContact CB-CG2 4.49Å; V159-V209 HydrophobicContact CG2-CG2 3.91Å; V159-C251 HydrophobicContact CG1-CB 4.04Å; V159-C251 HydrophobicContact CG2-CB 4.13Å; V159-N252 HydrophobicContact CB-CB 4.5Å; V159-N252 HydrophobicContact CG2-CB 4.08Å; V159-C275 PolarHBondContact N-O 2.78Å; V159-C275 PolarHBondContact O-N 3.06Å; V159-T277 HydrophobicContact CG2-CG2 4.01Å
160	V	98.9	Very high	98.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	116	165.2	-178.6	0	0	0	0	107.2	K162 A193 L196 T208 V209 I210 G211 V274 L304	V160-K162 PolarHBondContact O-N 3.34Å; V160-A193 HydrophobicContact CG1-CB 3.83Å; V160-L196 HydrophobicContact CG1-CB 4.32Å; V160-L196 HydrophobicContact CG1-CD1 4.21Å; V160-L196 HydrophobicContact CG2-CB 4.26Å; V160-T208 HydrophobicContact CG2-CG2 3.84Å; V160-V209 PolarHBondContact N-O 3.36Å; V160-I210 HydrophobicContact CB-CG1 4.13Å; V160-I210 WeakPolarHBondContact O-CA 3.28Å; V160-G211 PolarHBondContact O-N 3.38Å; V160-V274 HydrophobicContact CG2-CG2 4.38Å; V160-L304 HydrophobicContact CG2-CD2 4.32Å
161	T	98.9	Very high	98.6	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	121.2	-172.3	-55.6	0	0	0	0	111.3	Q163 L188 G211 T213 V273	T161-Q163 VanDerWaalsContact CG2-C 3.42Å; T161-Q163 VanDerWaalsContact CG2-O 3.31Å; T161-Q163 WeakPolarHBondContact CG2-O 3.32Å; T161-L188 HydrophobicContact CG2-CD1 3.72Å; T161-G211 WeakPolarHBondContact CA-O 3.32Å; T161-T213 WeakPolarHBondContact CB-OG1 3.41Å; T161-T213 VanDerWaalsContact CG2-OG1 3.32Å; T161-T213 WeakPolarHBondContact CG2-OG1 3.35Å; T161-T213 PolarHBondContact OG1-OG1 2.97Å; T161-V273 PolarHBondContact N-O 2.76Å; T161-V273 WeakPolarHBondContact OG1-CB 3.11Å
162	K	98.4	Very high	98.5	Very high	77 Å²	77	35.2 Å²	35.2	34%	0.335	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	-54.2	168.3	-179.6	-176.1	169.9	-171	0	110.5	V160 Q190 I210 G211 E249	V160-K162 PolarHBondContact O-N 3.34Å; K162-Q190 PolarHBondContact O-NE2 2.82Å; K162-I210 HydrophobicContact CB-CG2 3.7Å; K162-I210 HydrophobicContact CG-CG2 4.33Å; K162-G211 PolarHBondContact N-O 3.28Å; K162-E249 IonicContact NZ-OE2 3.1Å; K162-E249 PolarHBondContact NZ-OE2 3.03Å; K162-E249 VanDerWaalsContact NZ-OE2 3.1Å
163	Q	98.1	Very high	98.6	Very high	31 Å²	31	34.5 Å²	34.5	15%	0.145	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	137.4	-179.3	-169.4	73.7	33.9	0	0	108.8	T161 V165 P171 T186 D187 N212 T213	T161-Q163 VanDerWaalsContact CG2-C 3.42Å; T161-Q163 VanDerWaalsContact CG2-O 3.31Å; T161-Q163 WeakPolarHBondContact CG2-O 3.32Å; Q163-V165 HydrophobicContact CG-CG1 4.31Å; Q163-P171 HydrophobicContact CG-CB 3.55Å; Q163-T186 PolarHBondContact NE2-O 3.3Å; Q163-T186 PolarHBondContact NE2-OG1 3.03Å; Q163-D187 PolarHBondContact NE2-OD1 3.44Å; Q163-N212 WeakPolarHBondContact O-CA 3.23Å; Q163-T213 PolarHBondContact O-N 3.09Å
164	S	98.6	Very high	98.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.8	167.3	180	0	0	0	0	109.5	T186 T213 S257 S258	S164-T186 WeakPolarHBondContact O-CB 3.41Å; S164-T186 PolarHBondContact O-OG1 2.99Å; S164-T213 CarbonylContact C-O 3.55Å; S164-T213 WeakPolarHBondContact CA-O 3.32Å; S164-S257 WeakPolarHBondContact CB-OG 3.43Å; S164-S257 VanDerWaalsContact OG-C 3.3Å; S164-S257 WeakPolarHBondContact OG-CB 3.35Å; S164-S257 PolarHBondContact OG-OG 2.92Å; S164-S258 WeakPolarHBondContact OG-CA 3.41Å; S164-S258 PolarHBondContact OG-N 3.2Å
165	V	98.9	Very high	98.5	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	154.5	-179.8	-60	0	0	0	0	111.1	Q163 Q170 P171 N212 T213 M214 C215 V250	Q163-V165 HydrophobicContact CG-CG1 4.31Å; V165-Q170 CarbonylContact C-O 3.58Å; V165-Q170 VanDerWaalsContact CA-O 3.25Å; V165-Q170 WeakPolarHBondContact CA-O 3.37Å; V165-P171 HydrophobicContact CG1-CB 4.47Å; V165-N212 HydrophobicContact CG1-CB 4.46Å; V165-T213 PolarHBondContact N-O 3.33Å; V165-M214 HydrophobicContact CG2-CB 4.19Å; V165-M214 WeakPolarHBondContact O-CA 3.35Å; V165-C215 PolarHBondContact O-N 3.28Å; V165-V250 HydrophobicContact CG2-CG2 3.81Å
166	D	98.7	Very high	98.5	Very high	29 Å²	29	38.3 Å²	38.3	16%	0.155	20%	0.203	C	C	.	.			trans	-78.4	-178.5	174.1	71.3	9.1	0	0	0	112.3	T168 F169 Q170 K172	D166-T168 VanDerWaalsContact CG-OG1 3.28Å; D166-T168 PolarHBondContact O-N 3.29Å; D166-T168 VanDerWaalsContact O-N 3.08Å; D166-T168 VanDerWaalsContact OD1-C 3.24Å; D166-T168 VanDerWaalsContact OD1-CA 3.24Å; D166-T168 WeakPolarHBondContact OD1-CA 3.34Å; D166-T168 WeakPolarHBondContact OD1-CB 3.33Å; D166-T168 PolarHBondContact OD1-N 2.82Å; D166-T168 PolarHBondContact OD1-OG1 3.17Å; D166-T168 PolarHBondContact OD2-OG1 3.41Å; D166-F169 WeakPolarHBondContact O-CA 3.18Å; D166-F169 PolarHBondContact O-N 3.31Å; D166-F169 PolarHBondContact OD1-N 2.88Å; D166-F169 VanDerWaalsContact OD1-N 3.1Å; D166-Q170 PolarHBondContact N-O 3.3Å; D166-Q170 PolarHBondContact OD1-N 3.14Å; D166-K172 WeakPolarHBondContact OD2-CE 3.47Å; D166-K172 WeakPolarHBondContact OD2-CG 3.39Å; D166-K172 IonicContact OD2-NZ 3.88Å
167	A	98.1	Very high	98.5	Very high	46 Å²	46	41.2 Å²	41.2	38%	0.38	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-2.6	177.1	0	0	0	0	0	114.3	Y241	A167-Y241 PolarHBondContact O-OH 2.97Å
168	T	98.3	Very high	98.5	Very high	85 Å²	85	49.3 Å²	49.3	52%	0.521	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	12.4	170.4	70.9	0	0	0	0	112.2	D166 Q170	D166-T168 VanDerWaalsContact CG-OG1 3.28Å; D166-T168 PolarHBondContact O-N 3.29Å; D166-T168 VanDerWaalsContact O-N 3.08Å; D166-T168 VanDerWaalsContact OD1-C 3.24Å; D166-T168 VanDerWaalsContact OD1-CA 3.24Å; D166-T168 WeakPolarHBondContact OD1-CA 3.34Å; D166-T168 WeakPolarHBondContact OD1-CB 3.33Å; D166-T168 PolarHBondContact OD1-N 2.82Å; D166-T168 PolarHBondContact OD1-OG1 3.17Å; D166-T168 PolarHBondContact OD2-OG1 3.41Å; T168-Q170 PolarHBondContact O-N 2.96Å
169	F	98.6	Very high	98.4	Very high	40 Å²	40	52.6 Å²	52.6	18%	0.175	29%	0.294	C	S	.	.	S	Bend	trans	63.1	20.9	-179.9	-36.2	-50.3	0	0	0	114.2	D166 M214 Y241 K244 A245 A248 V250	D166-F169 WeakPolarHBondContact O-CA 3.18Å; D166-F169 PolarHBondContact O-N 3.31Å; D166-F169 PolarHBondContact OD1-N 2.88Å; D166-F169 VanDerWaalsContact OD1-N 3.1Å; F169-M214 HydrophobicContact CD1-SD 4.07Å; F169-M214 HydrophobicContact CE1-SD 3.7Å; F169-Y241 AromaticContact CE1-CE2 3.96Å; F169-Y241 HydrophobicContact CE1-CE2 3.96Å; F169-Y241 AromaticContact CE1-CZ 4Å; F169-Y241 HydrophobicContact CE2-CE2 4.49Å; F169-Y241 AromaticContact CZ-CD2 3.96Å; F169-Y241 HydrophobicContact CZ-CD2 3.96Å; F169-Y241 AromaticContact CZ-CE2 3.52Å; F169-Y241 HydrophobicContact CZ-CE2 3.52Å; F169-K244 HydrophobicContact CE2-CB 3.89Å; F169-K244 HydrophobicContact CZ-CB 4.33Å; F169-A245 HydrophobicContact CD1-CB 4.1Å; F169-A245 HydrophobicContact CE1-CB 3.38Å; F169-A245 HydrophobicContact CZ-CB 3.65Å; F169-A248 HydrophobicContact CB-CB 3.7Å; F169-A248 HydrophobicContact CD2-CB 4.05Å; F169-A248 HydrophobicContact CG-CB 3.91Å; F169-V250 HydrophobicContact CD1-CG2 4.18Å
170	Q	98.6	Very high	98.4	Very high	103 Å²	103	60 Å²	60	48%	0.481	33%	0.326	S	S	.	.			trans	-93.6	141	177.8	-63.4	-59	-53	0	0	111	V165 D166 T168 K172	V165-Q170 CarbonylContact C-O 3.58Å; V165-Q170 VanDerWaalsContact CA-O 3.25Å; V165-Q170 WeakPolarHBondContact CA-O 3.37Å; D166-Q170 PolarHBondContact N-O 3.3Å; D166-Q170 PolarHBondContact OD1-N 3.14Å; T168-Q170 PolarHBondContact O-N 2.96Å; Q170-K172 HydrophobicContact CB-CD 4.15Å; Q170-K172 HydrophobicContact CB-CG 3.95Å; Q170-K172 PolarHBondContact O-N 3.05Å
171	P	98.4	Very high	98.4	Very high	59 Å²	59	64.4 Å²	64.4	38%	0.383	35%	0.353	S	S	.	.	S	Bend	trans	-78.6	60.3	-178.4	34.3	-38.1	0	0	0	112.3	Q163 V165 T186	Q163-P171 HydrophobicContact CG-CB 3.55Å; V165-P171 HydrophobicContact CG1-CB 4.47Å; P171-T186 WeakPolarHBondContact CA-OG1 3.32Å; P171-T186 PolarHBondContact O-OG1 2.9Å
172	K	98.3	Very high	98.3	Very high	61 Å²	61	66.9 Å²	66.9	27%	0.265	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.2	-175.3	65.9	176.6	-178.5	166.9	0	112.6	D166 Q170 E174 V183 R184	D166-K172 WeakPolarHBondContact OD2-CE 3.47Å; D166-K172 WeakPolarHBondContact OD2-CG 3.39Å; D166-K172 IonicContact OD2-NZ 3.88Å; Q170-K172 HydrophobicContact CB-CD 4.15Å; Q170-K172 HydrophobicContact CB-CG 3.95Å; Q170-K172 PolarHBondContact O-N 3.05Å; K172-E174 HydrophobicContact CD-CG 4.38Å; K172-E174 WeakPolarHBondContact CE-OE1 3.42Å; K172-E174 IonicContact NZ-OE1 2.71Å; K172-E174 PolarHBondContact NZ-OE1 3.11Å; K172-V183 HydrophobicContact CB-CG1 3.69Å; K172-V183 HydrophobicContact CD-CG1 4.08Å; K172-V183 HydrophobicContact CG-CG1 4.41Å; K172-R184 CarbonylContact C-O 3.58Å; K172-R184 WeakPolarHBondContact CA-O 3.31Å
173	F	98.8	Very high	98.3	Very high	15 Å²	15	67.2 Å²	67.2	7%	0.066	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.2	168.5	172.4	-115.7	0	0	0	108.6	I118 Q175 V183 R184 T186 V259 A262	I118-F173 HydrophobicContact CD1-CE2 4.25Å; I118-F173 HydrophobicContact CG2-CE2 3.76Å; I118-F173 HydrophobicContact CG2-CZ 4.11Å; F173-Q175 HydrophobicContact CE1-CB 3.94Å; F173-Q175 HydrophobicContact CZ-CB 4.18Å; F173-V183 WeakPolarHBondContact O-CA 3.33Å; F173-R184 PolarHBondContact N-O 2.82Å; F173-R184 PolarHBondContact O-N 3.01Å; F173-T186 HydrophobicContact CB-CG2 3.73Å; F173-V259 HydrophobicContact CD1-CG2 4.49Å; F173-V259 HydrophobicContact CD2-CB 4.17Å; F173-V259 HydrophobicContact CE1-CB 4.1Å; F173-V259 HydrophobicContact CE1-CG2 3.77Å; F173-V259 HydrophobicContact CE2-CB 3.76Å; F173-V259 HydrophobicContact CE2-CG2 4.19Å; F173-V259 HydrophobicContact CZ-CB 3.71Å; F173-V259 HydrophobicContact CZ-CG2 3.6Å; F173-A262 HydrophobicContact CB-CB 4Å; F173-A262 HydrophobicContact CD1-CB 3.85Å; F173-A262 HydrophobicContact CG-CB 4.23Å
174	E	98.3	Very high	98.3	Very high	96 Å²	96	68.6 Å²	68.6	45%	0.449	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.2	177.7	-59.1	-166.7	172.3	0	0	110.6	K172 T181 V182 V183	K172-E174 HydrophobicContact CD-CG 4.38Å; K172-E174 WeakPolarHBondContact CE-OE1 3.42Å; K172-E174 IonicContact NZ-OE1 2.71Å; K172-E174 PolarHBondContact NZ-OE1 3.11Å; E174-T181 HydrophobicContact CB-CG2 4.37Å; E174-V182 WeakPolarHBondContact CA-O 3.26Å; E174-V183 HydrophobicContact CG-CG2 4.2Å
175	Q	97.6	Very high	98.3	Very high	56 Å²	56	70.7 Å²	70.7	26%	0.262	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.5	175.7	-175.4	179.3	-41.4	0	0	109.9	F173 I177 V182	F173-Q175 HydrophobicContact CE1-CB 3.94Å; F173-Q175 HydrophobicContact CZ-CB 4.18Å; Q175-I177 HydrophobicContact CG-CG1 4.15Å; Q175-V182 PolarHBondContact N-O 2.92Å; Q175-V182 PolarHBondContact O-N 3.11Å
176	V	98.1	Very high	98.3	Very high	98 Å²	98	70.5 Å²	70.5	59%	0.594	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.2	170.9	-179.9	0	0	0	0	109.3	K180	V176-K180 CarbonylContact C-O 3.56Å; V176-K180 WeakPolarHBondContact CA-O 3.38Å
177	I	98.1	Very high	98.2	Very high	61 Å²	61	72.3 Å²	72.3	31%	0.313	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.8	176	-57.2	-178.5	0	0	0	107.8	Q175 G179 K180 V182	Q175-I177 HydrophobicContact CG-CG1 4.15Å; I177-G179 VanDerWaalsContact C-N 3.25Å; I177-G179 PolarHBondContact O-N 2.94Å; I177-K180 PolarHBondContact N-O 3.48Å; I177-K180 PolarHBondContact O-N 3.09Å; I177-V182 HydrophobicContact CB-CG2 4.2Å; I177-V182 HydrophobicContact CD1-CB 4.16Å; I177-V182 HydrophobicContact CD1-CG1 4.44Å; I177-V182 HydrophobicContact CD1-CG2 3.98Å; I177-V182 HydrophobicContact CG1-CB 4.49Å; I177-V182 HydrophobicContact CG1-CG2 4.18Å
178	L	97.9	Very high	98.3	Very high	174 Å²	174	70.8 Å²	70.8	91%	0.911	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	42.7	-177.1	-54.1	176.7	0	0	0	112.8	K180	L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 2.91Å
179	G	97.9	Very high	98.3	Very high	69 Å²	69	69.1 Å²	69.1	71%	0.711	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	1.5	-179	0	0	0	0	0	115.3	I177	I177-G179 VanDerWaalsContact C-N 3.25Å; I177-G179 PolarHBondContact O-N 2.94Å
180	K	98.4	Very high	98.3	Very high	157 Å²	157	71 Å²	71	68%	0.683	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.7	177.6	-60.9	-178	-179.1	179.8	0	111.1	V176 I177 L178 V182	V176-K180 CarbonylContact C-O 3.56Å; V176-K180 WeakPolarHBondContact CA-O 3.38Å; I177-K180 PolarHBondContact N-O 3.48Å; I177-K180 PolarHBondContact O-N 3.09Å; L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 2.91Å; K180-V182 PolarHBondContact O-N 3.1Å
181	T	98.3	Very high	98.2	Very high	92 Å²	92	69 Å²	69	56%	0.564	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.3	172	-55.3	0	0	0	0	110.1	E174 V183	E174-T181 HydrophobicContact CB-CG2 4.37Å; T181-V183 HydrophobicContact CG2-CG2 4.45Å
182	V	98.4	Very high	98.3	Very high	52 Å²	52	66.2 Å²	66.2	32%	0.315	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.6	173.6	178.1	0	0	0	0	107.9	E174 Q175 I177 K180	E174-V182 WeakPolarHBondContact CA-O 3.26Å; Q175-V182 PolarHBondContact N-O 2.92Å; Q175-V182 PolarHBondContact O-N 3.11Å; I177-V182 HydrophobicContact CB-CG2 4.2Å; I177-V182 HydrophobicContact CD1-CB 4.16Å; I177-V182 HydrophobicContact CD1-CG1 4.44Å; I177-V182 HydrophobicContact CD1-CG2 3.98Å; I177-V182 HydrophobicContact CG1-CB 4.49Å; I177-V182 HydrophobicContact CG1-CG2 4.18Å; K180-V182 PolarHBondContact O-N 3.1Å
183	V	98.5	Very high	98.3	Very high	84 Å²	84	63.4 Å²	63.4	51%	0.509	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.1	-179.5	-172.5	0	0	0	0	109.1	K172 F173 E174 T181	K172-V183 HydrophobicContact CB-CG1 3.69Å; K172-V183 HydrophobicContact CD-CG1 4.08Å; K172-V183 HydrophobicContact CG-CG1 4.41Å; F173-V183 WeakPolarHBondContact O-CA 3.33Å; E174-V183 HydrophobicContact CG-CG2 4.2Å; T181-V183 HydrophobicContact CG2-CG2 4.45Å
184	R	98.3	Very high	98.3	Very high	61 Å²	61	67 Å²	67	23%	0.23	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.2	176.8	-64.5	175.8	176.8	145.1	-2.8	110.1	K172 F173 A262	K172-R184 CarbonylContact C-O 3.58Å; K172-R184 WeakPolarHBondContact CA-O 3.31Å; F173-R184 PolarHBondContact N-O 2.82Å; F173-R184 PolarHBondContact O-N 3.01Å; R184-A262 HydrophobicContact CB-CB 4.04Å
185	S	97.6	Very high	98.3	Very high	43 Å²	43	65.6 Å²	65.6	30%	0.301	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	149.7	171.5	135.8	0	0	0	0	110.3	D187 K265	S185-D187 PolarHBondContact OG-N 3.04Å; S185-D187 PolarHBondContact OG-OD1 2.67Å; S185-D187 PolarHBondContact OG-OD2 3.19Å; S185-K265 PolarHBondContact OG-NZ 3.43Å
186	T	98.6	Very high	98.3	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.351	C	S	.	.			trans	-111.8	29	-175.9	52	0	0	0	0	112.4	Q163 S164 P171 F173 A261	Q163-T186 PolarHBondContact NE2-O 3.3Å; Q163-T186 PolarHBondContact NE2-OG1 3.03Å; S164-T186 WeakPolarHBondContact O-CB 3.41Å; S164-T186 PolarHBondContact O-OG1 2.99Å; P171-T186 WeakPolarHBondContact CA-OG1 3.32Å; P171-T186 PolarHBondContact O-OG1 2.9Å; F173-T186 HydrophobicContact CB-CG2 3.73Å; T186-A261 VanDerWaalsContact O-CB 3.23Å; T186-A261 WeakPolarHBondContact O-CB 3.18Å
187	D	97.9	Very high	98.4	Very high	67 Å²	67	59.3 Å²	59.3	36%	0.358	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-68.5	137.9	-175.1	-51.4	-7.4	0	0	0	110.5	Q163 S185 K265	Q163-D187 PolarHBondContact NE2-OD1 3.44Å; S185-D187 PolarHBondContact OG-N 3.04Å; S185-D187 PolarHBondContact OG-OD1 2.67Å; S185-D187 PolarHBondContact OG-OD2 3.19Å; D187-K265 HydrophobicContact CB-CD 4.2Å; D187-K265 IonicContact OD2-NZ 2.64Å; D187-K265 PolarHBondContact OD2-NZ 2.85Å
188	L	98.6	Very high	98.4	Very high	14 Å²	14	61.4 Å²	61.4	7%	0.073	34%	0.337	C	S	.	.			trans	-110.1	162	172.2	-69.3	167.9	0	0	0	110.2	T161 Q190 F260 A261 A271 V273	T161-L188 HydrophobicContact CG2-CD1 3.72Å; L188-Q190 PolarHBondContact O-N 2.71Å; L188-Q190 VanDerWaalsContact O-N 3.14Å; L188-Q190 PolarHBondContact O-NE2 2.88Å; L188-F260 HydrophobicContact CD2-CD1 4.36Å; L188-F260 HydrophobicContact CD2-CE1 4.28Å; L188-A261 HydrophobicContact CD2-CB 3.67Å; L188-A261 HydrophobicContact CG-CB 3.9Å; L188-A271 HydrophobicContact CD2-CB 4.02Å; L188-V273 HydrophobicContact CD1-CB 4.36Å; L188-V273 HydrophobicContact CD1-CG2 3.96Å; L188-V273 HydrophobicContact CD2-CG2 4.48Å
189	D	98.3	Very high	98.4	Very high	49 Å²	49	53.2 Å²	53.2	26%	0.262	30%	0.295	S	S	.	.			trans	-69.2	112.2	179	-175.9	-39.6	0	0	0	110.2	S191 L192 A193 R270 A271	D189-S191 WeakPolarHBondContact OD1-CA 3.41Å; D189-S191 PolarHBondContact OD1-N 2.76Å; D189-S191 PolarHBondContact OD1-OG 3.12Å; D189-L192 HydrophobicContact CB-CB 3.89Å; D189-L192 PolarHBondContact O-N 3.19Å; D189-L192 PolarHBondContact OD1-N 3.24Å; D189-A193 PolarHBondContact O-N 2.59Å; D189-A193 VanDerWaalsContact O-N 3.09Å; D189-R270 HydrophobicContact CB-CG 4.08Å; D189-R270 WeakPolarHBondContact OD2-CD 3.39Å; D189-R270 VanDerWaalsContact OD2-CG 3.28Å; D189-R270 WeakPolarHBondContact OD2-CG 3.35Å; D189-R270 IonicContact OD2-CZ 2.97Å; D189-R270 IonicContact OD2-NE 3.48Å; D189-R270 PolarHBondContact OD2-NE 3.15Å; D189-A271 PolarHBondContact N-O 2.88Å
190	Q	98.2	Very high	98.4	Very high	80 Å²	80	50.1 Å²	50.1	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-70.7	-30.4	-177.9	-58.5	-56.1	-62.4	0	0	112.8	K162 L188 A193 Q194	K162-Q190 PolarHBondContact O-NE2 2.82Å; L188-Q190 PolarHBondContact O-N 2.71Å; L188-Q190 VanDerWaalsContact O-N 3.14Å; L188-Q190 PolarHBondContact O-NE2 2.88Å; Q190-A193 PolarHBondContact O-N 3.02Å; Q190-Q194 WeakPolarHBondContact O-CG 3.4Å; Q190-Q194 PolarHBondContact O-N 2.91Å; Q190-Q194 VanDerWaalsContact O-N 3.13Å
191	S	98.4	Very high	98.4	Very high	62 Å²	62	48.5 Å²	48.5	43%	0.434	26%	0.255	S	S	.	.	H	α-helix	trans	-70.9	-38.5	175.9	75.6	0	0	0	0	110.6	D189 A193 Q194 E195 R270	D189-S191 WeakPolarHBondContact OD1-CA 3.41Å; D189-S191 PolarHBondContact OD1-N 2.76Å; D189-S191 PolarHBondContact OD1-OG 3.12Å; S191-A193 VanDerWaalsContact C-N 3.34Å; S191-A193 PolarHBondContact O-N 2.87Å; S191-Q194 PolarHBondContact O-N 3.46Å; S191-E195 WeakPolarHBondContact O-CG 3.48Å; S191-E195 PolarHBondContact O-N 3.42Å; S191-R270 PolarHBondContact OG-NH2 3.46Å
192	L	98.7	Very high	98.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-42.1	174.2	-178.3	56.2	0	0	0	111.4	T141 D189 Q194 E195 L196 R270 A272 Y308	T141-L192 HydrophobicContact CG2-CD1 4.24Å; T141-L192 HydrophobicContact CG2-CD2 3.67Å; D189-L192 HydrophobicContact CB-CB 3.89Å; D189-L192 PolarHBondContact O-N 3.19Å; D189-L192 PolarHBondContact OD1-N 3.24Å; L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 PolarHBondContact O-N 2.63Å; L192-E195 PolarHBondContact O-N 2.93Å; L192-L196 HydrophobicContact CD1-CD1 4.23Å; L192-L196 HydrophobicContact CD1-CG 4.28Å; L192-L196 HydrophobicContact CG-CD1 4.05Å; L192-L196 WeakPolarHBondContact O-CB 3.47Å; L192-L196 WeakPolarHBondContact O-CG 3.45Å; L192-L196 PolarHBondContact O-N 3.06Å; L192-R270 HydrophobicContact CD2-CG 4.02Å; L192-A272 HydrophobicContact CD2-CB 3.49Å; L192-A272 VanDerWaalsContact CD2-CB 3.49Å; L192-A272 HydrophobicContact CG-CB 3.79Å; L192-Y308 HydrophobicContact CD1-CE1 3.89Å; L192-Y308 HydrophobicContact CD1-CE2 3.96Å; L192-Y308 VanDerWaalsContact CD1-CZ 3.41Å; L192-Y308 WeakPolarHBondContact CD1-OH 3.48Å
193	A	98.7	Very high	98.2	Very high	2 Å²	2	46.9 Å²	46.9	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-42.8	175.3	0	0	0	0	0	111.8	V160 D189 Q190 S191 L197 I210	V160-A193 HydrophobicContact CG1-CB 3.83Å; D189-A193 PolarHBondContact O-N 2.59Å; D189-A193 VanDerWaalsContact O-N 3.09Å; Q190-A193 PolarHBondContact O-N 3.02Å; S191-A193 VanDerWaalsContact C-N 3.34Å; S191-A193 PolarHBondContact O-N 2.87Å; A193-L197 PolarHBondContact O-N 3Å; A193-I210 HydrophobicContact CB-CD1 4.26Å
194	Q	98.7	Very high	98.2	Very high	91 Å²	91	49.8 Å²	49.8	43%	0.425	27%	0.27	S	S	.	.	H	α-helix	trans	-67.1	-43.3	175.8	-66.9	-60.2	-32	0	0	112.3	Q190 S191 L192 L196 L197 Q198 I210	Q190-Q194 WeakPolarHBondContact O-CG 3.4Å; Q190-Q194 PolarHBondContact O-N 2.91Å; Q190-Q194 VanDerWaalsContact O-N 3.13Å; S191-Q194 PolarHBondContact O-N 3.46Å; L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 PolarHBondContact O-N 2.63Å; Q194-L196 VanDerWaalsContact C-N 3.31Å; Q194-L196 PolarHBondContact O-N 3.23Å; Q194-L197 PolarHBondContact O-N 3.03Å; Q194-Q198 VanDerWaalsContact O-CG 3.32Å; Q194-Q198 WeakPolarHBondContact O-CG 3.47Å; Q194-Q198 PolarHBondContact O-N 3.03Å; Q194-I210 VanDerWaalsContact NE2-CD1 3.28Å
195	E	98.7	Very high	98.1	Very high	65 Å²	65	52.7 Å²	52.7	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-57.6	-44	175.7	-74.4	165.6	-154.1	0	0	111.6	S191 L192 Q198 C199 R270 Y308	S191-E195 WeakPolarHBondContact O-CG 3.48Å; S191-E195 PolarHBondContact O-N 3.42Å; L192-E195 PolarHBondContact O-N 2.93Å; E195-Q198 PolarHBondContact O-N 3.29Å; E195-C199 WeakPolarHBondContact O-CB 3.4Å; E195-C199 PolarHBondContact O-N 3.08Å; E195-R270 IonicContact OE1-CZ 3.96Å; E195-R270 IonicContact OE1-NH1 3.6Å; E195-R270 IonicContact OE1-NH2 3.73Å; E195-R270 PolarHBondContact OE1-NH2 3.49Å; E195-R270 IonicContact OE2-CZ 3.42Å; E195-R270 IonicContact OE2-NH1 3.97Å; E195-R270 PolarHBondContact OE2-NH1 2.68Å; E195-R270 IonicContact OE2-NH2 3.95Å; E195-R270 PolarHBondContact OE2-NH2 2.98Å; E195-Y308 HydrophobicContact CB-CD2 4.42Å; E195-Y308 HydrophobicContact CB-CE2 3.86Å; E195-Y308 WeakPolarHBondContact OE2-CE2 3.42Å; E195-Y308 PolarHBondContact OE2-OH 3.41Å
196	L	98.8	Very high	98.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-43.7	175	-72.4	164.4	0	0	0	111.6	I143 V160 L192 Q194 Q198 C199 S200 A272 V274 L304 Y308	I143-L196 HydrophobicContact CD1-CD2 4.44Å; V160-L196 HydrophobicContact CG1-CB 4.32Å; V160-L196 HydrophobicContact CG1-CD1 4.21Å; V160-L196 HydrophobicContact CG2-CB 4.26Å; L192-L196 HydrophobicContact CD1-CD1 4.23Å; L192-L196 HydrophobicContact CD1-CG 4.28Å; L192-L196 HydrophobicContact CG-CD1 4.05Å; L192-L196 WeakPolarHBondContact O-CB 3.47Å; L192-L196 WeakPolarHBondContact O-CG 3.45Å; L192-L196 PolarHBondContact O-N 3.06Å; Q194-L196 VanDerWaalsContact C-N 3.31Å; Q194-L196 PolarHBondContact O-N 3.23Å; L196-Q198 VanDerWaalsContact C-N 3.34Å; L196-Q198 PolarHBondContact O-N 3.41Å; L196-C199 WeakPolarHBondContact O-CB 3.29Å; L196-C199 PolarHBondContact O-N 3.49Å; L196-S200 PolarHBondContact O-N 2.95Å; L196-A272 HydrophobicContact CD1-CB 3.62Å; L196-V274 HydrophobicContact CD1-CG2 3.84Å; L196-L304 HydrophobicContact CD2-CG 4.44Å; L196-L304 WeakPolarHBondContact O-CD1 3.44Å; L196-Y308 HydrophobicContact CD2-CD1 4.11Å; L196-Y308 HydrophobicContact CD2-CD2 4.13Å; L196-Y308 HydrophobicContact CD2-CG 3.74Å
197	L	98.7	Very high	98.1	Very high	22 Å²	22	57.1 Å²	57.1	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-42.4	176	-179.9	64.8	0	0	0	111.9	A193 Q194 S200 K201 T208 I210	A193-L197 PolarHBondContact O-N 3Å; Q194-L197 PolarHBondContact O-N 3.03Å; L197-S200 PolarHBondContact O-N 3.23Å; L197-K201 WeakPolarHBondContact O-CG 3.48Å; L197-K201 PolarHBondContact O-N 3.21Å; L197-T208 HydrophobicContact CD1-CG2 3.96Å; L197-T208 WeakPolarHBondContact CD1-O 3.41Å; L197-I210 HydrophobicContact CB-CD1 3.87Å; L197-I210 HydrophobicContact CB-CG1 4.24Å; L197-I210 HydrophobicContact CD2-CD1 3.62Å; L197-I210 HydrophobicContact CD2-CG1 4.02Å; L197-I210 HydrophobicContact CG-CD1 4.31Å
198	Q	98.5	Very high	98.2	Very high	105 Å²	105	55 Å²	55	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-40	176.7	-64.3	-57.6	-19.1	0	0	111.8	Q194 E195 L196 S200 K201 G202	Q194-Q198 VanDerWaalsContact O-CG 3.32Å; Q194-Q198 WeakPolarHBondContact O-CG 3.47Å; Q194-Q198 PolarHBondContact O-N 3.03Å; E195-Q198 PolarHBondContact O-N 3.29Å; L196-Q198 VanDerWaalsContact C-N 3.34Å; L196-Q198 PolarHBondContact O-N 3.41Å; Q198-S200 VanDerWaalsContact C-N 3.3Å; Q198-S200 PolarHBondContact O-N 2.94Å; Q198-K201 PolarHBondContact O-N 3.36Å; Q198-G202 PolarHBondContact O-N 2.98Å
199	C	98.4	Very high	98.2	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-57.8	-44.3	172.9	-175.3	0	0	0	0	111.1	E195 L196 G202 L203 L304 S307 Y308 Q311	E195-C199 WeakPolarHBondContact O-CB 3.4Å; E195-C199 PolarHBondContact O-N 3.08Å; L196-C199 WeakPolarHBondContact O-CB 3.29Å; L196-C199 PolarHBondContact O-N 3.49Å; C199-G202 PolarHBondContact O-N 3.34Å; C199-L203 PolarHBondContact O-N 3.43Å; C199-L304 HydrophobicContact CB-CD1 4.05Å; C199-S307 PolarHBondContact SG-OG 3.13Å; C199-Y308 PolarHBondContact SG-N 2.94Å; C199-Y308 VanDerWaalsContact SG-N 3.41Å; C199-Q311 PolarHBondContact SG-NE2 2.94Å
200	S	98.3	Very high	98.2	Very high	4 Å²	4	55.6 Å²	55.6	3%	0.028	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-43	176.5	-168.4	0	0	0	0	112.9	L196 L197 Q198 G202 L203 N204 T208	L196-S200 PolarHBondContact O-N 2.95Å; L197-S200 PolarHBondContact O-N 3.23Å; Q198-S200 VanDerWaalsContact C-N 3.3Å; Q198-S200 PolarHBondContact O-N 2.94Å; S200-G202 VanDerWaalsContact C-N 3.27Å; S200-G202 PolarHBondContact O-N 2.95Å; S200-L203 WeakPolarHBondContact O-CB 3.42Å; S200-L203 PolarHBondContact O-N 2.88Å; S200-L203 VanDerWaalsContact O-N 3.09Å; S200-N204 PolarHBondContact O-N 2.98Å; S200-T208 VanDerWaalsContact OG-CB 3.3Å; S200-T208 WeakPolarHBondContact OG-CB 3.36Å; S200-T208 PolarHBondContact OG-OG1 3.4Å
201	K	97.6	Very high	98.2	Very high	123 Å²	123	52 Å²	52	54%	0.535	28%	0.279	S	S	.	.	H	α-helix	trans	-59.3	-38.7	174.1	-73	174.6	179.7	176.1	0	112.3	L197 Q198 N204	L197-K201 WeakPolarHBondContact O-CG 3.48Å; L197-K201 PolarHBondContact O-N 3.21Å; Q198-K201 PolarHBondContact O-N 3.36Å; K201-N204 PolarHBondContact O-N 3.39Å
202	G	97	Very high	98.3	Very high	68 Å²	68	50 Å²	50	70%	0.701	26%	0.263	S	S	*	.	H	α-helix	trans	-66.9	-33.7	174.7	0	0	0	0	0	113.5	Q198 C199 S200	Q198-G202 PolarHBondContact O-N 2.98Å; C199-G202 PolarHBondContact O-N 3.34Å; S200-G202 VanDerWaalsContact C-N 3.27Å; S200-G202 PolarHBondContact O-N 2.95Å
203	L	96.6	Very high	98.3	Very high	41 Å²	41	50 Å²	50	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-69.5	-42	173.3	-72.6	170.3	0	0	0	112	C199 S200 Q205 F206 I303 L304	C199-L203 PolarHBondContact O-N 3.43Å; S200-L203 WeakPolarHBondContact O-CB 3.42Å; S200-L203 PolarHBondContact O-N 2.88Å; S200-L203 VanDerWaalsContact O-N 3.09Å; L203-Q205 VanDerWaalsContact C-N 3.27Å; L203-Q205 HydrophobicContact CB-CG 4.42Å; L203-Q205 WeakPolarHBondContact O-CG 3.4Å; L203-Q205 PolarHBondContact O-N 3.09Å; L203-F206 HydrophobicContact CD1-CZ 4.47Å; L203-I303 HydrophobicContact CD1-CG2 4.12Å; L203-L304 HydrophobicContact CD1-CD1 4.21Å
204	N	96.9	Very high	98.3	Very high	146 Å²	146	49.9 Å²	49.9	78%	0.781	26%	0.263	S	S	*	.			trans	52.8	39.4	-179.4	-165.9	42.4	0	0	0	114	S200 K201	S200-N204 PolarHBondContact O-N 2.98Å; K201-N204 PolarHBondContact O-N 3.39Å
205	Q	97.6	Very high	98.3	Very high	121 Å²	121	45.9 Å²	45.9	57%	0.565	25%	0.245	S	C	*	.	S	Bend	trans	-106.7	-26.2	-177.1	-67	-177.9	20.5	0	0	114	L203	L203-Q205 VanDerWaalsContact C-N 3.27Å; L203-Q205 HydrophobicContact CB-CG 4.42Å; L203-Q205 WeakPolarHBondContact O-CG 3.4Å; L203-Q205 PolarHBondContact O-N 3.09Å
206	F	98.1	Very high	98.3	Very high	26 Å²	26	43 Å²	43	11%	0.114	23%	0.231	C	C	.	.	S	Bend	trans	-155.3	152.7	-177.2	41.7	-98.4	0	0	0	110.3	V158 L203 T208 R300 I303 L304	V158-F206 HydrophobicContact CB-CD2 4.26Å; V158-F206 HydrophobicContact CB-CE2 4.36Å; V158-F206 HydrophobicContact CG2-CD2 3.63Å; V158-F206 HydrophobicContact CG2-CE2 3.78Å; V158-F206 HydrophobicContact CG2-CG 4.48Å; L203-F206 HydrophobicContact CD1-CZ 4.47Å; F206-T208 PolarHBondContact O-N 2.72Å; F206-R300 HydrophobicContact CB-CG 4.37Å; F206-R300 HydrophobicContact CD1-CB 3.93Å; F206-R300 HydrophobicContact CD1-CG 3.69Å; F206-R300 HydrophobicContact CD2-CB 4.2Å; F206-R300 HydrophobicContact CE1-CB 3.9Å; F206-R300 HydrophobicContact CE1-CG 4.08Å; F206-R300 HydrophobicContact CE2-CB 4.18Å; F206-R300 HydrophobicContact CG-CB 4.09Å; F206-R300 HydrophobicContact CG-CG 3.95Å; F206-R300 HydrophobicContact CZ-CB 4.03Å; F206-R300 WeakPolarHBondContact CZ-O 3.37Å; F206-I303 HydrophobicContact CE1-CB 4.26Å; F206-I303 HydrophobicContact CE1-CG2 4.07Å; F206-I303 HydrophobicContact CZ-CB 4.46Å; F206-I303 HydrophobicContact CZ-CG2 4.37Å; F206-L304 HydrophobicContact CE2-CB 4.28Å; F206-L304 HydrophobicContact CZ-CB 4.06Å
207	E	98.4	Very high	98.3	Very high	111 Å²	111	49.5 Å²	49.5	52%	0.519	27%	0.266	S	S	.	.			trans	-63	134.8	175.5	-170.7	170.4	174.4	0	0	110.5	T157 V158 V209	T157-E207 HydrophobicContact CG2-CB 4.31Å; T157-E207 HydrophobicContact CG2-CG 4.09Å; V158-E207 PolarHBondContact N-O 3.2Å; E207-V209 HydrophobicContact CG-CG1 4.49Å
208	T	98.8	Very high	98.3	Very high	21 Å²	21	51.6 Å²	51.6	13%	0.129	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.4	176.7	-59.1	0	0	0	0	109.9	V158 V160 L197 S200 F206 L304	V158-T208 HydrophobicContact CB-CG2 4.27Å; V158-T208 HydrophobicContact CG1-CG2 4.22Å; V158-T208 CarbonylContact O-C 3.49Å; V158-T208 WeakPolarHBondContact O-CA 3.28Å; V160-T208 HydrophobicContact CG2-CG2 3.84Å; L197-T208 HydrophobicContact CD1-CG2 3.96Å; L197-T208 WeakPolarHBondContact CD1-O 3.41Å; S200-T208 VanDerWaalsContact OG-CB 3.3Å; S200-T208 WeakPolarHBondContact OG-CB 3.36Å; S200-T208 PolarHBondContact OG-OG1 3.4Å; F206-T208 PolarHBondContact O-N 2.72Å; T208-L304 HydrophobicContact CG2-CD2 4.35Å
209	V	98.8	Very high	98.3	Very high	33 Å²	33	50.8 Å²	50.8	20%	0.2	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	155.9	179.9	-59.1	0	0	0	0	110.5	L153 T157 V158 V159 V160 E207	L153-V209 HydrophobicContact CD1-CG2 4.04Å; T157-V209 HydrophobicContact CG2-CG1 4.35Å; T157-V209 HydrophobicContact CG2-CG2 4.12Å; V158-V209 PolarHBondContact O-N 2.93Å; V159-V209 WeakPolarHBondContact CA-O 3.44Å; V159-V209 HydrophobicContact CB-CG2 4.49Å; V159-V209 HydrophobicContact CG2-CG2 3.91Å; V160-V209 PolarHBondContact N-O 3.36Å; E207-V209 HydrophobicContact CG-CG1 4.49Å
210	I	98.8	Very high	98.3	Very high	44 Å²	44	55.5 Å²	55.5	23%	0.226	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.2	166.3	-70.7	174.9	0	0	0	107.6	V160 K162 A193 Q194 L197	V160-I210 HydrophobicContact CB-CG1 4.13Å; V160-I210 WeakPolarHBondContact O-CA 3.28Å; K162-I210 HydrophobicContact CB-CG2 3.7Å; K162-I210 HydrophobicContact CG-CG2 4.33Å; A193-I210 HydrophobicContact CB-CD1 4.26Å; Q194-I210 VanDerWaalsContact NE2-CD1 3.28Å; L197-I210 HydrophobicContact CB-CD1 3.87Å; L197-I210 HydrophobicContact CB-CG1 4.24Å; L197-I210 HydrophobicContact CD2-CD1 3.62Å; L197-I210 HydrophobicContact CD2-CG1 4.02Å; L197-I210 HydrophobicContact CG-CD1 4.31Å
211	G	98.4	Very high	98.3	Very high	5 Å²	5	58.8 Å²	58.8	5%	0.052	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	171.7	-179.2	0	0	0	0	0	112.8	V160 T161 K162	V160-G211 PolarHBondContact O-N 3.38Å; T161-G211 WeakPolarHBondContact CA-O 3.32Å; K162-G211 PolarHBondContact N-O 3.28Å
212	N	98.9	Very high	98.4	Very high	18 Å²	18	54.1 Å²	54.1	10%	0.096	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	148.5	175.5	-62.8	-20	0	0	0	110	Q163 V165 A248 E249 V250 C251	Q163-N212 WeakPolarHBondContact O-CA 3.23Å; V165-N212 HydrophobicContact CG1-CB 4.46Å; N212-A248 PolarHBondContact ND2-O 2.72Å; N212-A248 VanDerWaalsContact ND2-O 3.09Å; N212-E249 WeakPolarHBondContact CB-O 3.44Å; N212-E249 PolarHBondContact N-O 2.94Å; N212-V250 HydrophobicContact CB-CG2 4.29Å; N212-V250 WeakPolarHBondContact O-CA 3.32Å; N212-C251 PolarHBondContact O-N 2.92Å
213	T	98.9	Very high	98.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121	177.4	-62.7	0	0	0	0	109.1	T161 Q163 S164 V165 N252 E254	T161-T213 WeakPolarHBondContact CB-OG1 3.41Å; T161-T213 VanDerWaalsContact CG2-OG1 3.32Å; T161-T213 WeakPolarHBondContact CG2-OG1 3.35Å; T161-T213 PolarHBondContact OG1-OG1 2.97Å; Q163-T213 PolarHBondContact O-N 3.09Å; S164-T213 CarbonylContact C-O 3.55Å; S164-T213 WeakPolarHBondContact CA-O 3.32Å; V165-T213 PolarHBondContact N-O 3.33Å; T213-N252 WeakPolarHBondContact CA-O 3.27Å; T213-N252 WeakPolarHBondContact CA-OD1 3.33Å; T213-N252 VanDerWaalsContact CB-OD1 3.27Å; T213-N252 WeakPolarHBondContact CB-OD1 3.32Å; T213-N252 WeakPolarHBondContact CG2-OD1 3.41Å; T213-N252 PolarHBondContact OG1-OD1 3.4Å; T213-E254 HydrophobicContact CG2-CG 3.47Å; T213-E254 VanDerWaalsContact CG2-CG 3.47Å
214	M	98.9	Very high	98.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.7	174.2	-177.2	172.3	72.8	0	0	110	V165 F169 T216 Y241 V250 N252 I253 E254	V165-M214 HydrophobicContact CG2-CB 4.19Å; V165-M214 WeakPolarHBondContact O-CA 3.35Å; F169-M214 HydrophobicContact CD1-SD 4.07Å; F169-M214 HydrophobicContact CE1-SD 3.7Å; M214-T216 HydrophobicContact CE-CG2 4.01Å; M214-T216 HydrophobicContact CG-CG2 4.12Å; M214-Y241 HydrophobicContact CE-CE1 3.94Å; M214-Y241 HydrophobicContact SD-CE1 4.36Å; M214-Y241 PolarHBondContact SD-OH 3.41Å; M214-V250 HydrophobicContact CB-CG1 3.72Å; M214-N252 PolarHBondContact N-O 3.35Å; M214-I253 HydrophobicContact CB-CG2 4.41Å; M214-I253 HydrophobicContact CE-CB 4.31Å; M214-I253 HydrophobicContact CE-CD1 3.57Å; M214-I253 HydrophobicContact CE-CG1 3.77Å; M214-I253 HydrophobicContact CE-CG2 3.6Å; M214-I253 WeakPolarHBondContact O-CA 3.39Å; M214-E254 PolarHBondContact O-N 2.83Å
215	C	98.9	Very high	98.7	Very high	7 Å²	7	43 Å²	43	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.5	178	-173.6	0	0	0	0	110	V165 E254 E256 S258	V165-C215 PolarHBondContact O-N 3.28Å; C215-E254 CarbonylContact C-O 3.59Å; C215-E254 WeakPolarHBondContact CA-O 3.41Å; C215-E256 PolarHBondContact SG-N 2.97Å; C215-S258 PolarHBondContact SG-OG 3.46Å
216	T	98.9	Very high	98.7	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.025	21%	0.205	C	C	.	.			trans	-114.5	156.6	-177.3	72.4	0	0	0	0	112.2	M214 D218 G222 Q223 I253 E254 M255	M214-T216 HydrophobicContact CE-CG2 4.01Å; M214-T216 HydrophobicContact CG-CG2 4.12Å; T216-D218 PolarHBondContact OG1-O 3.48Å; T216-G222 VanDerWaalsContact CG2-O 3.25Å; T216-G222 WeakPolarHBondContact CG2-O 3.31Å; T216-Q223 HydrophobicContact CG2-CG 3.98Å; T216-Q223 VanDerWaalsContact OG1-CG 3.24Å; T216-Q223 WeakPolarHBondContact OG1-CG 3.38Å; T216-Q223 PolarHBondContact OG1-NE2 2.83Å; T216-I253 HydrophobicContact CG2-CG2 3.78Å; T216-E254 PolarHBondContact N-O 2.8Å; T216-M255 WeakPolarHBondContact O-CA 3.42Å
217	L	98.6	Very high	98.7	Very high	138 Å²	138	41.1 Å²	41.1	72%	0.723	21%	0.211	S	C	*	.	S	Bend	trans	-86.6	-25.8	176.3	-72.1	169.3	0	0	0	113	I118 M255	I118-L217 HydrophobicContact CB-CD2 4.24Å; I118-L217 HydrophobicContact CD1-CD2 3.69Å; I118-L217 HydrophobicContact CD1-CG 4.43Å; I118-L217 HydrophobicContact CG1-CD2 4.37Å; L217-M255 WeakPolarHBondContact O-CE 3.23Å
218	D	98.7	Very high	98.7	Very high	66 Å²	66	36.8 Å²	36.8	35%	0.353	20%	0.197	S	C	.	.			trans	-124.1	145.4	179.1	173.5	60.7	0	0	0	109.9	T216 Y220 E221 G222 Q223	T216-D218 PolarHBondContact OG1-O 3.48Å; D218-Y220 VanDerWaalsContact OD2-C 3.26Å; D218-Y220 WeakPolarHBondContact OD2-CA 3.49Å; D218-Y220 PolarHBondContact OD2-N 2.9Å; D218-E221 WeakPolarHBondContact OD2-CA 3.33Å; D218-E221 PolarHBondContact OD2-N 2.8Å; D218-G222 WeakPolarHBondContact O-CA 3.32Å; D218-G222 PolarHBondContact OD2-N 3.5Å; D218-Q223 WeakPolarHBondContact O-CG 3.46Å
219	F	98.8	Very high	98.7	Very high	87 Å²	87	40.4 Å²	40.4	38%	0.382	23%	0.229	S	C	.	.	S	Bend	trans	-82.1	-30.8	-177.6	-178.5	-98.3	0	0	0	112.7	Q223 R225 M255	F219-Q223 WeakPolarHBondContact O-CB 3.32Å; F219-Q223 VanDerWaalsContact O-CG 3.31Å; F219-Q223 WeakPolarHBondContact O-CG 3.44Å; F219-R225 VanDerWaalsContact O-CD 3.29Å; F219-R225 WeakPolarHBondContact O-CD 3.39Å; F219-M255 HydrophobicContact CB-CE 4.37Å; F219-M255 HydrophobicContact CB-SD 3.89Å; F219-M255 HydrophobicContact CD2-SD 4.11Å
220	Y	98.8	Very high	98.7	Very high	102 Å²	102	46.4 Å²	46.4	40%	0.4	25%	0.252	S	S	.	.	S	Bend	trans	-94.3	-87.6	-174	-68.6	-82.7	0	0	0	110.9	D218 G222 Q223 A224 R225	D218-Y220 VanDerWaalsContact OD2-C 3.26Å; D218-Y220 WeakPolarHBondContact OD2-CA 3.49Å; D218-Y220 PolarHBondContact OD2-N 2.9Å; Y220-G222 VanDerWaalsContact C-N 3.27Å; Y220-G222 PolarHBondContact O-N 3Å; Y220-Q223 CarbonylContact O-C 3.54Å; Y220-Q223 PolarHBondContact O-N 3.36Å; Y220-A224 PolarHBondContact O-N 3.22Å; Y220-A224 VanDerWaalsContact O-N 3.16Å; Y220-R225 HydrophobicContact CD1-CB 4.48Å; Y220-R225 PolarHBondContact O-N 2.82Å
221	E	98.8	Very high	98.7	Very high	74 Å²	74	47.1 Å²	47.1	35%	0.346	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-58.2	-39.7	178.2	-68.3	-168.3	109	0	0	112.2	D218 Q223 A224 F230 S232 Y233	D218-E221 WeakPolarHBondContact OD2-CA 3.33Å; D218-E221 PolarHBondContact OD2-N 2.8Å; E221-Q223 PolarHBondContact O-N 2.92Å; E221-Q223 VanDerWaalsContact O-N 3.16Å; E221-A224 PolarHBondContact O-N 2.93Å; E221-F230 WeakPolarHBondContact CG-O 3.45Å; E221-S232 PolarHBondContact OE1-N 2.98Å; E221-S232 PolarHBondContact OE1-OG 3.47Å; E221-Y233 VanDerWaalsContact CA-OH 3.28Å; E221-Y233 WeakPolarHBondContact CA-OH 3.28Å; E221-Y233 HydrophobicContact CB-CE1 4.22Å; E221-Y233 HydrophobicContact CG-CE1 4.1Å
222	G	98.6	Very high	98.7	Very high	25 Å²	25	51.7 Å²	51.7	26%	0.258	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.3	-22.7	176.9	0	0	0	0	0	114.2	T216 D218 Y220	T216-G222 VanDerWaalsContact CG2-O 3.25Å; T216-G222 WeakPolarHBondContact CG2-O 3.31Å; D218-G222 WeakPolarHBondContact O-CA 3.32Å; D218-G222 PolarHBondContact OD2-N 3.5Å; Y220-G222 VanDerWaalsContact C-N 3.27Å; Y220-G222 PolarHBondContact O-N 3Å
223	Q	98.8	Very high	98.7	Very high	3 Å²	3	53.3 Å²	53.3	1%	0.014	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-110.7	15.6	176.2	-51.2	-172.4	3.6	0	0	112.6	T216 D218 F219 Y220 E221 R225 I253 R281	T216-Q223 HydrophobicContact CG2-CG 3.98Å; T216-Q223 VanDerWaalsContact OG1-CG 3.24Å; T216-Q223 WeakPolarHBondContact OG1-CG 3.38Å; T216-Q223 PolarHBondContact OG1-NE2 2.83Å; D218-Q223 WeakPolarHBondContact O-CG 3.46Å; F219-Q223 WeakPolarHBondContact O-CB 3.32Å; F219-Q223 VanDerWaalsContact O-CG 3.31Å; F219-Q223 WeakPolarHBondContact O-CG 3.44Å; Y220-Q223 CarbonylContact O-C 3.54Å; Y220-Q223 PolarHBondContact O-N 3.36Å; E221-Q223 PolarHBondContact O-N 2.92Å; E221-Q223 VanDerWaalsContact O-N 3.16Å; Q223-R225 VanDerWaalsContact C-N 3.29Å; Q223-R225 HydrophobicContact CB-CG 4.33Å; Q223-R225 PolarHBondContact O-N 3.38Å; Q223-I253 HydrophobicContact CB-CG2 4.28Å; Q223-I253 HydrophobicContact CG-CG2 3.78Å; Q223-R281 VanDerWaalsContact O-CZ 3.24Å; Q223-R281 PolarHBondContact O-NH1 3.25Å; Q223-R281 PolarHBondContact O-NH2 3.03Å
224	A	98.6	Very high	98.7	Very high	8 Å²	8	56.8 Å²	56.8	7%	0.066	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	37.7	-177.3	0	0	0	0	0	113.6	Y220 E221 Y233 K238 Y241 R281	Y220-A224 PolarHBondContact O-N 3.22Å; Y220-A224 VanDerWaalsContact O-N 3.16Å; E221-A224 PolarHBondContact O-N 2.93Å; A224-Y233 VanDerWaalsContact C-OH 3.3Å; A224-Y233 VanDerWaalsContact CA-OH 3.31Å; A224-Y233 WeakPolarHBondContact CA-OH 3.38Å; A224-Y233 HydrophobicContact CB-CE2 4.34Å; A224-K238 HydrophobicContact CB-CB 4.24Å; A224-K238 HydrophobicContact CB-CG 4.18Å; A224-K238 WeakPolarHBondContact O-CD 3.45Å; A224-K238 WeakPolarHBondContact O-CG 3.47Å; A224-Y241 HydrophobicContact CB-CD1 3.78Å; A224-Y241 HydrophobicContact CB-CE1 4.3Å; A224-R281 PolarHBondContact O-NH2 3.42Å
225	R	98.8	Very high	98.6	Very high	10 Å²	10	60.6 Å²	60.6	4%	0.038	34%	0.336	C	S	.	.			trans	-80.7	152	173.5	-50.3	-171.4	99.6	83.2	-6.6	111.3	F219 Y220 Q223 D227 Y233 D285	F219-R225 VanDerWaalsContact O-CD 3.29Å; F219-R225 WeakPolarHBondContact O-CD 3.39Å; Y220-R225 HydrophobicContact CD1-CB 4.48Å; Y220-R225 PolarHBondContact O-N 2.82Å; Q223-R225 VanDerWaalsContact C-N 3.29Å; Q223-R225 HydrophobicContact CB-CG 4.33Å; Q223-R225 PolarHBondContact O-N 3.38Å; R225-D227 WeakPolarHBondContact CB-OD1 3.37Å; R225-D227 WeakPolarHBondContact CD-OD1 3.3Å; R225-D227 IonicContact NE-OD1 2.77Å; R225-D227 IonicContact NE-OD2 3.24Å; R225-Y233 PolarHBondContact N-OH 3.21Å; R225-Y233 PolarHBondContact O-OH 2.99Å; R225-D285 HydrophobicContact CB-CB 4.28Å; R225-D285 PolarHBondContact NE-O 2.76Å; R225-D285 PolarHBondContact NH2-O 3.37Å
226	L	98.8	Very high	98.6	Very high	60 Å²	60	64.5 Å²	64.5	31%	0.314	36%	0.36	S	S	.	.	S	Bend	trans	-101.7	3.8	176.5	-58.1	-173.2	0	0	0	114.4	C231 Y233 E235 K238 D285	L226-C231 VanDerWaalsContact CD2-SG 3.54Å; L226-Y233 HydrophobicContact CD2-CD2 3.8Å; L226-Y233 HydrophobicContact CD2-CE2 3.57Å; L226-E235 HydrophobicContact CD1-CB 3.66Å; L226-E235 HydrophobicContact CD1-CG 4.31Å; L226-E235 WeakPolarHBondContact CD1-OE2 3.26Å; L226-K238 HydrophobicContact CD1-CD 4.45Å; L226-K238 HydrophobicContact CD2-CD 4.49Å; L226-K238 HydrophobicContact CG-CD 4.04Å; L226-D285 PolarHBondContact N-OD2 3.39Å
227	D	98.4	Very high	98.6	Very high	47 Å²	47	67.9 Å²	67.9	25%	0.251	38%	0.378	S	S	.	.	S	Bend	trans	-110.8	17.6	-171.6	62.5	-5.3	0	0	0	113.1	R225 D285 Q286	R225-D227 WeakPolarHBondContact CB-OD1 3.37Å; R225-D227 WeakPolarHBondContact CD-OD1 3.3Å; R225-D227 IonicContact NE-OD1 2.77Å; R225-D227 IonicContact NE-OD2 3.24Å; D227-D285 WeakPolarHBondContact OD2-CB 3.21Å; D227-Q286 PolarHBondContact OD2-NE2 3.13Å
228	G	98.3	Very high	98.6	Very high	21 Å²	21	61.4 Å²	61.4	22%	0.216	34%	0.344	C	S	.	.	S	Bend	trans	-82.5	169.3	172.9	0	0	0	0	0	113	F230	G228-F230 PolarHBondContact O-N 3.46Å
229	A	98.5	Very high	98.6	Very high	97 Å²	97	60.6 Å²	60.6	80%	0.802	34%	0.338	S	S	*	.	S	Bend	trans	-67.7	-24.7	172.4	0	0	0	0	0	112.7
230	F	98.5	Very high	98.6	Very high	158 Å²	158	61.1 Å²	61.1	69%	0.693	34%	0.342	S	S	*	.			trans	-124.8	137.7	175.8	-50.2	-69.5	0	0	0	108.8	E221 G228	E221-F230 WeakPolarHBondContact CG-O 3.45Å; G228-F230 PolarHBondContact O-N 3.46Å
231	C	98.5	Very high	98.7	Very high	59 Å²	59	59 Å²	59	40%	0.399	33%	0.333	S	S	.	.			trans	-152.3	114.3	176.3	-172.9	0	0	0	0	108.9	L226 Y233	L226-C231 VanDerWaalsContact CD2-SG 3.54Å; C231-Y233 PolarHBondContact SG-O 3.28Å
232	S	97.9	Very high	98.7	Very high	101 Å²	101	55.4 Å²	55.4	71%	0.706	32%	0.317	S	S	*	.			trans	-105.6	11.1	-174.6	50	0	0	0	0	114	E221	E221-S232 PolarHBondContact OE1-N 2.98Å; E221-S232 PolarHBondContact OE1-OG 3.47Å
233	Y	98.7	Very high	98.7	Very high	52 Å²	52	58.1 Å²	58.1	20%	0.204	33%	0.325	C	S	.	.	S	Bend	trans	-143.9	170.2	-175.4	50.6	-96.3	0	0	0	111.4	E221 A224 R225 L226 C231	E221-Y233 VanDerWaalsContact CA-OH 3.28Å; E221-Y233 WeakPolarHBondContact CA-OH 3.28Å; E221-Y233 HydrophobicContact CB-CE1 4.22Å; E221-Y233 HydrophobicContact CG-CE1 4.1Å; A224-Y233 VanDerWaalsContact C-OH 3.3Å; A224-Y233 VanDerWaalsContact CA-OH 3.31Å; A224-Y233 WeakPolarHBondContact CA-OH 3.38Å; A224-Y233 HydrophobicContact CB-CE2 4.34Å; R225-Y233 PolarHBondContact N-OH 3.21Å; R225-Y233 PolarHBondContact O-OH 2.99Å; L226-Y233 HydrophobicContact CD2-CD2 3.8Å; L226-Y233 HydrophobicContact CD2-CE2 3.57Å; C231-Y233 PolarHBondContact SG-O 3.28Å
234	T	98.8	Very high	98.7	Very high	74 Å²	74	63.3 Å²	63.3	45%	0.454	35%	0.347	S	S	.	.			trans	-100.5	170.3	-177.2	68.8	0	0	0	0	112.7	T236 D237 K238	T234-T236 PolarHBondContact O-N 3.39Å; T234-T236 PolarHBondContact OG1-N 3.21Å; T234-D237 WeakPolarHBondContact CB-OD2 3.2Å; T234-D237 PolarHBondContact N-OD2 3.4Å; T234-D237 PolarHBondContact O-N 2.99Å; T234-D237 VanDerWaalsContact OG1-CG 3.29Å; T234-D237 PolarHBondContact OG1-N 2.68Å; T234-D237 PolarHBondContact OG1-OD2 3.11Å; T234-K238 PolarHBondContact O-N 3.13Å; T234-K238 VanDerWaalsContact O-N 3.07Å
235	E	98.8	Very high	98.7	Very high	79 Å²	79	62.9 Å²	62.9	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-59.9	-35.3	170.8	-177.9	63.7	-146.7	0	0	111.8	L226 K238 Q239	L226-E235 HydrophobicContact CD1-CB 3.66Å; L226-E235 HydrophobicContact CD1-CG 4.31Å; L226-E235 WeakPolarHBondContact CD1-OE2 3.26Å; E235-K238 WeakPolarHBondContact O-CB 3.18Å; E235-K238 PolarHBondContact O-N 3.24Å; E235-K238 IonicContact OE1-NZ 3.91Å; E235-K238 PolarHBondContact OE1-NZ 3.09Å; E235-K238 WeakPolarHBondContact OE2-CD 3.3Å; E235-K238 IonicContact OE2-NZ 2.71Å; E235-K238 PolarHBondContact OE2-NZ 3.3Å; E235-Q239 HydrophobicContact CG-CG 4.39Å; E235-Q239 VanDerWaalsContact O-CG 3.29Å; E235-Q239 WeakPolarHBondContact O-CG 3.37Å; E235-Q239 PolarHBondContact O-N 3.36Å; E235-Q239 WeakPolarHBondContact OE1-CG 3.43Å; E235-Q239 PolarHBondContact OE1-NE2 2.91Å
236	T	98.8	Very high	98.7	Very high	90 Å²	90	67.4 Å²	67.4	55%	0.552	36%	0.364	S	S	*	.	H	α-helix	trans	-61.6	-48.5	175.3	-54.7	0	0	0	0	111	T234 K238 Q239 E240	T234-T236 PolarHBondContact O-N 3.39Å; T234-T236 PolarHBondContact OG1-N 3.21Å; T236-K238 VanDerWaalsContact C-N 3.31Å; T236-K238 PolarHBondContact O-N 2.85Å; T236-Q239 PolarHBondContact O-N 3.46Å; T236-E240 WeakPolarHBondContact O-CG 3.36Å; T236-E240 PolarHBondContact O-N 3.49Å
237	D	98.8	Very high	98.6	Very high	75 Å²	75	72 Å²	72	40%	0.401	38%	0.384	S	S	.	.	H	α-helix	trans	-59.9	-42.7	178.6	-58.6	-53.2	0	0	0	111.5	T234 E240 Y241	T234-D237 WeakPolarHBondContact CB-OD2 3.2Å; T234-D237 PolarHBondContact N-OD2 3.4Å; T234-D237 PolarHBondContact O-N 2.99Å; T234-D237 VanDerWaalsContact OG1-CG 3.29Å; T234-D237 PolarHBondContact OG1-N 2.68Å; T234-D237 PolarHBondContact OG1-OD2 3.11Å; D237-E240 PolarHBondContact O-N 3.11Å; D237-Y241 WeakPolarHBondContact O-CB 3.37Å; D237-Y241 PolarHBondContact O-N 3.25Å
238	K	98.8	Very high	98.6	Very high	2 Å²	2	71.4 Å²	71.4	1%	0.009	39%	0.385	C	S	.	.	H	α-helix	trans	-58	-51.4	173.8	162.5	-171.6	169.2	-167.9	0	111.5	A224 L226 T234 E235 T236 E240 Y241 L242 D285	A224-K238 HydrophobicContact CB-CB 4.24Å; A224-K238 HydrophobicContact CB-CG 4.18Å; A224-K238 WeakPolarHBondContact O-CD 3.45Å; A224-K238 WeakPolarHBondContact O-CG 3.47Å; L226-K238 HydrophobicContact CD1-CD 4.45Å; L226-K238 HydrophobicContact CD2-CD 4.49Å; L226-K238 HydrophobicContact CG-CD 4.04Å; T234-K238 PolarHBondContact O-N 3.13Å; T234-K238 VanDerWaalsContact O-N 3.07Å; E235-K238 WeakPolarHBondContact O-CB 3.18Å; E235-K238 PolarHBondContact O-N 3.24Å; E235-K238 IonicContact OE1-NZ 3.91Å; E235-K238 PolarHBondContact OE1-NZ 3.09Å; E235-K238 WeakPolarHBondContact OE2-CD 3.3Å; E235-K238 IonicContact OE2-NZ 2.71Å; E235-K238 PolarHBondContact OE2-NZ 3.3Å; T236-K238 VanDerWaalsContact C-N 3.31Å; T236-K238 PolarHBondContact O-N 2.85Å; K238-E240 VanDerWaalsContact C-N 3.34Å; K238-E240 PolarHBondContact O-N 3.28Å; K238-Y241 PolarHBondContact O-N 3.32Å; K238-L242 HydrophobicContact CG-CD1 3.91Å; K238-L242 HydrophobicContact CG-CG 4.42Å; K238-L242 WeakPolarHBondContact O-CG 3.24Å; K238-L242 PolarHBondContact O-N 3.3Å; K238-D285 WeakPolarHBondContact CE-OD1 3.23Å; K238-D285 IonicContact NZ-OD1 2.82Å; K238-D285 PolarHBondContact NZ-OD1 3.47Å; K238-D285 IonicContact NZ-OD2 2.76Å; K238-D285 PolarHBondContact NZ-OD2 3.43Å
239	Q	98.8	Very high	98.6	Very high	48 Å²	48	75.9 Å²	75.9	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-62.8	-43	-177.9	-71	-66.7	-28.6	0	0	110.9	E235 T236 Y241 L242 L243 L282	E235-Q239 HydrophobicContact CG-CG 4.39Å; E235-Q239 VanDerWaalsContact O-CG 3.29Å; E235-Q239 WeakPolarHBondContact O-CG 3.37Å; E235-Q239 PolarHBondContact O-N 3.36Å; E235-Q239 WeakPolarHBondContact OE1-CG 3.43Å; E235-Q239 PolarHBondContact OE1-NE2 2.91Å; T236-Q239 PolarHBondContact O-N 3.46Å; Q239-Y241 VanDerWaalsContact C-N 3.35Å; Q239-Y241 PolarHBondContact O-N 2.78Å; Q239-L242 PolarHBondContact O-N 3.18Å; Q239-L243 WeakPolarHBondContact O-CB 3.39Å; Q239-L243 WeakPolarHBondContact O-CG 3.47Å; Q239-L243 PolarHBondContact O-N 3.41Å; Q239-L282 PolarHBondContact NE2-O 2.79Å; Q239-L282 VanDerWaalsContact NE2-O 3.13Å
240	E	98.8	Very high	98.6	Very high	99 Å²	99	71.3 Å²	71.3	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-59.6	-43.5	174.4	-72.7	-176.4	-170	0	0	112.4	T236 D237 K238 K244	T236-E240 WeakPolarHBondContact O-CG 3.36Å; T236-E240 PolarHBondContact O-N 3.49Å; D237-E240 PolarHBondContact O-N 3.11Å; K238-E240 VanDerWaalsContact C-N 3.34Å; K238-E240 PolarHBondContact O-N 3.28Å; E240-K244 VanDerWaalsContact O-CG 3.31Å; E240-K244 WeakPolarHBondContact O-CG 3.33Å; E240-K244 PolarHBondContact O-N 3.28Å
241	Y	98.9	Very high	98.6	Very high	56 Å²	56	65.1 Å²	65.1	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-46.1	177.6	175.8	-108	0	0	0	112.5	A167 F169 M214 A224 D237 K238 Q239 L243 K244 A245	A167-Y241 PolarHBondContact O-OH 2.97Å; F169-Y241 AromaticContact CE1-CE2 3.96Å; F169-Y241 HydrophobicContact CE1-CE2 3.96Å; F169-Y241 AromaticContact CE1-CZ 4Å; F169-Y241 HydrophobicContact CE2-CE2 4.49Å; F169-Y241 AromaticContact CZ-CD2 3.96Å; F169-Y241 HydrophobicContact CZ-CD2 3.96Å; F169-Y241 AromaticContact CZ-CE2 3.52Å; F169-Y241 HydrophobicContact CZ-CE2 3.52Å; M214-Y241 HydrophobicContact CE-CE1 3.94Å; M214-Y241 HydrophobicContact SD-CE1 4.36Å; M214-Y241 PolarHBondContact SD-OH 3.41Å; A224-Y241 HydrophobicContact CB-CD1 3.78Å; A224-Y241 HydrophobicContact CB-CE1 4.3Å; D237-Y241 WeakPolarHBondContact O-CB 3.37Å; D237-Y241 PolarHBondContact O-N 3.25Å; K238-Y241 PolarHBondContact O-N 3.32Å; Q239-Y241 VanDerWaalsContact C-N 3.35Å; Q239-Y241 PolarHBondContact O-N 2.78Å; Y241-L243 VanDerWaalsContact C-N 3.34Å; Y241-L243 PolarHBondContact O-N 3.25Å; Y241-K244 PolarHBondContact O-N 2.95Å; Y241-A245 PolarHBondContact O-N 3.25Å
242	L	98.9	Very high	98.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.9	-33.5	179.3	-66.5	178.1	0	0	0	112.4	I151 K238 Q239 A245 K246 I253 R281 L282	I151-L242 HydrophobicContact CD1-CD2 4.23Å; K238-L242 HydrophobicContact CG-CD1 3.91Å; K238-L242 HydrophobicContact CG-CG 4.42Å; K238-L242 WeakPolarHBondContact O-CG 3.24Å; K238-L242 PolarHBondContact O-N 3.3Å; Q239-L242 PolarHBondContact O-N 3.18Å; L242-A245 WeakPolarHBondContact O-CB 3.45Å; L242-A245 PolarHBondContact O-N 3.38Å; L242-K246 PolarHBondContact O-N 3.32Å; L242-I253 HydrophobicContact CD2-CD1 3.79Å; L242-R281 HydrophobicContact CD1-CB 3.89Å; L242-L282 HydrophobicContact CB-CD2 3.63Å; L242-L282 HydrophobicContact CD1-CD2 4.23Å
243	L	98.8	Very high	98.7	Very high	81 Å²	81	57.5 Å²	57.5	42%	0.424	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-41.4	172.9	-71.8	172.2	0	0	0	111.6	Q239 Y241 A245 K246 E247 L282	Q239-L243 WeakPolarHBondContact O-CB 3.39Å; Q239-L243 WeakPolarHBondContact O-CG 3.47Å; Q239-L243 PolarHBondContact O-N 3.41Å; Y241-L243 VanDerWaalsContact C-N 3.34Å; Y241-L243 PolarHBondContact O-N 3.25Å; L243-A245 VanDerWaalsContact C-N 3.31Å; L243-A245 PolarHBondContact O-N 3.09Å; L243-K246 WeakPolarHBondContact O-CB 3.1Å; L243-K246 PolarHBondContact O-N 3.48Å; L243-K246 VanDerWaalsContact O-N 3.15Å; L243-E247 WeakPolarHBondContact O-CG 3.26Å; L243-E247 PolarHBondContact O-N 3.17Å; L243-L282 HydrophobicContact CD2-CD2 4.4Å
244	K	98.8	Very high	98.7	Very high	112 Å²	112	55.3 Å²	55.3	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-39.1	171.7	-72	169	-176.1	165.1	0	112.2	F169 E240 Y241 K246 E247 A248	F169-K244 HydrophobicContact CE2-CB 3.89Å; F169-K244 HydrophobicContact CZ-CB 4.33Å; E240-K244 VanDerWaalsContact O-CG 3.31Å; E240-K244 WeakPolarHBondContact O-CG 3.33Å; E240-K244 PolarHBondContact O-N 3.28Å; Y241-K244 PolarHBondContact O-N 2.95Å; K244-K246 VanDerWaalsContact C-N 3.33Å; K244-K246 PolarHBondContact O-N 2.99Å; K244-E247 PolarHBondContact O-N 2.73Å; K244-A248 PolarHBondContact O-N 3.13Å
245	A	98.8	Very high	98.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-44.3	173.8	0	0	0	0	0	111.1	I151 F169 Y241 L242 L243 A248 E249 V250	I151-A245 HydrophobicContact CD1-CB 3.85Å; F169-A245 HydrophobicContact CD1-CB 4.1Å; F169-A245 HydrophobicContact CE1-CB 3.38Å; F169-A245 HydrophobicContact CZ-CB 3.65Å; Y241-A245 PolarHBondContact O-N 3.25Å; L242-A245 WeakPolarHBondContact O-CB 3.45Å; L242-A245 PolarHBondContact O-N 3.38Å; L243-A245 VanDerWaalsContact C-N 3.31Å; L243-A245 PolarHBondContact O-N 3.09Å; A245-A248 CarbonylContact O-C 3.58Å; A245-A248 WeakPolarHBondContact O-CA 3.37Å; A245-A248 WeakPolarHBondContact O-CB 3.39Å; A245-A248 PolarHBondContact O-N 3.06Å; A245-A248 VanDerWaalsContact O-N 3.12Å; A245-E249 PolarHBondContact O-N 3.36Å; A245-V250 HydrophobicContact CB-CB 4.07Å; A245-V250 HydrophobicContact CB-CG2 4.3Å; A245-V250 WeakPolarHBondContact O-CB 3.3Å; A245-V250 WeakPolarHBondContact O-CG2 3.38Å; A245-V250 PolarHBondContact O-N 3.33Å
246	K	98.4	Very high	98.7	Very high	104 Å²	104	50 Å²	50	45%	0.452	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-41.9	176.1	-170.8	177.4	-179	176.8	0	112.4	I151 L242 L243 K244 A248 E249 L282	I151-K246 HydrophobicContact CG2-CB 3.93Å; I151-K246 HydrophobicContact CG2-CG 4.45Å; L242-K246 PolarHBondContact O-N 3.32Å; L243-K246 WeakPolarHBondContact O-CB 3.1Å; L243-K246 PolarHBondContact O-N 3.48Å; L243-K246 VanDerWaalsContact O-N 3.15Å; K244-K246 VanDerWaalsContact C-N 3.33Å; K244-K246 PolarHBondContact O-N 2.99Å; K246-A248 PolarHBondContact O-N 3.37Å; K246-E249 WeakPolarHBondContact O-CA 3.48Å; K246-E249 PolarHBondContact O-N 2.87Å; K246-L282 HydrophobicContact CD-CD1 4.41Å
247	E	98.4	Very high	98.7	Very high	157 Å²	157	45.7 Å²	45.7	73%	0.734	22%	0.222	S	C	*	.	H	α-helix	trans	-60.7	-32.4	173.7	-72.3	170.7	-176	0	0	112	L243 K244 E249	L243-E247 WeakPolarHBondContact O-CG 3.26Å; L243-E247 PolarHBondContact O-N 3.17Å; K244-E247 PolarHBondContact O-N 2.73Å; E247-E249 PolarHBondContact O-N 3.38Å
248	A	98.2	Very high	98.7	Very high	34 Å²	34	42.4 Å²	42.4	28%	0.281	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	19.4	172.1	0	0	0	0	0	114.1	F169 N212 K244 A245 K246 V250	F169-A248 HydrophobicContact CB-CB 3.7Å; F169-A248 HydrophobicContact CD2-CB 4.05Å; F169-A248 HydrophobicContact CG-CB 3.91Å; N212-A248 PolarHBondContact ND2-O 2.72Å; N212-A248 VanDerWaalsContact ND2-O 3.09Å; K244-A248 PolarHBondContact O-N 3.13Å; A245-A248 CarbonylContact O-C 3.58Å; A245-A248 WeakPolarHBondContact O-CA 3.37Å; A245-A248 WeakPolarHBondContact O-CB 3.39Å; A245-A248 PolarHBondContact O-N 3.06Å; A245-A248 VanDerWaalsContact O-N 3.12Å; K246-A248 PolarHBondContact O-N 3.37Å; A248-V250 PolarHBondContact O-N 2.93Å
249	E	98.1	Very high	98.8	Very high	115 Å²	115	42.3 Å²	42.3	54%	0.537	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	20.5	-179.3	-47.7	-173.2	126.1	0	0	114.8	K162 N212 A245 K246 E247 C251	K162-E249 IonicContact NZ-OE2 3.1Å; K162-E249 PolarHBondContact NZ-OE2 3.03Å; K162-E249 VanDerWaalsContact NZ-OE2 3.1Å; N212-E249 WeakPolarHBondContact CB-O 3.44Å; N212-E249 PolarHBondContact N-O 2.94Å; A245-E249 PolarHBondContact O-N 3.36Å; K246-E249 WeakPolarHBondContact O-CA 3.48Å; K246-E249 PolarHBondContact O-N 2.87Å; E247-E249 PolarHBondContact O-N 3.38Å; E249-C251 PolarHBondContact O-N 3.03Å
250	V	98.8	Very high	98.8	Very high	2 Å²	2	40 Å²	40	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.2	173.8	-178.3	0	0	0	0	109.5	I151 V165 F169 N212 M214 A245 A248 N252	I151-V250 HydrophobicContact CD1-CB 4.31Å; I151-V250 HydrophobicContact CD1-CG1 3.79Å; V165-V250 HydrophobicContact CG2-CG2 3.81Å; F169-V250 HydrophobicContact CD1-CG2 4.18Å; N212-V250 HydrophobicContact CB-CG2 4.29Å; N212-V250 WeakPolarHBondContact O-CA 3.32Å; M214-V250 HydrophobicContact CB-CG1 3.72Å; A245-V250 HydrophobicContact CB-CB 4.07Å; A245-V250 HydrophobicContact CB-CG2 4.3Å; A245-V250 WeakPolarHBondContact O-CB 3.3Å; A245-V250 WeakPolarHBondContact O-CG2 3.38Å; A245-V250 PolarHBondContact O-N 3.33Å; A248-V250 PolarHBondContact O-N 2.93Å; V250-N252 VanDerWaalsContact CG1-O 3.32Å; V250-N252 WeakPolarHBondContact CG1-O 3.46Å
251	C	98.8	Very high	98.8	Very high	27 Å²	27	35.3 Å²	35.3	18%	0.182	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-28.2	178.8	-72.9	0	0	0	0	112.8	G150 I151 L153 V159 N212 E249	G150-C251 CarbonylContact C-O 3.42Å; G150-C251 WeakPolarHBondContact CA-O 3.48Å; I151-C251 PolarHBondContact N-O 3.09Å; L153-C251 HydrophobicContact CD1-CB 3.95Å; V159-C251 HydrophobicContact CG1-CB 4.04Å; V159-C251 HydrophobicContact CG2-CB 4.13Å; N212-C251 PolarHBondContact O-N 2.92Å; E249-C251 PolarHBondContact O-N 3.03Å
252	N	98.9	Very high	98.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	167.4	-178.1	71.1	-28	0	0	0	113.9	S148 G149 V159 T213 M214 V250 T277	S148-N252 VanDerWaalsContact CB-ND2 3.34Å; S148-N252 WeakPolarHBondContact CB-ND2 3.48Å; S148-N252 PolarHBondContact OG-ND2 2.97Å; G149-N252 CarbonylContact O-C 3.54Å; G149-N252 WeakPolarHBondContact O-CA 3.29Å; G149-N252 WeakPolarHBondContact O-CB 3.28Å; V159-N252 HydrophobicContact CB-CB 4.5Å; V159-N252 HydrophobicContact CG2-CB 4.08Å; T213-N252 WeakPolarHBondContact CA-O 3.27Å; T213-N252 WeakPolarHBondContact CA-OD1 3.33Å; T213-N252 VanDerWaalsContact CB-OD1 3.27Å; T213-N252 WeakPolarHBondContact CB-OD1 3.32Å; T213-N252 WeakPolarHBondContact CG2-OD1 3.41Å; T213-N252 PolarHBondContact OG1-OD1 3.4Å; M214-N252 PolarHBondContact N-O 3.35Å; V250-N252 VanDerWaalsContact CG1-O 3.32Å; V250-N252 WeakPolarHBondContact CG1-O 3.46Å; N252-T277 HydrophobicContact CB-CG2 4.2Å
253	I	98.9	Very high	98.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.7	-176	-41.9	176.1	0	0	0	110.2	S148 G149 I151 M214 T216 Q223 L242	S148-I253 VanDerWaalsContact CA-O 3.26Å; S148-I253 WeakPolarHBondContact CA-O 3.32Å; S148-I253 WeakPolarHBondContact CB-O 3.26Å; G149-I253 PolarHBondContact N-O 3.37Å; G149-I253 PolarHBondContact O-N 3.2Å; I151-I253 HydrophobicContact CD1-CD1 3.88Å; I151-I253 HydrophobicContact CD1-CG1 3.86Å; I151-I253 HydrophobicContact CG1-CD1 4.14Å; I151-I253 HydrophobicContact CG1-CG1 4.11Å; M214-I253 HydrophobicContact CB-CG2 4.41Å; M214-I253 HydrophobicContact CE-CB 4.31Å; M214-I253 HydrophobicContact CE-CD1 3.57Å; M214-I253 HydrophobicContact CE-CG1 3.77Å; M214-I253 HydrophobicContact CE-CG2 3.6Å; M214-I253 WeakPolarHBondContact O-CA 3.39Å; T216-I253 HydrophobicContact CG2-CG2 3.78Å; Q223-I253 HydrophobicContact CB-CG2 4.28Å; Q223-I253 HydrophobicContact CG-CG2 3.78Å; L242-I253 HydrophobicContact CD2-CD1 3.79Å
254	E	98.9	Very high	98.7	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.028	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-165.2	174.8	56.8	82.2	-103.7	0	0	110.6	R144 T213 M214 C215 T216 E256 S257	R144-E254 IonicContact CZ-OE2 2.93Å; R144-E254 IonicContact NE-OE2 2.77Å; R144-E254 PolarHBondContact NE-OE2 3.36Å; R144-E254 IonicContact NH2-OE2 3.02Å; R144-E254 PolarHBondContact NH2-OE2 2.93Å; T213-E254 HydrophobicContact CG2-CG 3.47Å; T213-E254 VanDerWaalsContact CG2-CG 3.47Å; M214-E254 PolarHBondContact O-N 2.83Å; C215-E254 CarbonylContact C-O 3.59Å; C215-E254 WeakPolarHBondContact CA-O 3.41Å; T216-E254 PolarHBondContact N-O 2.8Å; E254-E256 PolarHBondContact OE1-N 2.82Å; E254-E256 PolarHBondContact OE2-N 3.27Å; E254-S257 WeakPolarHBondContact OE1-CB 3.48Å; E254-S257 PolarHBondContact OE1-N 3.46Å; E254-S257 PolarHBondContact OE1-OG 2.84Å; E254-S257 PolarHBondContact OE2-N 3.5Å; E254-S257 VanDerWaalsContact OE2-N 3.12Å
255	M	98.9	Very high	98.7	Very high	27 Å²	27	28.9 Å²	28.9	13%	0.133	14%	0.142	C	C	.	.	S	Bend	trans	-132.7	14.3	-164.5	-59.7	-179.2	69.9	0	0	115.1	G117 I118 T216 L217 F219	G117-M255 CarbonylContact C-O 3.43Å; G117-M255 WeakPolarHBondContact CA-O 3.48Å; I118-M255 WeakPolarHBondContact CG1-O 3.21Å; I118-M255 PolarHBondContact N-O 3.39Å; T216-M255 WeakPolarHBondContact O-CA 3.42Å; L217-M255 WeakPolarHBondContact O-CE 3.23Å; F219-M255 HydrophobicContact CB-CE 4.37Å; F219-M255 HydrophobicContact CB-SD 3.89Å; F219-M255 HydrophobicContact CD2-SD 4.11Å
256	E	98.9	Very high	98.6	Very high	14 Å²	14	32.2 Å²	32.2	7%	0.065	16%	0.159	C	C	.	.	S	Bend	trans	-141.5	-18.6	-171.8	-65.4	83.8	-177.2	0	0	115	M116 G117 I121 R144 C215 E254 S258 F260	M116-E256 WeakPolarHBondContact CA-OE1 3.24Å; G117-E256 PolarHBondContact N-OE1 2.95Å; I121-E256 HydrophobicContact CB-CB 4.4Å; I121-E256 HydrophobicContact CB-CG 4.16Å; I121-E256 HydrophobicContact CD1-CB 3.83Å; I121-E256 HydrophobicContact CD1-CG 4.27Å; I121-E256 HydrophobicContact CG2-CB 3.91Å; I121-E256 HydrophobicContact CG2-CG 3.92Å; R144-E256 VanDerWaalsContact CZ-CB 3.48Å; R144-E256 IonicContact CZ-OE2 3.02Å; R144-E256 VanDerWaalsContact CZ-OE2 3.25Å; R144-E256 IonicContact NH1-OE2 2.91Å; R144-E256 IonicContact NH2-OE2 3.8Å; R144-E256 PolarHBondContact NH2-OE2 3.22Å; C215-E256 PolarHBondContact SG-N 2.97Å; E254-E256 PolarHBondContact OE1-N 2.82Å; E254-E256 PolarHBondContact OE2-N 3.27Å; E256-S258 VanDerWaalsContact C-N 3.29Å; E256-S258 PolarHBondContact O-N 3.07Å; E256-F260 VanDerWaalsContact O-CB 3.31Å; E256-F260 WeakPolarHBondContact O-CB 3.43Å; E256-F260 PolarHBondContact O-N 2.92Å
257	S	98.9	Very high	98.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-30.8	-170.1	59.1	0	0	0	0	114.1	S164 E254 A261	S164-S257 WeakPolarHBondContact CB-OG 3.43Å; S164-S257 VanDerWaalsContact OG-C 3.3Å; S164-S257 WeakPolarHBondContact OG-CB 3.35Å; S164-S257 PolarHBondContact OG-OG 2.92Å; E254-S257 WeakPolarHBondContact OE1-CB 3.48Å; E254-S257 PolarHBondContact OE1-N 3.46Å; E254-S257 PolarHBondContact OE1-OG 2.84Å; E254-S257 PolarHBondContact OE2-N 3.5Å; E254-S257 VanDerWaalsContact OE2-N 3.12Å; S257-A261 WeakPolarHBondContact O-CB 3.45Å; S257-A261 PolarHBondContact O-N 3.42Å
258	S	98.8	Very high	98.5	Very high	5 Å²	5	21.9 Å²	21.9	4%	0.035	12%	0.123	C	C	.	.	H	α-helix	trans	-68.3	-53.9	-174.3	59.4	0	0	0	0	112.2	I118 S164 C215 E256 F260 A261 A262	I118-S258 WeakPolarHBondContact CD1-OG 3.48Å; S164-S258 WeakPolarHBondContact OG-CA 3.41Å; S164-S258 PolarHBondContact OG-N 3.2Å; C215-S258 PolarHBondContact SG-OG 3.46Å; E256-S258 VanDerWaalsContact C-N 3.29Å; E256-S258 PolarHBondContact O-N 3.07Å; S258-F260 VanDerWaalsContact C-N 3.32Å; S258-A261 PolarHBondContact O-N 3.31Å; S258-A262 WeakPolarHBondContact O-CB 3.34Å; S258-A262 PolarHBondContact O-N 3.37Å
259	V	98.9	Very high	98.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.3	-34.2	176.6	66.2	0	0	0	0	111.8	I118 I121 A122 F173 A262 M263	I118-V259 HydrophobicContact CB-CG1 4.15Å; I118-V259 HydrophobicContact CG1-CG1 4.07Å; I118-V259 HydrophobicContact CG2-CB 3.98Å; I118-V259 HydrophobicContact CG2-CG1 3.87Å; I118-V259 HydrophobicContact CG2-CG2 4.45Å; I121-V259 HydrophobicContact CG2-CG1 3.38Å; A122-V259 HydrophobicContact CB-CG2 3.93Å; F173-V259 HydrophobicContact CD1-CG2 4.49Å; F173-V259 HydrophobicContact CD2-CB 4.17Å; F173-V259 HydrophobicContact CE1-CB 4.1Å; F173-V259 HydrophobicContact CE1-CG2 3.77Å; F173-V259 HydrophobicContact CE2-CB 3.76Å; F173-V259 HydrophobicContact CE2-CG2 4.19Å; F173-V259 HydrophobicContact CZ-CB 3.71Å; F173-V259 HydrophobicContact CZ-CG2 3.6Å; V259-A262 PolarHBondContact O-N 3.22Å; V259-M263 HydrophobicContact CG2-CG 3.98Å; V259-M263 HydrophobicContact CG2-SD 3.64Å; V259-M263 WeakPolarHBondContact O-CB 3.37Å; V259-M263 WeakPolarHBondContact O-CG 3.15Å; V259-M263 PolarHBondContact O-N 3.12Å
260	F	98.9	Very high	98.5	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.9	-53.2	173.8	175.3	-94.8	0	0	0	111.2	V64 I121 L125 I142 R144 L188 E256 S258 C264 A271 A272 V273	V64-F260 HydrophobicContact CG2-CD2 4.27Å; V64-F260 HydrophobicContact CG2-CE2 3.8Å; I121-F260 HydrophobicContact CD1-CB 4.18Å; I121-F260 HydrophobicContact CD1-CD2 4.12Å; L125-F260 HydrophobicContact CD1-CB 4.32Å; L125-F260 HydrophobicContact CD1-CD2 4.17Å; L125-F260 HydrophobicContact CD2-CD2 4.13Å; L125-F260 HydrophobicContact CD2-CE2 4.43Å; I142-F260 HydrophobicContact CD1-CE2 3.81Å; I142-F260 HydrophobicContact CD1-CZ 4.4Å; I142-F260 HydrophobicContact CG1-CE2 3.81Å; I142-F260 HydrophobicContact CG1-CZ 3.96Å; I142-F260 HydrophobicContact CG2-CE2 4.46Å; I142-F260 HydrophobicContact CG2-CZ 4.08Å; R144-F260 HydrophobicContact CB-CD1 4.38Å; R144-F260 HydrophobicContact CB-CD2 4.27Å; R144-F260 HydrophobicContact CB-CE1 4.13Å; R144-F260 HydrophobicContact CB-CE2 4.02Å; R144-F260 HydrophobicContact CB-CG 4.44Å; R144-F260 HydrophobicContact CB-CZ 3.94Å; L188-F260 HydrophobicContact CD2-CD1 4.36Å; L188-F260 HydrophobicContact CD2-CE1 4.28Å; E256-F260 VanDerWaalsContact O-CB 3.31Å; E256-F260 WeakPolarHBondContact O-CB 3.43Å; E256-F260 PolarHBondContact O-N 2.92Å; S258-F260 VanDerWaalsContact C-N 3.32Å; F260-C264 VanDerWaalsContact O-CB 3.32Å; F260-C264 WeakPolarHBondContact O-CB 3.16Å; F260-C264 PolarHBondContact O-N 3.27Å; F260-C264 PolarHBondContact O-SG 2.86Å; F260-A271 HydrophobicContact CE1-CB 3.9Å; F260-A271 HydrophobicContact CZ-CB 4.16Å; F260-A272 WeakPolarHBondContact CE1-O 3.43Å; F260-V273 HydrophobicContact CD1-CG2 3.51Å; F260-V273 HydrophobicContact CE1-CG2 3.72Å; F260-V273 HydrophobicContact CG-CG2 4.5Å
261	A	98.9	Very high	98.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.1	-47.8	179	0	0	0	0	0	111.6	T186 L188 S257 S258 M263 C264 K265	T186-A261 VanDerWaalsContact O-CB 3.23Å; T186-A261 WeakPolarHBondContact O-CB 3.18Å; L188-A261 HydrophobicContact CD2-CB 3.67Å; L188-A261 HydrophobicContact CG-CB 3.9Å; S257-A261 WeakPolarHBondContact O-CB 3.45Å; S257-A261 PolarHBondContact O-N 3.42Å; S258-A261 PolarHBondContact O-N 3.31Å; A261-M263 PolarHBondContact O-N 2.96Å; A261-C264 PolarHBondContact O-N 3.36Å; A261-K265 WeakPolarHBondContact O-CB 3.44Å; A261-K265 PolarHBondContact O-N 3.4Å
262	A	98.8	Very high	98.5	Very high	1 Å²	1	17 Å²	17	1%	0.008	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-45.7	-178.6	0	0	0	0	0	112.8	F173 R184 S258 V259 L266	F173-A262 HydrophobicContact CB-CB 4Å; F173-A262 HydrophobicContact CD1-CB 3.85Å; F173-A262 HydrophobicContact CG-CB 4.23Å; R184-A262 HydrophobicContact CB-CB 4.04Å; S258-A262 WeakPolarHBondContact O-CB 3.34Å; S258-A262 PolarHBondContact O-N 3.37Å; V259-A262 PolarHBondContact O-N 3.22Å; A262-L266 WeakPolarHBondContact O-CG 3.39Å; A262-L266 PolarHBondContact O-N 3.49Å; A262-L266 VanDerWaalsContact O-N 3.09Å
263	M	98.8	Very high	98.5	Very high	9 Å²	9	17 Å²	17	4%	0.044	9%	0.09	C	C	.	.	H	α-helix	trans	-72.3	-38.6	179.9	-69.9	-177.2	69.6	0	0	112.4	A122 L125 H126 I129 V259 A261 K265 L266 S267	A122-M263 HydrophobicContact CB-SD 4.22Å; L125-M263 HydrophobicContact CB-CE 3.68Å; L125-M263 HydrophobicContact CB-SD 3.93Å; L125-M263 HydrophobicContact CD1-CB 4.3Å; L125-M263 HydrophobicContact CD1-SD 4.07Å; H126-M263 HydrophobicContact CB-CE 4.24Å; H126-M263 WeakPolarHBondContact CD2-CE 3.07Å; I129-M263 HydrophobicContact CD1-CB 4.32Å; I129-M263 HydrophobicContact CD1-CE 4.18Å; V259-M263 HydrophobicContact CG2-CG 3.98Å; V259-M263 HydrophobicContact CG2-SD 3.64Å; V259-M263 WeakPolarHBondContact O-CB 3.37Å; V259-M263 WeakPolarHBondContact O-CG 3.15Å; V259-M263 PolarHBondContact O-N 3.12Å; A261-M263 PolarHBondContact O-N 2.96Å; M263-K265 VanDerWaalsContact C-N 3.35Å; M263-L266 PolarHBondContact O-N 2.86Å; M263-S267 PolarHBondContact O-N 2.99Å; M263-S267 PolarHBondContact O-OG 3.39Å
264	C	98.7	Very high	98.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.007	9%	0.09	C	C	.	.	H	α-helix	trans	-63.3	-43.5	176.2	-68	0	0	0	0	111.4	I142 F260 A261 L266 S267 G268 L269 A271	I142-C264 HydrophobicContact CG2-CB 4.37Å; I142-C264 VanDerWaalsContact CG2-SG 3.56Å; F260-C264 VanDerWaalsContact O-CB 3.32Å; F260-C264 WeakPolarHBondContact O-CB 3.16Å; F260-C264 PolarHBondContact O-N 3.27Å; F260-C264 PolarHBondContact O-SG 2.86Å; A261-C264 PolarHBondContact O-N 3.36Å; C264-L266 PolarHBondContact O-N 3.42Å; C264-S267 CarbonylContact O-C 3.58Å; C264-S267 PolarHBondContact O-N 3.26Å; C264-S267 VanDerWaalsContact O-N 3.11Å; C264-G268 PolarHBondContact O-N 2.66Å; C264-G268 VanDerWaalsContact O-N 3.14Å; C264-L269 HydrophobicContact CB-CB 3.99Å; C264-L269 PolarHBondContact O-N 3.01Å; C264-A271 HydrophobicContact CB-CB 3.5Å
265	K	97.7	Very high	98.5	Very high	103 Å²	103	16.6 Å²	16.6	45%	0.448	9%	0.088	S	C	.	.	H	α-helix	trans	-60	-45.4	175.7	-176.8	173.1	-179.6	178.2	0	112	S185 D187 A261 M263 S267 G268	S185-K265 PolarHBondContact OG-NZ 3.43Å; D187-K265 HydrophobicContact CB-CD 4.2Å; D187-K265 IonicContact OD2-NZ 2.64Å; D187-K265 PolarHBondContact OD2-NZ 2.85Å; A261-K265 WeakPolarHBondContact O-CB 3.44Å; A261-K265 PolarHBondContact O-N 3.4Å; M263-K265 VanDerWaalsContact C-N 3.35Å; K265-S267 PolarHBondContact O-N 3.19Å; K265-G268 PolarHBondContact O-N 3.37Å
266	L	97.4	Very high	98.5	Very high	70 Å²	70	15.3 Å²	15.3	37%	0.366	8%	0.082	S	C	.	.	H	α-helix	trans	-60.5	-31.7	175.5	-76.1	175.5	0	0	0	112.8	H28 A262 M263 C264	H28-L266 PolarHBondContact CD2-O 3.17Å; H28-L266 PolarHBondContact NE2-O 3.43Å; A262-L266 WeakPolarHBondContact O-CG 3.39Å; A262-L266 PolarHBondContact O-N 3.49Å; A262-L266 VanDerWaalsContact O-N 3.09Å; M263-L266 PolarHBondContact O-N 2.86Å; C264-L266 PolarHBondContact O-N 3.42Å
267	S	97.7	Very high	98.5	Very high	10 Å²	10	14.7 Å²	14.7	7%	0.07	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	4.1	-178.8	-53.8	0	0	0	0	113.9	Y26 I129 M263 C264 K265 L269	Y26-S267 PolarHBondContact N-O 2.89Å; Y26-S267 WeakPolarHBondContact O-CA 3.44Å; Y26-S267 WeakPolarHBondContact O-CB 3.17Å; I129-S267 VanDerWaalsContact CD1-OG 3.26Å; I129-S267 WeakPolarHBondContact CD1-OG 3.32Å; I129-S267 WeakPolarHBondContact CG2-OG 3.46Å; M263-S267 PolarHBondContact O-N 2.99Å; M263-S267 PolarHBondContact O-OG 3.39Å; C264-S267 CarbonylContact O-C 3.58Å; C264-S267 PolarHBondContact O-N 3.26Å; C264-S267 VanDerWaalsContact O-N 3.11Å; K265-S267 PolarHBondContact O-N 3.19Å; S267-L269 PolarHBondContact O-N 2.7Å
268	G	96.7	Very high	98.5	Very high	34 Å²	34	16 Å²	16	35%	0.351	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	18.4	-174.5	0	0	0	0	0	114.5	C264 K265	C264-G268 PolarHBondContact O-N 2.66Å; C264-G268 VanDerWaalsContact O-N 3.14Å; K265-G268 PolarHBondContact O-N 3.37Å
269	L	97.9	Very high	98.5	Very high	10 Å²	10	16.5 Å²	16.5	5%	0.052	9%	0.088	C	C	.	.			trans	-77.7	129.8	177.8	-80.7	165.1	0	0	0	110.4	I25 I129 L132 V140 I142 C264 S267 A271	I25-L269 HydrophobicContact CD1-CD2 3.37Å; I25-L269 HydrophobicContact CD1-CG 3.99Å; I25-L269 HydrophobicContact CG1-CD2 4.48Å; I129-L269 HydrophobicContact CG1-CD1 3.92Å; L132-L269 HydrophobicContact CD1-CD2 4.48Å; V140-L269 HydrophobicContact CB-CD2 3.8Å; V140-L269 HydrophobicContact CG1-CD2 3.97Å; I142-L269 HydrophobicContact CG2-CB 3.98Å; I142-L269 HydrophobicContact CG2-CD1 4.32Å; I142-L269 HydrophobicContact CG2-CD2 4.48Å; C264-L269 HydrophobicContact CB-CB 3.99Å; C264-L269 PolarHBondContact O-N 3.01Å; S267-L269 PolarHBondContact O-N 2.7Å; L269-A271 PolarHBondContact O-N 3.46Å
270	R	98.1	Very high	98.5	Very high	59 Å²	59	17.1 Å²	17.1	22%	0.223	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	116.7	168.3	-176.9	174.1	-164.9	-138.2	3.6	108.9	T141 I142 D189 S191 L192 E195 Y308	T141-R270 CarbonylContact C-O 3.55Å; T141-R270 WeakPolarHBondContact CA-O 3.46Å; I142-R270 PolarHBondContact N-O 2.62Å; D189-R270 HydrophobicContact CB-CG 4.08Å; D189-R270 WeakPolarHBondContact OD2-CD 3.39Å; D189-R270 VanDerWaalsContact OD2-CG 3.28Å; D189-R270 WeakPolarHBondContact OD2-CG 3.35Å; D189-R270 IonicContact OD2-CZ 2.97Å; D189-R270 IonicContact OD2-NE 3.48Å; D189-R270 PolarHBondContact OD2-NE 3.15Å; S191-R270 PolarHBondContact OG-NH2 3.46Å; L192-R270 HydrophobicContact CD2-CG 4.02Å; E195-R270 IonicContact OE1-CZ 3.96Å; E195-R270 IonicContact OE1-NH1 3.6Å; E195-R270 IonicContact OE1-NH2 3.73Å; E195-R270 PolarHBondContact OE1-NH2 3.49Å; E195-R270 IonicContact OE2-CZ 3.42Å; E195-R270 IonicContact OE2-NH1 3.97Å; E195-R270 PolarHBondContact OE2-NH1 2.68Å; E195-R270 IonicContact OE2-NH2 3.95Å; E195-R270 PolarHBondContact OE2-NH2 2.98Å; R270-Y308 PolarHBondContact NH1-OH 3.07Å
271	A	98.8	Very high	98.5	Very high	4 Å²	4	17.1 Å²	17.1	3%	0.033	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.2	-167.9	0	0	0	0	0	114.8	I142 L188 D189 F260 C264 L269	I142-A271 HydrophobicContact CG2-CB 3.69Å; I142-A271 VanDerWaalsContact O-CA 3.23Å; I142-A271 WeakPolarHBondContact O-CA 3.37Å; L188-A271 HydrophobicContact CD2-CB 4.02Å; D189-A271 PolarHBondContact N-O 2.88Å; F260-A271 HydrophobicContact CE1-CB 3.9Å; F260-A271 HydrophobicContact CZ-CB 4.16Å; C264-A271 HydrophobicContact CB-CB 3.5Å; L269-A271 PolarHBondContact O-N 3.46Å
272	A	98.9	Very high	98.4	Very high	2 Å²	2	18.7 Å²	18.7	2%	0.017	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	158	171.1	0	0	0	0	0	112.4	I142 I143 R144 L192 L196 F260	I142-A272 PolarHBondContact O-N 2.95Å; I142-A272 VanDerWaalsContact O-N 3.11Å; I143-A272 WeakPolarHBondContact CA-O 3.37Å; I143-A272 HydrophobicContact CG1-CB 4.45Å; I143-A272 HydrophobicContact CG2-CB 4.45Å; R144-A272 PolarHBondContact N-O 2.82Å; L192-A272 HydrophobicContact CD2-CB 3.49Å; L192-A272 VanDerWaalsContact CD2-CB 3.49Å; L192-A272 HydrophobicContact CG-CB 3.79Å; L196-A272 HydrophobicContact CD1-CB 3.62Å; F260-A272 WeakPolarHBondContact CE1-O 3.43Å
273	V	98.9	Very high	98.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.2	172.9	-179.8	0	0	0	0	108.3	R144 T161 L188 F260	R144-V273 HydrophobicContact CB-CB 4.49Å; R144-V273 HydrophobicContact CB-CG1 4.34Å; R144-V273 HydrophobicContact CB-CG2 4.16Å; R144-V273 HydrophobicContact CG-CG1 4.27Å; T161-V273 PolarHBondContact N-O 2.76Å; T161-V273 WeakPolarHBondContact OG1-CB 3.11Å; L188-V273 HydrophobicContact CD1-CB 4.36Å; L188-V273 HydrophobicContact CD1-CG2 3.96Å; L188-V273 HydrophobicContact CD2-CG2 4.48Å; F260-V273 HydrophobicContact CD1-CG2 3.51Å; F260-V273 HydrophobicContact CE1-CG2 3.72Å; F260-V273 HydrophobicContact CG-CG2 4.5Å
274	V	98.9	Very high	98.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	107.2	-177.1	-176.4	0	0	0	0	108.4	I143 R144 I145 G146 V158 V160 L196 P301 L304 V305	I143-V274 HydrophobicContact CG2-CG2 3.89Å; R144-V274 PolarHBondContact O-N 3.03Å; I145-V274 WeakPolarHBondContact CA-O 3.43Å; G146-V274 PolarHBondContact N-O 3.31Å; V158-V274 HydrophobicContact CG1-CG1 3.56Å; V160-V274 HydrophobicContact CG2-CG2 4.38Å; L196-V274 HydrophobicContact CD1-CG2 3.84Å; V274-P301 HydrophobicContact CG1-CB 4.06Å; V274-L304 HydrophobicContact CG1-CD2 3.9Å; V274-V305 HydrophobicContact CB-CG2 4.37Å; V274-V305 HydrophobicContact CG2-CG2 4.18Å
275	C	98.9	Very high	98.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.8	-175.9	-71.9	0	0	0	0	111.1	G146 V158 V159	G146-C275 WeakPolarHBondContact O-CA 3.2Å; V158-C275 CarbonylContact C-O 3.5Å; V158-C275 WeakPolarHBondContact CA-O 3.41Å; V159-C275 PolarHBondContact N-O 2.78Å; V159-C275 PolarHBondContact O-N 3.06Å
276	V	98.9	Very high	98.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	141.2	167.5	67.4	0	0	0	0	110.3	G146 T147 S148 G156 V158 L278 Y297 P301	G146-V276 PolarHBondContact O-N 2.96Å; T147-V276 CarbonylContact C-O 3.58Å; T147-V276 WeakPolarHBondContact CA-O 3.24Å; T147-V276 HydrophobicContact CG2-CG1 3.83Å; S148-V276 PolarHBondContact N-O 2.77Å; S148-V276 PolarHBondContact OG-O 3.29Å; G156-V276 WeakPolarHBondContact O-CG2 3.39Å; V158-V276 HydrophobicContact CG2-CB 4.44Å; V158-V276 HydrophobicContact CG2-CG2 4.39Å; V276-L278 HydrophobicContact CG1-CD2 4.1Å; V276-Y297 WeakPolarHBondContact CG1-O 3.47Å; V276-P301 HydrophobicContact CB-CG 3.85Å; V276-P301 HydrophobicContact CG1-CG 4.08Å
277	T	98.8	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131.1	171	63.6	0	0	0	0	109.5	S148 G150 L153 E154 G156 T157 V159 N252	S148-T277 CarbonylContact O-C 3.59Å; S148-T277 WeakPolarHBondContact O-CA 3.19Å; G150-T277 VanDerWaalsContact CA-CG2 3.46Å; L153-T277 HydrophobicContact CD1-CG2 4.2Å; E154-T277 PolarHBondContact O-OG1 3Å; G156-T277 WeakPolarHBondContact CA-O 3.37Å; G156-T277 PolarHBondContact N-O 3.23Å; G156-T277 PolarHBondContact N-OG1 3.42Å; T157-T277 PolarHBondContact N-OG1 2.91Å; T157-T277 PolarHBondContact O-N 2.79Å; T157-T277 PolarHBondContact O-OG1 2.6Å; V159-T277 HydrophobicContact CG2-CG2 4.01Å; N252-T277 HydrophobicContact CB-CG2 4.2Å
278	L	98.6	Very high	98	Very high	27 Å²	27	34.1 Å²	34.1	14%	0.141	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-18.9	179	-61.6	-176.5	0	0	0	113.3	T147 S148 V276 L287 L294 Q298	T147-L278 HydrophobicContact CG2-CD1 3.89Å; T147-L278 HydrophobicContact CG2-CD2 3.97Å; T147-L278 HydrophobicContact CG2-CG 4.07Å; S148-L278 PolarHBondContact O-N 3.35Å; V276-L278 HydrophobicContact CG1-CD2 4.1Å; L278-L287 HydrophobicContact CB-CD2 3.64Å; L278-L287 HydrophobicContact CD1-CD1 4.46Å; L278-L294 HydrophobicContact CD2-CD2 4.37Å; L278-Q298 HydrophobicContact CD2-CG 4.45Å
279	L	98.7	Very high	97.8	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.089	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	163.8	-179.8	70.2	168.4	0	0	0	109.7	G150 G284 L287	G150-L279 WeakPolarHBondContact CA-O 3.38Å; G150-L279 PolarHBondContact N-O 3.41Å; L279-G284 WeakPolarHBondContact CD1-O 3.46Å; L279-L287 HydrophobicContact CB-CD2 4.09Å; L279-L287 HydrophobicContact CD1-CD2 4.49Å; L279-L287 HydrophobicContact CD2-CD2 3.85Å; L279-L287 HydrophobicContact CG-CD2 4.36Å
280	D	98.7	Very high	97.6	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.064	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.8	164.5	-174.2	-4.6	0	0	0	109.4	G152 L153 L282 K283 G284	G152-D280 PolarHBondContact N-OD1 2.96Å; L153-D280 WeakPolarHBondContact O-CB 3.19Å; D280-L282 PolarHBondContact O-N 2.91Å; D280-L282 WeakPolarHBondContact OD1-CB 3.39Å; D280-L282 PolarHBondContact OD1-N 2.94Å; D280-K283 HydrophobicContact CB-CB 4.28Å; D280-K283 HydrophobicContact CB-CD 3.97Å; D280-K283 HydrophobicContact CB-CG 4.02Å; D280-K283 PolarHBondContact O-N 3.03Å; D280-K283 VanDerWaalsContact OD2-CE 3.24Å; D280-K283 WeakPolarHBondContact OD2-CE 3.35Å; D280-K283 IonicContact OD2-NZ 3.73Å; D280-G284 PolarHBondContact O-N 2.85Å
281	R	98.8	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-20.3	-178	-70.5	-62.9	-52.5	-59.1	-8.6	113.6	G150 Q223 A224 L242 K283 G284 D285	G150-R281 WeakPolarHBondContact O-CB 3.48Å; G150-R281 PolarHBondContact O-N 2.88Å; Q223-R281 VanDerWaalsContact O-CZ 3.24Å; Q223-R281 PolarHBondContact O-NH1 3.25Å; Q223-R281 PolarHBondContact O-NH2 3.03Å; A224-R281 PolarHBondContact O-NH2 3.42Å; L242-R281 HydrophobicContact CD1-CB 3.89Å; R281-K283 PolarHBondContact O-N 3.35Å; R281-G284 WeakPolarHBondContact CA-O 3.42Å; R281-D285 IonicContact CZ-OD1 3.5Å; R281-D285 VanDerWaalsContact CZ-OD1 3.24Å; R281-D285 IonicContact NE-OD1 2.7Å; R281-D285 PolarHBondContact NE-OD1 2.93Å; R281-D285 IonicContact NH2-OD1 2.72Å; R281-D285 PolarHBondContact NH2-OD1 3.18Å
282	L	98.6	Very high	97.1	Very high	33 Å²	33	48 Å²	48	17%	0.173	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.5	171.1	-61.8	178.9	0	0	0	112	I151 Q239 L242 L243 K246 D280	I151-L282 HydrophobicContact CG2-CD1 4.19Å; I151-L282 HydrophobicContact CG2-CD2 4.27Å; I151-L282 HydrophobicContact CG2-CG 4.11Å; Q239-L282 PolarHBondContact NE2-O 2.79Å; Q239-L282 VanDerWaalsContact NE2-O 3.13Å; L242-L282 HydrophobicContact CB-CD2 3.63Å; L242-L282 HydrophobicContact CD1-CD2 4.23Å; L243-L282 HydrophobicContact CD2-CD2 4.4Å; K246-L282 HydrophobicContact CD-CD1 4.41Å; D280-L282 PolarHBondContact O-N 2.91Å; D280-L282 WeakPolarHBondContact OD1-CB 3.39Å; D280-L282 PolarHBondContact OD1-N 2.94Å
283	K	98.4	Very high	96.9	Very high	141 Å²	141	50.2 Å²	50.2	61%	0.613	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-11.1	-178.4	-58.1	-179.8	-170.8	169.1	0	113.6	E154 D280 R281	E154-K283 IonicContact OE1-NZ 2.59Å; E154-K283 PolarHBondContact OE1-NZ 3.16Å; E154-K283 IonicContact OE2-NZ 2.76Å; D280-K283 HydrophobicContact CB-CB 4.28Å; D280-K283 HydrophobicContact CB-CD 3.97Å; D280-K283 HydrophobicContact CB-CG 4.02Å; D280-K283 PolarHBondContact O-N 3.03Å; D280-K283 VanDerWaalsContact OD2-CE 3.24Å; D280-K283 WeakPolarHBondContact OD2-CE 3.35Å; D280-K283 IonicContact OD2-NZ 3.73Å; R281-K283 PolarHBondContact O-N 3.35Å
284	G	98.1	Very high	96.7	Very high	23 Å²	23	51.3 Å²	51.3	24%	0.237	28%	0.277	C	S	.	.			trans	158.9	178.3	176.7	0	0	0	0	0	115	L279 D280 R281	L279-G284 WeakPolarHBondContact CD1-O 3.46Å; D280-G284 PolarHBondContact O-N 2.85Å; R281-G284 WeakPolarHBondContact CA-O 3.42Å
285	D	98.6	Very high	96.4	Very high	17 Å²	17	53.8 Å²	53.8	9%	0.091	29%	0.29	C	S	.	.	S	Bend	trans	-111.8	-9	-178.5	-63.8	-39.6	0	0	0	113.8	R225 L226 D227 K238 R281	R225-D285 HydrophobicContact CB-CB 4.28Å; R225-D285 PolarHBondContact NE-O 2.76Å; R225-D285 PolarHBondContact NH2-O 3.37Å; L226-D285 PolarHBondContact N-OD2 3.39Å; D227-D285 WeakPolarHBondContact OD2-CB 3.21Å; K238-D285 WeakPolarHBondContact CE-OD1 3.23Å; K238-D285 IonicContact NZ-OD1 2.82Å; K238-D285 PolarHBondContact NZ-OD1 3.47Å; K238-D285 IonicContact NZ-OD2 2.76Å; K238-D285 PolarHBondContact NZ-OD2 3.43Å; R281-D285 IonicContact CZ-OD1 3.5Å; R281-D285 VanDerWaalsContact CZ-OD1 3.24Å; R281-D285 IonicContact NE-OD1 2.7Å; R281-D285 PolarHBondContact NE-OD1 2.93Å; R281-D285 IonicContact NH2-OD1 2.72Å; R281-D285 PolarHBondContact NH2-OD1 3.18Å
286	Q	97.9	Very high	96.2	Very high	138 Å²	138	56.4 Å²	56.4	65%	0.645	31%	0.308	S	S	*	.	S	Bend	trans	-111	145.6	-178.5	-72	-73.6	-24.2	0	0	111.2	D227 S288	D227-Q286 PolarHBondContact OD2-NE2 3.13Å; Q286-S288 PolarHBondContact O-N 2.94Å
287	L	95.2	Very high	96.1	Very high	79 Å²	79	58 Å²	58	41%	0.414	32%	0.315	S	S	.	.			trans	-72.7	125.6	174.1	-60.5	179.3	0	0	0	109.2	L278 L279 L294	L278-L287 HydrophobicContact CB-CD2 3.64Å; L278-L287 HydrophobicContact CD1-CD1 4.46Å; L279-L287 HydrophobicContact CB-CD2 4.09Å; L279-L287 HydrophobicContact CD1-CD2 4.49Å; L279-L287 HydrophobicContact CD2-CD2 3.85Å; L279-L287 HydrophobicContact CG-CD2 4.36Å; L287-L294 HydrophobicContact CB-CD1 4.36Å; L287-L294 HydrophobicContact CD1-CD1 3.91Å; L287-L294 HydrophobicContact CD1-CD2 4.16Å; L287-L294 HydrophobicContact CD2-CD2 4.35Å
288	S	90.8	Very high	95.8	Very high	121 Å²	121	60 Å²	60	85%	0.846	32%	0.324	S	S	*	.			trans	-107.8	-10.7	177.2	57.3	0	0	0	0	113.7	Q286	Q286-S288 PolarHBondContact O-N 2.94Å
289	S	93.1	Very high	95.7	Very high	37 Å²	37	62.5 Å²	62.5	26%	0.259	34%	0.337	S	S	.	.	S	Bend	trans	-75.1	151.4	179.9	-64.2	0	0	0	0	112.1
290	S	94.2	Very high	95.7	Very high	63 Å²	63	64.2 Å²	64.2	44%	0.441	34%	0.342	S	S	.	.			trans	-64.9	159.5	176.6	72.9	0	0	0	0	112.1	E292 V293 L294	S290-E292 VanDerWaalsContact C-N 3.26Å; S290-E292 PolarHBondContact O-N 2.79Å; S290-V293 PolarHBondContact O-N 2.88Å; S290-V293 WeakPolarHBondContact OG-CG2 3.4Å; S290-V293 PolarHBondContact OG-N 2.87Å; S290-L294 WeakPolarHBondContact O-CG 3.39Å; S290-L294 PolarHBondContact O-N 2.95Å
291	H	91.7	Very high	95.7	Very high	138 Å²	138	63.8 Å²	63.8	64%	0.639	34%	0.34	S	S	*	.	H	α-helix	trans	-57.5	-39.1	178	-172.5	73	0	0	0	112.6	L294 N295	H291-L294 PolarHBondContact O-N 3.3Å; H291-N295 PolarHBondContact CD2-ND2 3.43Å; H291-N295 VanDerWaalsContact CD2-ND2 3.26Å; H291-N295 PolarHBondContact NE2-ND2 2.88Å; H291-N295 WeakPolarHBondContact O-CB 3.34Å; H291-N295 PolarHBondContact O-N 3.05Å
292	E	94.3	Very high	95.7	Very high	160 Å²	160	64 Å²	64	75%	0.748	34%	0.341	S	S	*	.	H	α-helix	trans	-62.5	-45.1	177.1	-66.3	175.3	-179.2	0	0	112	S290 N295 S296	S290-E292 VanDerWaalsContact C-N 3.26Å; S290-E292 PolarHBondContact O-N 2.79Å; E292-N295 PolarHBondContact O-N 3.33Å; E292-S296 PolarHBondContact O-N 2.89Å
293	V	95.6	Very high	95.6	Very high	49 Å²	49	64.4 Å²	64.4	30%	0.297	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.4	172.4	0	0	0	0	110.5	S290 N295 S296 Y297	S290-V293 PolarHBondContact O-N 2.88Å; S290-V293 WeakPolarHBondContact OG-CG2 3.4Å; S290-V293 PolarHBondContact OG-N 2.87Å; V293-N295 VanDerWaalsContact C-N 3.32Å; V293-N295 PolarHBondContact O-N 3.37Å; V293-S296 WeakPolarHBondContact O-CB 3.33Å; V293-S296 PolarHBondContact O-N 2.9Å; V293-S296 VanDerWaalsContact O-N 3.11Å; V293-S296 PolarHBondContact O-OG 2.91Å; V293-Y297 HydrophobicContact CG1-CD1 4.33Å; V293-Y297 HydrophobicContact CG1-CD2 4.36Å; V293-Y297 HydrophobicContact CG1-CE1 3.69Å; V293-Y297 HydrophobicContact CG1-CE2 3.73Å; V293-Y297 WeakPolarHBondContact CG1-OH 3.37Å; V293-Y297 WeakPolarHBondContact O-CD1 3.46Å; V293-Y297 PolarHBondContact O-N 3.47Å
294	L	93.3	Very high	95.7	Very high	22 Å²	22	57.7 Å²	57.7	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-37	177.9	-68.9	173.1	0	0	0	112.4	L278 L287 S290 H291 Y297 Q298	L278-L294 HydrophobicContact CD2-CD2 4.37Å; L287-L294 HydrophobicContact CB-CD1 4.36Å; L287-L294 HydrophobicContact CD1-CD1 3.91Å; L287-L294 HydrophobicContact CD1-CD2 4.16Å; L287-L294 HydrophobicContact CD2-CD2 4.35Å; S290-L294 WeakPolarHBondContact O-CG 3.39Å; S290-L294 PolarHBondContact O-N 2.95Å; H291-L294 PolarHBondContact O-N 3.3Å; L294-Y297 PolarHBondContact O-N 2.84Å; L294-Q298 VanDerWaalsContact O-CG 3.3Å; L294-Q298 WeakPolarHBondContact O-CG 3.33Å; L294-Q298 PolarHBondContact O-N 3.28Å; L294-Q298 VanDerWaalsContact O-N 3.09Å; L294-Q298 PolarHBondContact O-NE2 3.36Å
295	N	92.4	Very high	95.7	Very high	53 Å²	53	56.6 Å²	56.6	28%	0.283	30%	0.303	S	S	.	.	H	α-helix	trans	-64.2	-43.9	172.3	-80.2	-19.7	0	0	0	111.1	H291 E292 V293 Y297 Q298 L299	H291-N295 PolarHBondContact CD2-ND2 3.43Å; H291-N295 VanDerWaalsContact CD2-ND2 3.26Å; H291-N295 PolarHBondContact NE2-ND2 2.88Å; H291-N295 WeakPolarHBondContact O-CB 3.34Å; H291-N295 PolarHBondContact O-N 3.05Å; E292-N295 PolarHBondContact O-N 3.33Å; V293-N295 VanDerWaalsContact C-N 3.32Å; V293-N295 PolarHBondContact O-N 3.37Å; N295-Y297 VanDerWaalsContact C-N 3.26Å; N295-Y297 PolarHBondContact O-N 2.9Å; N295-Q298 PolarHBondContact O-N 3.26Å; N295-L299 WeakPolarHBondContact O-CG 3.47Å; N295-L299 PolarHBondContact O-N 3.42Å
296	S	95.7	Very high	95.6	Very high	54 Å²	54	55.8 Å²	55.8	38%	0.378	30%	0.298	S	S	.	.	H	α-helix	trans	-59.4	-37.6	176.3	84.8	0	0	0	0	112.4	E292 V293 L299	E292-S296 PolarHBondContact O-N 2.89Å; V293-S296 WeakPolarHBondContact O-CB 3.33Å; V293-S296 PolarHBondContact O-N 2.9Å; V293-S296 VanDerWaalsContact O-N 3.11Å; V293-S296 PolarHBondContact O-OG 2.91Å; S296-L299 PolarHBondContact O-N 3.27Å
297	Y	97.4	Very high	95.6	Very high	34 Å²	34	50.2 Å²	50.2	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-45.9	177.1	-67.5	-4.7	0	0	0	111.3	P155 V276 V293 L294 N295 L299 R300	P155-Y297 HydrophobicContact CB-CE2 3.74Å; P155-Y297 PolarHBondContact O-OH 2.98Å; V276-Y297 WeakPolarHBondContact CG1-O 3.47Å; V293-Y297 HydrophobicContact CG1-CD1 4.33Å; V293-Y297 HydrophobicContact CG1-CD2 4.36Å; V293-Y297 HydrophobicContact CG1-CE1 3.69Å; V293-Y297 HydrophobicContact CG1-CE2 3.73Å; V293-Y297 WeakPolarHBondContact CG1-OH 3.37Å; V293-Y297 WeakPolarHBondContact O-CD1 3.46Å; V293-Y297 PolarHBondContact O-N 3.47Å; L294-Y297 PolarHBondContact O-N 2.84Å; N295-Y297 VanDerWaalsContact C-N 3.26Å; N295-Y297 PolarHBondContact O-N 2.9Å; Y297-L299 PolarHBondContact O-N 3.37Å; Y297-L299 VanDerWaalsContact O-N 3.13Å; Y297-R300 VanDerWaalsContact CE1-NH2 3.28Å; Y297-R300 WeakPolarHBondContact O-CB 3.36Å; Y297-R300 WeakPolarHBondContact O-CG 2.97Å; Y297-R300 PolarHBondContact O-N 3.21Å
298	Q	92.7	Very high	95.8	Very high	43 Å²	43	46.5 Å²	46.5	20%	0.201	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-19.2	-179.4	-73.2	176.6	71.8	0	0	114.2	T147 L278 L294 N295 Q302	T147-Q298 HydrophobicContact CG2-CG 3.87Å; L278-Q298 HydrophobicContact CD2-CG 4.45Å; L294-Q298 VanDerWaalsContact O-CG 3.3Å; L294-Q298 WeakPolarHBondContact O-CG 3.33Å; L294-Q298 PolarHBondContact O-N 3.28Å; L294-Q298 VanDerWaalsContact O-N 3.09Å; L294-Q298 PolarHBondContact O-NE2 3.36Å; N295-Q298 PolarHBondContact O-N 3.26Å; Q298-Q302 PolarHBondContact O-NE2 3.12Å
299	L	96.2	Very high	96.1	Very high	79 Å²	79	40.8 Å²	40.8	41%	0.414	22%	0.215	S	C	.	.	H	α-helix	trans	-80.4	-23.7	173.7	-66	175	0	0	0	113	N295 S296 Y297 Q302 I303	N295-L299 WeakPolarHBondContact O-CG 3.47Å; N295-L299 PolarHBondContact O-N 3.42Å; S296-L299 PolarHBondContact O-N 3.27Å; Y297-L299 PolarHBondContact O-N 3.37Å; Y297-L299 VanDerWaalsContact O-N 3.13Å; L299-Q302 WeakPolarHBondContact O-CA 3.44Å; L299-Q302 WeakPolarHBondContact O-CB 3.39Å; L299-Q302 PolarHBondContact O-N 3.18Å; L299-I303 HydrophobicContact CB-CD1 4.16Å; L299-I303 WeakPolarHBondContact O-CG1 3.33Å; L299-I303 PolarHBondContact O-N 3.12Å
300	R	98.4	Very high	96.3	Very high	52 Å²	52	42 Å²	42	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-58.1	-45.6	-173.4	-58.9	177.3	-180	-163.1	-1.4	113.6	G156 V158 F206 Y297 Q302 I303 L304	G156-R300 WeakPolarHBondContact O-CD 3.34Å; G156-R300 PolarHBondContact O-NH1 3.04Å; V158-R300 HydrophobicContact CG2-CB 3.58Å; F206-R300 HydrophobicContact CB-CG 4.37Å; F206-R300 HydrophobicContact CD1-CB 3.93Å; F206-R300 HydrophobicContact CD1-CG 3.69Å; F206-R300 HydrophobicContact CD2-CB 4.2Å; F206-R300 HydrophobicContact CE1-CB 3.9Å; F206-R300 HydrophobicContact CE1-CG 4.08Å; F206-R300 HydrophobicContact CE2-CB 4.18Å; F206-R300 HydrophobicContact CG-CB 4.09Å; F206-R300 HydrophobicContact CG-CG 3.95Å; F206-R300 HydrophobicContact CZ-CB 4.03Å; F206-R300 WeakPolarHBondContact CZ-O 3.37Å; Y297-R300 VanDerWaalsContact CE1-NH2 3.28Å; Y297-R300 WeakPolarHBondContact O-CB 3.36Å; Y297-R300 WeakPolarHBondContact O-CG 2.97Å; Y297-R300 PolarHBondContact O-N 3.21Å; R300-Q302 VanDerWaalsContact C-N 3.29Å; R300-Q302 PolarHBondContact O-N 2.96Å; R300-I303 PolarHBondContact O-N 2.73Å; R300-L304 PolarHBondContact O-N 3.34Å
301	P	98.6	Very high	96.4	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-35.7	175.5	-24.1	36.6	0	0	0	112.9	I145 V274 V276 V305	I145-P301 HydrophobicContact CB-CB 4.01Å; I145-P301 HydrophobicContact CG2-CB 3.98Å; V274-P301 HydrophobicContact CG1-CB 4.06Å; V276-P301 HydrophobicContact CB-CG 3.85Å; V276-P301 HydrophobicContact CG1-CG 4.08Å; P301-V305 WeakPolarHBondContact O-CB 3.35Å; P301-V305 VanDerWaalsContact O-CG2 3.31Å; P301-V305 WeakPolarHBondContact O-CG2 3.45Å; P301-V305 PolarHBondContact O-N 3.33Å
302	Q	97.8	Very high	96.6	Very high	5 Å²	5	39.4 Å²	39.4	2%	0.023	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-46.4	178.1	-64.4	178.7	62.8	0	0	111	F74 F77 I145 Q298 L299 R300 L304 V305 G306	F74-Q302 VanDerWaalsContact CA-OE1 3.22Å; F74-Q302 HydrophobicContact CB-CG 4.3Å; F74-Q302 HydrophobicContact CD2-CB 3.84Å; F74-Q302 HydrophobicContact CD2-CG 3.84Å; F74-Q302 HydrophobicContact CE2-CB 4.46Å; F74-Q302 HydrophobicContact CG-CG 4.5Å; F77-Q302 VanDerWaalsContact CE1-O 3.32Å; F77-Q302 WeakPolarHBondContact CE1-O 3.25Å; I145-Q302 HydrophobicContact CD1-CG 3.83Å; Q298-Q302 PolarHBondContact O-NE2 3.12Å; L299-Q302 WeakPolarHBondContact O-CA 3.44Å; L299-Q302 WeakPolarHBondContact O-CB 3.39Å; L299-Q302 PolarHBondContact O-N 3.18Å; R300-Q302 VanDerWaalsContact C-N 3.29Å; R300-Q302 PolarHBondContact O-N 2.96Å; Q302-L304 PolarHBondContact O-N 3.11Å; Q302-V305 PolarHBondContact O-N 3.18Å; Q302-G306 PolarHBondContact O-N 3.01Å
303	I	98.3	Very high	96.5	Very high	41 Å²	41	33.8 Å²	33.8	21%	0.21	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-48.1	176.6	-66.6	165.3	0	0	0	110.6	F77 L203 F206 L299 R300 S307	F77-I303 HydrophobicContact CE2-CG1 4.44Å; F77-I303 HydrophobicContact CZ-CB 4.49Å; F77-I303 HydrophobicContact CZ-CG1 4.19Å; L203-I303 HydrophobicContact CD1-CG2 4.12Å; F206-I303 HydrophobicContact CE1-CB 4.26Å; F206-I303 HydrophobicContact CE1-CG2 4.07Å; F206-I303 HydrophobicContact CZ-CB 4.46Å; F206-I303 HydrophobicContact CZ-CG2 4.37Å; L299-I303 HydrophobicContact CB-CD1 4.16Å; L299-I303 WeakPolarHBondContact O-CG1 3.33Å; L299-I303 PolarHBondContact O-N 3.12Å; R300-I303 PolarHBondContact O-N 2.73Å; I303-S307 WeakPolarHBondContact O-CB 3.4Å; I303-S307 PolarHBondContact O-N 3.04Å
304	L	98.7	Very high	96.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-53.3	179.5	176.7	52.6	0	0	0	111.6	V158 V160 L196 C199 L203 F206 T208 V274 R300 Q302 G306 S307 Y308	V158-L304 HydrophobicContact CG1-CD2 4.11Å; V160-L304 HydrophobicContact CG2-CD2 4.32Å; L196-L304 HydrophobicContact CD2-CG 4.44Å; L196-L304 WeakPolarHBondContact O-CD1 3.44Å; C199-L304 HydrophobicContact CB-CD1 4.05Å; L203-L304 HydrophobicContact CD1-CD1 4.21Å; F206-L304 HydrophobicContact CE2-CB 4.28Å; F206-L304 HydrophobicContact CZ-CB 4.06Å; T208-L304 HydrophobicContact CG2-CD2 4.35Å; V274-L304 HydrophobicContact CG1-CD2 3.9Å; R300-L304 PolarHBondContact O-N 3.34Å; Q302-L304 PolarHBondContact O-N 3.11Å; L304-G306 PolarHBondContact O-N 3.12Å; L304-S307 PolarHBondContact O-N 2.8Å; L304-Y308 PolarHBondContact O-N 3.38Å
305	V	98.6	Very high	96.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.4	-38.3	-176.3	172.5	0	0	0	0	111.4	C63 F74 I143 I145 V274 P301 Q302 Y308 I309	C63-V305 VanDerWaalsContact SG-CG1 3.55Å; F74-V305 HydrophobicContact CZ-CG1 4.37Å; I143-V305 HydrophobicContact CB-CG1 4.38Å; I143-V305 HydrophobicContact CD1-CG1 3.92Å; I143-V305 HydrophobicContact CD1-CG2 4.43Å; I143-V305 HydrophobicContact CG2-CG1 4.39Å; I143-V305 HydrophobicContact CG2-CG2 3.71Å; I145-V305 HydrophobicContact CG2-CB 4.18Å; I145-V305 HydrophobicContact CG2-CG2 3.6Å; V274-V305 HydrophobicContact CB-CG2 4.37Å; V274-V305 HydrophobicContact CG2-CG2 4.18Å; P301-V305 WeakPolarHBondContact O-CB 3.35Å; P301-V305 VanDerWaalsContact O-CG2 3.31Å; P301-V305 WeakPolarHBondContact O-CG2 3.45Å; P301-V305 PolarHBondContact O-N 3.33Å; Q302-V305 PolarHBondContact O-N 3.18Å; V305-Y308 PolarHBondContact O-N 3.5Å; V305-I309 HydrophobicContact CG1-CD1 3.85Å; V305-I309 HydrophobicContact CG1-CG1 4.39Å; V305-I309 VanDerWaalsContact O-CG1 3.28Å; V305-I309 WeakPolarHBondContact O-CG1 3.21Å; V305-I309 PolarHBondContact O-N 3.27Å
306	G	97.8	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-40.9	175.9	0	0	0	0	0	113	I78 Q302 L304 I309 K310	I78-G306 VanDerWaalsContact CD1-CA 3.47Å; Q302-G306 PolarHBondContact O-N 3.01Å; L304-G306 PolarHBondContact O-N 3.12Å; G306-I309 PolarHBondContact O-N 3.25Å; G306-K310 WeakPolarHBondContact O-CB 3.45Å; G306-K310 PolarHBondContact O-N 3.39Å
307	S	97.6	Very high	95.3	Very high	20 Å²	20	40 Å²	40	14%	0.14	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-44.2	172.8	-176.5	0	0	0	0	111.8	C199 I303 L304 K310 Q311	C199-S307 PolarHBondContact SG-OG 3.13Å; I303-S307 WeakPolarHBondContact O-CB 3.4Å; I303-S307 PolarHBondContact O-N 3.04Å; L304-S307 PolarHBondContact O-N 2.8Å; S307-K310 PolarHBondContact O-N 2.81Å; S307-Q311 VanDerWaalsContact O-CG 3.32Å; S307-Q311 WeakPolarHBondContact O-CG 3.45Å; S307-Q311 PolarHBondContact O-N 3.18Å; S307-Q311 PolarHBondContact OG-NE2 2.93Å
308	Y	98.4	Very high	94.5	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-49.1	176	168.5	-97.3	0	0	0	111.6	F61 I143 L192 E195 L196 C199 R270 L304 V305 K310 Q311 Q312	F61-Y308 HydrophobicContact CE1-CE1 4.05Å; I143-Y308 HydrophobicContact CD1-CD1 4.01Å; I143-Y308 HydrophobicContact CD1-CE1 4.06Å; L192-Y308 HydrophobicContact CD1-CE1 3.89Å; L192-Y308 HydrophobicContact CD1-CE2 3.96Å; L192-Y308 VanDerWaalsContact CD1-CZ 3.41Å; L192-Y308 WeakPolarHBondContact CD1-OH 3.48Å; E195-Y308 HydrophobicContact CB-CD2 4.42Å; E195-Y308 HydrophobicContact CB-CE2 3.86Å; E195-Y308 WeakPolarHBondContact OE2-CE2 3.42Å; E195-Y308 PolarHBondContact OE2-OH 3.41Å; L196-Y308 HydrophobicContact CD2-CD1 4.11Å; L196-Y308 HydrophobicContact CD2-CD2 4.13Å; L196-Y308 HydrophobicContact CD2-CG 3.74Å; C199-Y308 PolarHBondContact SG-N 2.94Å; C199-Y308 VanDerWaalsContact SG-N 3.41Å; R270-Y308 PolarHBondContact NH1-OH 3.07Å; L304-Y308 PolarHBondContact O-N 3.38Å; V305-Y308 PolarHBondContact O-N 3.5Å; Y308-K310 VanDerWaalsContact C-N 3.33Å; Y308-K310 PolarHBondContact O-N 3.4Å; Y308-Q311 PolarHBondContact O-N 3.03Å; Y308-Q312 HydrophobicContact CD1-CG 4.39Å; Y308-Q312 HydrophobicContact CD2-CG 4.22Å; Y308-Q312 HydrophobicContact CE1-CG 3.93Å; Y308-Q312 HydrophobicContact CE2-CG 3.73Å; Y308-Q312 VanDerWaalsContact CE2-NE2 3.32Å; Y308-Q312 WeakPolarHBondContact O-CG 3.48Å; Y308-Q312 PolarHBondContact O-N 3.23Å
309	I	98.2	Very high	93.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-46.5	177.7	-70.1	168.1	0	0	0	110.8	F61 F74 I78 L82 V109 V305 G306 Q311 Q312 L313	F61-I309 HydrophobicContact CB-CD1 4.06Å; F61-I309 HydrophobicContact CB-CG1 4.23Å; F61-I309 HydrophobicContact CD1-CG1 3.88Å; F61-I309 HydrophobicContact CD2-CG1 4.35Å; F61-I309 HydrophobicContact CD2-CG2 3.88Å; F61-I309 HydrophobicContact CE1-CG1 4.35Å; F61-I309 HydrophobicContact CE2-CG2 4.15Å; F61-I309 HydrophobicContact CG-CD1 4.27Å; F61-I309 HydrophobicContact CG-CG1 3.88Å; F61-I309 HydrophobicContact CG-CG2 4.24Å; F74-I309 HydrophobicContact CZ-CD1 4.25Å; I78-I309 HydrophobicContact CD1-CB 4.41Å; I78-I309 HydrophobicContact CD1-CG2 4.39Å; L82-I309 HydrophobicContact CD1-CG2 4.18Å; L82-I309 HydrophobicContact CD2-CG2 4.48Å; V109-I309 HydrophobicContact CG1-CD1 4.3Å; V109-I309 HydrophobicContact CG2-CG2 3.87Å; V305-I309 HydrophobicContact CG1-CD1 3.85Å; V305-I309 HydrophobicContact CG1-CG1 4.39Å; V305-I309 VanDerWaalsContact O-CG1 3.28Å; V305-I309 WeakPolarHBondContact O-CG1 3.21Å; V305-I309 PolarHBondContact O-N 3.27Å; G306-I309 PolarHBondContact O-N 3.25Å; I309-Q311 VanDerWaalsContact C-N 3.33Å; I309-Q311 PolarHBondContact O-N 3.37Å; I309-Q312 PolarHBondContact O-N 3.03Å; I309-L313 HydrophobicContact CG2-CD1 3.88Å; I309-L313 HydrophobicContact CG2-CG 4.34Å; I309-L313 WeakPolarHBondContact O-CG 3.31Å; I309-L313 PolarHBondContact O-N 3.44Å
310	K	96.3	Very high	91.5	Very high	64 Å²	64	59.7 Å²	59.7	28%	0.278	29%	0.288	S	S	.	.	H	α-helix	trans	-58.4	-43.5	178	-173.5	178.7	-166	166	0	112.1	E81 L82 G306 S307 Y308 K314	E81-K310 WeakPolarHBondContact O-CE 3.13Å; E81-K310 PolarHBondContact O-NZ 3.29Å; E81-K310 IonicContact OE2-NZ 3.17Å; E81-K310 PolarHBondContact OE2-NZ 3.4Å; L82-K310 HydrophobicContact CD2-CB 3.82Å; L82-K310 HydrophobicContact CD2-CG 4.07Å; G306-K310 WeakPolarHBondContact O-CB 3.45Å; G306-K310 PolarHBondContact O-N 3.39Å; S307-K310 PolarHBondContact O-N 2.81Å; Y308-K310 VanDerWaalsContact C-N 3.33Å; Y308-K310 PolarHBondContact O-N 3.4Å; K310-K314 WeakPolarHBondContact O-CG 3.32Å; K310-K314 PolarHBondContact O-N 3.19Å; K310-K314 VanDerWaalsContact O-N 3.08Å
311	Q	95.8	Very high	91.2	Very high	90 Å²	90	60.1 Å²	60.1	42%	0.421	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-44.5	176.7	-70.7	173.8	27.3	0	0	111.7	C199 S307 Y308 I309 L313 K314 A315	C199-Q311 PolarHBondContact SG-NE2 2.94Å; S307-Q311 VanDerWaalsContact O-CG 3.32Å; S307-Q311 WeakPolarHBondContact O-CG 3.45Å; S307-Q311 PolarHBondContact O-N 3.18Å; S307-Q311 PolarHBondContact OG-NE2 2.93Å; Y308-Q311 PolarHBondContact O-N 3.03Å; I309-Q311 VanDerWaalsContact C-N 3.33Å; I309-Q311 PolarHBondContact O-N 3.37Å; Q311-L313 PolarHBondContact O-N 3.34Å; Q311-K314 PolarHBondContact O-N 3Å; Q311-A315 WeakPolarHBondContact O-CB 3.37Å; Q311-A315 PolarHBondContact O-N 3.33Å
312	Q	96.1	Very high	90.8	Very high	55 Å²	55	63.1 Å²	63.1	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-40	179.1	-67.6	-62.1	-30.7	0	0	112.8	F61 Y308 I309 K316	F61-Q312 HydrophobicContact CE1-CB 4.38Å; F61-Q312 HydrophobicContact CE1-CG 4.5Å; F61-Q312 HydrophobicContact CZ-CB 3.66Å; F61-Q312 HydrophobicContact CZ-CG 4.24Å; Y308-Q312 HydrophobicContact CD1-CG 4.39Å; Y308-Q312 HydrophobicContact CD2-CG 4.22Å; Y308-Q312 HydrophobicContact CE1-CG 3.93Å; Y308-Q312 HydrophobicContact CE2-CG 3.73Å; Y308-Q312 VanDerWaalsContact CE2-NE2 3.32Å; Y308-Q312 WeakPolarHBondContact O-CG 3.48Å; Y308-Q312 PolarHBondContact O-N 3.23Å; I309-Q312 PolarHBondContact O-N 3.03Å; Q312-K316 WeakPolarHBondContact O-CG 3.43Å; Q312-K316 PolarHBondContact O-N 2.87Å
313	L	93.7	Very high	90.4	Very high	42 Å²	42	66.3 Å²	66.3	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-40	177.1	-69.9	176.1	0	0	0	111.9	F61 L82 P108 I309 Q311 K316 A317	F61-L313 HydrophobicContact CE2-CD2 3.91Å; F61-L313 HydrophobicContact CE2-CG 4.09Å; L82-L313 HydrophobicContact CD1-CD1 3.76Å; L82-L313 HydrophobicContact CD2-CD1 3.89Å; L82-L313 HydrophobicContact CG-CD1 4.47Å; P108-L313 HydrophobicContact CG-CD1 4.09Å; P108-L313 HydrophobicContact CG-CD2 3.9Å; I309-L313 HydrophobicContact CG2-CD1 3.88Å; I309-L313 HydrophobicContact CG2-CG 4.34Å; I309-L313 WeakPolarHBondContact O-CG 3.31Å; I309-L313 PolarHBondContact O-N 3.44Å; Q311-L313 PolarHBondContact O-N 3.34Å; L313-K316 PolarHBondContact O-N 3.11Å; L313-A317 PolarHBondContact O-N 3.44Å
314	K	92.2	Very high	89.9	Confident	120 Å²	120	67.8 Å²	67.8	52%	0.522	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-48.7	173.6	-75.1	-178.5	176.9	-169.4	0	112.1	K310 Q311 K316 A317 E318	K310-K314 WeakPolarHBondContact O-CG 3.32Å; K310-K314 PolarHBondContact O-N 3.19Å; K310-K314 VanDerWaalsContact O-N 3.08Å; Q311-K314 PolarHBondContact O-N 3Å; K314-K316 VanDerWaalsContact C-N 3.26Å; K314-K316 PolarHBondContact O-N 2.85Å; K314-A317 WeakPolarHBondContact O-CB 3.11Å; K314-A317 PolarHBondContact O-N 2.95Å; K314-E318 WeakPolarHBondContact O-CG 3.22Å; K314-E318 PolarHBondContact O-N 2.93Å
315	A	89.6	Confident	89.4	Confident	37 Å²	37	72 Å²	72	31%	0.306	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-37.1	178	0	0	0	0	0	112.1	Q311 N319	Q311-A315 WeakPolarHBondContact O-CB 3.37Å; Q311-A315 PolarHBondContact O-N 3.33Å; A315-N319 WeakPolarHBondContact O-CB 3.05Å; A315-N319 PolarHBondContact O-N 3.05Å; A315-N319 PolarHBondContact O-ND2 3.31Å
316	K	84.9	Confident	88.8	Confident	88 Å²	88	76.8 Å²	76.8	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-69.3	-32.7	173.9	-77.4	-175.3	179.4	-176.5	0	113.2	Q312 L313 K314 R320	Q312-K316 WeakPolarHBondContact O-CG 3.43Å; Q312-K316 PolarHBondContact O-N 2.87Å; L313-K316 PolarHBondContact O-N 3.11Å; K314-K316 VanDerWaalsContact C-N 3.26Å; K314-K316 PolarHBondContact O-N 2.85Å; K316-R320 WeakPolarHBondContact O-CG 3.23Å
317	A	83.7	Confident	88.1	Confident	65 Å²	65	82.3 Å²	82.3	54%	0.537	40%	0.399	S	S	.	.	H	α-helix	trans	-72.6	-35.3	176.5	0	0	0	0	0	112.3	L313 K314	L313-A317 PolarHBondContact O-N 3.44Å; K314-A317 WeakPolarHBondContact O-CB 3.11Å; K314-A317 PolarHBondContact O-N 2.95Å
318	E	81.8	Confident	87.4	Confident	154 Å²	154	87.1 Å²	87.1	72%	0.72	42%	0.419	S	S	*	.	H	α-helix	trans	-74.5	-24.3	178.1	-70.3	169.5	-173.7	0	0	113.5	K314	K314-E318 WeakPolarHBondContact O-CG 3.22Å; K314-E318 PolarHBondContact O-N 2.93Å
319	N	70.4	Confident	86.5	Confident	145 Å²	145	94.2 Å²	94.2	78%	0.775	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	6.5	177.6	-71.5	-51.5	0	0	0	113.7	A315	A315-N319 WeakPolarHBondContact O-CB 3.05Å; A315-N319 PolarHBondContact O-N 3.05Å; A315-N319 PolarHBondContact O-ND2 3.31Å
320	R	55.4	Low	85.4	Confident	270 Å²	270	102.7 Å²	102.7	100%	1.019	49%	0.494	S	S	*	.			trans	-104.3	0	174.1	-80.4	177.6	177.2	-170	-0.4	110.4	K316	K316-R320 WeakPolarHBondContact O-CG 3.23Å

Retrieved 320 of 320 residues in 463.5 ms (Link to these results)

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