A0A3Q0KT74_SCHMA Loading...

Katanin p80 WD40 repeat-containing subunit B1 AlphaSync

Participates in a complex which severs microtubules in an ATP-dependent manner. May act to target the enzymatic subunit of this complex to sites of action such as the centrosome. Microtubule severing may promote rapid reorganization of cellular microtubule arrays and the release of microtubules from the centrosome following nucleation.

AlphaFold DB , UniProt , Accession A0A3Q0KT74, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene KATNB1, Length 764 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	69.3	Low	87.3	Confident	58 Å²	58	67.1 Å²	67.1	29%	0.286	32%	0.324	S	S	.	.				0	179.5	0	-70.2	-177.7	-175.3	0	0	111.4	I252 E262 V264 V301 D302 V303 C306	M1-I252 HydrophobicContact CE-CD1 3.21Å; M1-I252 HydrophobicContact SD-CD1 3.64Å; M1-E262 PolarHBondContact N-OE1 2.92Å; M1-V264 HydrophobicContact CB-CG1 4.25Å; M1-V264 HydrophobicContact CB-CG2 3.92Å; M1-V264 HydrophobicContact CG-CG2 4.25Å; M1-V264 HydrophobicContact SD-CG2 4.18Å; M1-V301 HydrophobicContact CB-CG1 4.16Å; M1-V301 HydrophobicContact SD-CG1 4.16Å; M1-D302 VanDerWaalsContact CB-O 3.3Å; M1-D302 WeakPolarHBondContact CB-O 3.47Å; M1-D302 VanDerWaalsContact CG-O 3.26Å; M1-D302 WeakPolarHBondContact CG-O 3.31Å; M1-V303 HydrophobicContact CE-CB 4.47Å; M1-V303 HydrophobicContact CE-CG1 3.82Å; M1-V303 HydrophobicContact SD-CB 4.36Å; M1-V303 HydrophobicContact SD-CG1 4.14Å; M1-C306 WeakPolarHBondContact CE-SG 3.42Å
2	K	81.5	Confident	87.5	Confident	151 Å²	151	61.5 Å²	61.5	66%	0.657	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	139	165.4	-74.3	-172.7	178.3	-176.6	0	109.8	W4 V301 D302	K2-W4 HydrophobicContact CB-CE3 4.38Å; K2-W4 HydrophobicContact CB-CZ3 4.19Å; K2-V301 CarbonylContact O-C 3.56Å; K2-V301 WeakPolarHBondContact O-CA 3.43Å; K2-D302 HydrophobicContact CB-CB 4.44Å; K2-D302 PolarHBondContact O-N 3.13Å
3	A	86.1	Confident	87.4	Confident	36 Å²	36	63.5 Å²	63.5	30%	0.298	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.2	175.4	0	0	0	0	0	110.1	V264 V266 V300 V301	A3-V264 HydrophobicContact CB-CG1 4.22Å; A3-V266 HydrophobicContact CB-CB 4.36Å; A3-V266 HydrophobicContact CB-CG1 4.17Å; A3-V266 HydrophobicContact CB-CG2 4.14Å; A3-V300 WeakPolarHBondContact CA-O 3.41Å; A3-V301 HydrophobicContact CB-CG1 4.42Å; A3-V301 HydrophobicContact CB-CG2 3.99Å
4	W	90.7	Very high	87	Confident	96 Å²	96	66.9 Å²	66.9	36%	0.364	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.6	175.8	64	96.8	0	0	0	112.5	K2 L6 Y299 V300 D302	K2-W4 HydrophobicContact CB-CE3 4.38Å; K2-W4 HydrophobicContact CB-CZ3 4.19Å; W4-L6 PolarHBondContact O-N 2.93Å; W4-Y299 WeakPolarHBondContact O-CA 3.33Å; W4-V300 HydrophobicContact CD2-CB 4.46Å; W4-V300 HydrophobicContact CH2-CB 4.3Å; W4-V300 HydrophobicContact CH2-CG1 3.74Å; W4-V300 HydrophobicContact CZ2-CB 3.83Å; W4-V300 HydrophobicContact CZ2-CG1 3.62Å; W4-V300 HydrophobicContact CZ3-CG1 4.44Å; W4-V300 PolarHBondContact N-O 3.37Å; W4-V300 PolarHBondContact O-N 3.4Å; W4-D302 HydrophobicContact CZ3-CB 4.26Å
5	K	91.2	Very high	87	Confident	90 Å²	90	64.5 Å²	64.5	39%	0.391	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	118.7	165.4	177.1	162.9	170.7	162.6	0	108.3	E8 T297 Y299	K5-E8 IonicContact NZ-OE1 3.79Å; K5-E8 PolarHBondContact NZ-OE1 3.17Å; K5-E8 IonicContact NZ-OE2 3.87Å; K5-E8 PolarHBondContact NZ-OE2 3.4Å; K5-T297 HydrophobicContact CD-CG2 3.61Å; K5-T297 HydrophobicContact CG-CG2 3.66Å; K5-Y299 HydrophobicContact CB-CD1 4.02Å; K5-Y299 HydrophobicContact CB-CE1 3.71Å; K5-Y299 HydrophobicContact CG-CE1 4.35Å
6	L	88.8	Confident	87.4	Confident	64 Å²	64	61.8 Å²	61.8	34%	0.335	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-46.9	-178.6	177.4	69.7	0	0	0	111.3	W4 V44 T298 V300	W4-L6 PolarHBondContact O-N 2.93Å; L6-V44 HydrophobicContact CD2-CG1 3.67Å; L6-T298 PolarHBondContact N-O 3.34Å; L6-V300 HydrophobicContact CB-CG2 4.02Å; L6-V300 HydrophobicContact CD2-CG2 3.79Å; L6-V300 HydrophobicContact CG-CG2 4.33Å
7	Q	89.3	Confident	87.9	Confident	23 Å²	23	58.6 Å²	58.6	11%	0.107	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	151.9	-173.4	167.7	-174.9	-36.8	0	0	110.5	C9 K46 T297 T298	Q7-C9 PolarHBondContact NE2-SG 3.13Å; Q7-K46 VanDerWaalsContact CD-C 3.49Å; Q7-K46 VanDerWaalsContact NE2-C 3.31Å; Q7-K46 PolarHBondContact NE2-O 3.16Å; Q7-K46 PolarHBondContact OE1-O 3.47Å; Q7-T297 CarbonylContact O-C 3.6Å; Q7-T297 WeakPolarHBondContact O-CA 3.47Å; Q7-T298 PolarHBondContact N-O 3.39Å; Q7-T298 PolarHBondContact N-OG1 3.43Å; Q7-T298 PolarHBondContact O-N 2.85Å; Q7-T298 PolarHBondContact O-OG1 3.35Å
8	E	90.1	Very high	88.4	Confident	95 Å²	95	57.6 Å²	57.6	44%	0.444	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.3	165.4	174.3	168.9	-109.9	0	0	109	K5 L295 I296 T297	K5-E8 IonicContact NZ-OE1 3.79Å; K5-E8 PolarHBondContact NZ-OE1 3.17Å; K5-E8 IonicContact NZ-OE2 3.87Å; K5-E8 PolarHBondContact NZ-OE2 3.4Å; E8-L295 HydrophobicContact CG-CD2 4.3Å; E8-I296 VanDerWaalsContact CA-O 3.32Å; E8-I296 WeakPolarHBondContact CA-O 3.29Å; E8-T297 PolarHBondContact OE1-OG1 2.97Å; E8-T297 VanDerWaalsContact OE1-OG1 3.09Å
9	C	91	Very high	88.8	Confident	15 Å²	15	55 Å²	55	10%	0.101	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.1	178	54.5	0	0	0	0	111.4	Q7 A11 I296	Q7-C9 PolarHBondContact NE2-SG 3.13Å; C9-A11 PolarHBondContact O-N 2.66Å; C9-I296 PolarHBondContact N-O 3.27Å; C9-I296 PolarHBondContact O-N 2.97Å
10	I	90.8	Very high	89.1	Confident	106 Å²	106	52.7 Å²	52.7	54%	0.544	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117.9	168.2	-60	168.9	0	0	0	107.3	H12 L295	I10-H12 WeakPolarHBondContact CG2-O 3.39Å; I10-L295 HydrophobicContact CB-CD2 4.43Å; I10-L295 HydrophobicContact CG1-CD2 3.54Å
11	A	91	Very high	89.5	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.033	28%	0.277	C	S	.	.			trans	-95.2	-44	-176.8	0	0	0	0	0	112.4	C9 V17 K40 W42 S294 I296	C9-A11 PolarHBondContact O-N 2.66Å; A11-V17 HydrophobicContact CB-CG2 3.97Å; A11-K40 WeakPolarHBondContact O-CD 3.36Å; A11-K40 PolarHBondContact O-NZ 2.88Å; A11-W42 HydrophobicContact CB-CH2 4.11Å; A11-W42 HydrophobicContact CB-CZ2 3.59Å; A11-S294 PolarHBondContact N-O 3.48Å; A11-I296 HydrophobicContact CB-CB 4.47Å; A11-I296 HydrophobicContact CB-CD1 3.36Å; A11-I296 HydrophobicContact CB-CG1 3.71Å
12	H	90.6	Very high	90.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-122.3	141.1	179	-64.3	-102	0	0	0	110	I10 G15 V17 T32 D36 R38 S294	I10-H12 WeakPolarHBondContact CG2-O 3.39Å; H12-G15 CarbonylContact C-O 3.54Å; H12-V17 HydrophobicContact CB-CG2 4.33Å; H12-T32 PolarHBondContact CE1-O 3Å; H12-T32 PolarHBondContact NE2-O 3.18Å; H12-T32 PolarHBondContact NE2-OG1 3.3Å; H12-D36 IonicContact CE1-OD1 2.81Å; H12-D36 IonicContact CG-OD1 3.01Å; H12-D36 IonicContact CG-OD2 2.71Å; H12-D36 IonicContact ND1-OD1 3.39Å; H12-D36 PolarHBondContact ND1-OD1 3.24Å; H12-D36 IonicContact ND1-OD2 3.8Å; H12-D36 PolarHBondContact ND1-OD2 3.38Å; H12-R38 PolarHBondContact CE1-O 3.25Å; H12-R38 VanDerWaalsContact CE1-O 3.23Å; H12-S294 WeakPolarHBondContact O-CB 3.46Å
13	S	85.5	Confident	91.3	Very high	88 Å²	88	40.3 Å²	40.3	62%	0.615	23%	0.233	S	C	*	.	S	Bend	trans	-170.3	123.8	-176.7	177.5	0	0	0	0	108.9
14	P	82.3	Confident	91.5	Very high	111 Å²	111	41.8 Å²	41.8	72%	0.721	23%	0.231	S	C	*	.	S	Bend	cis	-63.2	165.7	-9.9	30.8	-36.5	0	0	0	111.9
15	G	87	Confident	91.4	Very high	30 Å²	30	41.4 Å²	41.4	31%	0.309	23%	0.232	S	C	.	.	S	Bend	trans	94.3	158.5	176.4	0	0	0	0	0	115.4	H12 E35	H12-G15 CarbonylContact C-O 3.54Å; G15-E35 VanDerWaalsContact CA-OE2 3.24Å; G15-E35 WeakPolarHBondContact CA-OE2 3.35Å
16	A	94	Very high	91.2	Very high	22 Å²	22	38.5 Å²	38.5	18%	0.182	22%	0.222	C	C	.	.			trans	-78.3	162.7	177	0	0	0	0	0	112.6	G34 E35	A16-G34 WeakPolarHBondContact O-CA 3.31Å; A16-E35 HydrophobicContact CB-CG 4.43Å; A16-E35 PolarHBondContact N-OE2 3.18Å; A16-E35 PolarHBondContact O-N 3.46Å
17	V	95.7	Very high	91.2	Very high	8 Å²	8	35.4 Å²	35.4	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	126.7	163.8	-167.4	0	0	0	0	107.7	A11 H12 G33 I291 N293 I296	A11-V17 HydrophobicContact CB-CG2 3.97Å; H12-V17 HydrophobicContact CB-CG2 4.33Å; V17-G33 WeakPolarHBondContact CA-O 3.41Å; V17-G33 VanDerWaalsContact CG1-O 3.26Å; V17-G33 WeakPolarHBondContact CG1-O 3.45Å; V17-I291 HydrophobicContact CB-CD1 4.49Å; V17-I291 HydrophobicContact CB-CG2 3.87Å; V17-I291 HydrophobicContact CG1-CD1 3.98Å; V17-I291 HydrophobicContact CG1-CG1 4.31Å; V17-I291 HydrophobicContact CG1-CG2 4.47Å; V17-I291 WeakPolarHBondContact O-CG2 3.33Å; V17-N293 WeakPolarHBondContact CG2-O 3.24Å; V17-N293 PolarHBondContact N-O 3.1Å; V17-I296 HydrophobicContact CB-CG1 4.49Å; V17-I296 HydrophobicContact CG1-CD1 3.88Å; V17-I296 HydrophobicContact CG1-CG1 4.28Å; V17-I296 HydrophobicContact CG2-CD1 4.11Å; V17-I296 HydrophobicContact CG2-CG1 3.91Å
18	T	95.8	Very high	91.3	Very high	40 Å²	40	37.4 Å²	37.4	25%	0.245	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	-20.3	-174.6	39.1	0	0	0	0	112.3	G33 G34 E35 S59 I60	T18-G33 PolarHBondContact N-O 3.47Å; T18-G33 PolarHBondContact OG1-O 3.19Å; T18-G34 WeakPolarHBondContact OG1-CA 3.47Å; T18-E35 HydrophobicContact CG2-CG 3.95Å; T18-S59 PolarHBondContact OG1-OG 2.98Å; T18-I60 WeakPolarHBondContact CB-O 3.45Å; T18-I60 PolarHBondContact OG1-O 3.23Å
19	A	95.7	Very high	91.4	Very high	8 Å²	8	33.1 Å²	33.1	7%	0.066	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	144	172.8	0	0	0	0	0	111.9	T32 G33	A19-T32 CarbonylContact O-C 2.99Å; A19-T32 WeakPolarHBondContact O-CA 3.38Å; A19-G33 PolarHBondContact N-O 2.84Å; A19-G33 PolarHBondContact O-N 3.41Å
20	A	96.2	Very high	91.7	Very high	9 Å²	9	32.5 Å²	32.5	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.6	164.4	0	0	0	0	0	111.8	A31 T32 D275 V289 I291	A20-A31 WeakPolarHBondContact CA-O 3.34Å; A20-T32 HydrophobicContact CB-CG2 4.39Å; A20-D275 PolarHBondContact N-OD2 2.81Å; A20-V289 HydrophobicContact CB-CG1 3.77Å; A20-I291 HydrophobicContact CB-CD1 3.86Å; A20-I291 HydrophobicContact CB-CG1 4.29Å
21	T	96.5	Very high	92	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.5	174.9	-177.9	0	0	0	0	111	R24 M30 A31 C63 E64 F65 D276	T21-R24 PolarHBondContact OG1-NH2 2.82Å; T21-M30 CarbonylContact O-C 3.57Å; T21-M30 VanDerWaalsContact O-CA 3.29Å; T21-M30 WeakPolarHBondContact O-CA 3.49Å; T21-M30 WeakPolarHBondContact O-CG 3.3Å; T21-A31 HydrophobicContact CG2-CB 3.74Å; T21-A31 PolarHBondContact N-O 3.5Å; T21-A31 PolarHBondContact O-N 2.69Å; T21-C63 WeakPolarHBondContact CB-O 3.45Å; T21-C63 HydrophobicContact CG2-CB 4.22Å; T21-C63 WeakPolarHBondContact CG2-O 3.34Å; T21-E64 WeakPolarHBondContact CB-OE2 3.4Å; T21-E64 PolarHBondContact OG1-OE2 3.44Å; T21-F65 HydrophobicContact CG2-CD2 3.93Å; T21-F65 HydrophobicContact CG2-CE2 4.08Å; T21-D276 WeakPolarHBondContact CA-OD2 3.42Å
22	L	95.7	Very high	92.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	136.3	173.6	-74.4	168.8	0	0	0	111.2	R24 M30 V44 D276 A278 V287 V289	L22-R24 PolarHBondContact O-N 3.35Å; L22-R24 VanDerWaalsContact O-N 3.14Å; L22-R24 PolarHBondContact O-NH1 2.98Å; L22-M30 HydrophobicContact CD2-CB 4.1Å; L22-M30 HydrophobicContact CD2-CG 4.3Å; L22-V44 HydrophobicContact CD2-CG2 3.87Å; L22-D276 PolarHBondContact N-OD2 2.74Å; L22-A278 HydrophobicContact CB-CB 3.57Å; L22-A278 HydrophobicContact CD1-CB 3.86Å; L22-A278 HydrophobicContact CG-CB 4.37Å; L22-V287 HydrophobicContact CD1-CB 4.01Å; L22-V287 HydrophobicContact CD1-CG1 3.93Å; L22-V287 WeakPolarHBondContact CD1-O 3.44Å; L22-V287 HydrophobicContact CD2-CG1 3.96Å; L22-V289 HydrophobicContact CD1-CG2 3.82Å; L22-V289 HydrophobicContact CD2-CG2 3.63Å; L22-V289 HydrophobicContact CG-CG2 3.6Å
23	G	93.3	Very high	92.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.161	C	C	.	.			trans	-55.7	118.2	170.7	0	0	0	0	0	111.4	K25 G27 V29 E69	G23-K25 VanDerWaalsContact C-N 3.31Å; G23-K25 PolarHBondContact O-N 2.89Å; G23-G27 VanDerWaalsContact O-CA 3.27Å; G23-G27 WeakPolarHBondContact O-CA 3.3Å; G23-G27 PolarHBondContact O-N 3.09Å; G23-V29 PolarHBondContact N-O 3.39Å; G23-E69 WeakPolarHBondContact CA-OE1 3.3Å
24	R	90.1	Very high	93	Very high	68 Å²	68	23.1 Å²	23.1	26%	0.257	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.9	-172.8	-54.3	-68.3	172.7	-128.7	5.6	113.4	T21 L22 E64 E69 D276	T21-R24 PolarHBondContact OG1-NH2 2.82Å; L22-R24 PolarHBondContact O-N 3.35Å; L22-R24 VanDerWaalsContact O-N 3.14Å; L22-R24 PolarHBondContact O-NH1 2.98Å; R24-E64 IonicContact CZ-OE1 2.96Å; R24-E64 IonicContact CZ-OE2 3.18Å; R24-E64 IonicContact NE-OE1 2.77Å; R24-E64 PolarHBondContact NE-OE1 3.42Å; R24-E64 IonicContact NH2-OE1 2.72Å; R24-E64 PolarHBondContact NH2-OE1 3.32Å; R24-E64 IonicContact NH2-OE2 3.82Å; R24-E64 PolarHBondContact NH2-OE2 3.04Å; R24-E64 VanDerWaalsContact NH2-OE2 3.08Å; R24-E69 PolarHBondContact N-OE1 3.11Å; R24-D276 IonicContact CZ-OD1 2.69Å; R24-D276 IonicContact CZ-OD2 3.87Å; R24-D276 IonicContact NH1-OD1 2.74Å; R24-D276 PolarHBondContact NH1-OD1 2.88Å; R24-D276 IonicContact NH1-OD2 3.05Å; R24-D276 PolarHBondContact NH1-OD2 2.77Å; R24-D276 IonicContact NH2-OD1 3.89Å; R24-D276 PolarHBondContact NH2-OD1 3.28Å; R24-D276 IonicContact NH2-OD2 3.33Å; R24-D276 PolarHBondContact NH2-OD2 2.94Å
25	K	88	Confident	93.7	Very high	88 Å²	88	22.7 Å²	22.7	38%	0.383	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-38.1	-171.1	165.8	-178.2	163.8	-166.7	0	111.8	G23 Q67 E68 E69	G23-K25 VanDerWaalsContact C-N 3.31Å; G23-K25 PolarHBondContact O-N 2.89Å; K25-Q67 WeakPolarHBondContact CB-O 3.44Å; K25-Q67 WeakPolarHBondContact CD-O 3.22Å; K25-E68 PolarHBondContact NZ-O 3.34Å; K25-E68 IonicContact NZ-OE1 2.7Å; K25-E68 IonicContact NZ-OE2 3.81Å; K25-E68 PolarHBondContact NZ-OE2 3.47Å; K25-E69 WeakPolarHBondContact CA-OE1 3.46Å; K25-E69 HydrophobicContact CB-CG 4.29Å; K25-E69 WeakPolarHBondContact CB-OE1 3.33Å; K25-E69 PolarHBondContact N-OE1 3.12Å
26	S	88	Confident	94	Very high	28 Å²	28	22.7 Å²	22.7	20%	0.196	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-34.7	176.6	67.5	0	0	0	0	113.3	R28 E69	S26-R28 PolarHBondContact O-N 3.37Å; S26-R28 PolarHBondContact OG-N 3.39Å; S26-R28 VanDerWaalsContact OG-N 3.07Å; S26-E69 WeakPolarHBondContact CB-OE2 3.32Å; S26-E69 PolarHBondContact N-OE1 2.89Å; S26-E69 VanDerWaalsContact OG-CD 3.31Å; S26-E69 PolarHBondContact OG-OE1 2.96Å; S26-E69 PolarHBondContact OG-OE2 2.84Å
27	G	88.7	Confident	94.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	59.7	19.4	-164.2	0	0	0	0	0	113.2	G23 V287	G23-G27 VanDerWaalsContact O-CA 3.27Å; G23-G27 WeakPolarHBondContact O-CA 3.3Å; G23-G27 PolarHBondContact O-N 3.09Å; G27-V287 WeakPolarHBondContact O-CG2 3.35Å
28	R	90.5	Very high	94.1	Very high	64 Å²	64	31.3 Å²	31.3	24%	0.242	14%	0.141	C	C	.	.			trans	-123.1	-7.5	-174.1	-66.9	-61.1	-175.3	-160.6	-5.8	114.3	S26 V44 F283	S26-R28 PolarHBondContact O-N 3.37Å; S26-R28 PolarHBondContact OG-N 3.39Å; S26-R28 VanDerWaalsContact OG-N 3.07Å; R28-V44 PolarHBondContact O-N 3.25Å; R28-F283 HydrophobicContact CG-CE2 4.01Å; R28-F283 VanDerWaalsContact NE-CE2 3.27Å
29	V	94	Very high	94.1	Very high	6 Å²	6	29.4 Å²	29.4	4%	0.036	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.5	171	-60.8	0	0	0	0	110.7	G23 W42 F65 E69 I445	G23-V29 PolarHBondContact N-O 3.39Å; V29-W42 WeakPolarHBondContact CA-O 3.33Å; V29-F65 HydrophobicContact CB-CZ 4.21Å; V29-F65 HydrophobicContact CG2-CE1 4.18Å; V29-F65 HydrophobicContact CG2-CE2 4.06Å; V29-F65 HydrophobicContact CG2-CZ 3.82Å; V29-E69 HydrophobicContact CG2-CG 4.32Å; V29-E69 WeakPolarHBondContact CG2-OE2 3.33Å; V29-I445 HydrophobicContact CG1-CD1 4.3Å; V29-I445 HydrophobicContact CG1-CG2 3.84Å
30	M	95.8	Very high	94.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.4	177.6	-177.5	179.9	66.8	0	0	109.2	T21 L22 T32 L41 W42 V44 V289 I296 T298	T21-M30 CarbonylContact O-C 3.57Å; T21-M30 VanDerWaalsContact O-CA 3.29Å; T21-M30 WeakPolarHBondContact O-CA 3.49Å; T21-M30 WeakPolarHBondContact O-CG 3.3Å; L22-M30 HydrophobicContact CD2-CB 4.1Å; L22-M30 HydrophobicContact CD2-CG 4.3Å; M30-T32 HydrophobicContact CE-CG2 3.83Å; M30-T32 HydrophobicContact CG-CG2 4.08Å; M30-T32 HydrophobicContact SD-CG2 4.23Å; M30-L41 CarbonylContact O-C 3.56Å; M30-L41 WeakPolarHBondContact O-CA 3.46Å; M30-W42 HydrophobicContact CB-CB 4.39Å; M30-W42 HydrophobicContact CE-CB 3.85Å; M30-W42 HydrophobicContact CE-CD2 4.49Å; M30-W42 HydrophobicContact CE-CG 3.74Å; M30-W42 PolarHBondContact N-O 2.94Å; M30-W42 PolarHBondContact O-N 3.12Å; M30-V44 HydrophobicContact CB-CG2 4.48Å; M30-V289 HydrophobicContact CG-CG2 4.3Å; M30-V289 HydrophobicContact SD-CB 4.32Å; M30-V289 HydrophobicContact SD-CG1 3.77Å; M30-V289 HydrophobicContact SD-CG2 3.49Å; M30-V289 WeakPolarHBondContact SD-CG2 3.3Å; M30-I296 HydrophobicContact CE-CD1 4.26Å; M30-I296 HydrophobicContact CE-CG2 3.97Å; M30-I296 HydrophobicContact SD-CG2 4.01Å; M30-T298 HydrophobicContact SD-CG2 4.26Å
31	A	96.8	Very high	94.1	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146	169.1	0	0	0	0	0	109.7	A20 T21 L39 K40 L41 F65 V72	A20-A31 WeakPolarHBondContact CA-O 3.34Å; T21-A31 HydrophobicContact CG2-CB 3.74Å; T21-A31 PolarHBondContact N-O 3.5Å; T21-A31 PolarHBondContact O-N 2.69Å; A31-L39 HydrophobicContact CB-CD1 4.48Å; A31-L39 HydrophobicContact CB-CD2 4.24Å; A31-K40 CarbonylContact C-O 3.51Å; A31-K40 WeakPolarHBondContact CA-O 3.36Å; A31-L41 HydrophobicContact CB-CD2 3.47Å; A31-L41 VanDerWaalsContact CB-CD2 3.47Å; A31-F65 HydrophobicContact CB-CD2 4.45Å; A31-F65 HydrophobicContact CB-CE1 4.28Å; A31-F65 HydrophobicContact CB-CE2 3.66Å; A31-F65 HydrophobicContact CB-CZ 3.56Å; A31-V72 HydrophobicContact CB-CG2 4.08Å
32	T	97.2	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	131.9	-175	68.4	0	0	0	0	109.7	H12 A19 A20 M30 L39 K40 W42 I296	H12-T32 PolarHBondContact CE1-O 3Å; H12-T32 PolarHBondContact NE2-O 3.18Å; H12-T32 PolarHBondContact NE2-OG1 3.3Å; A19-T32 CarbonylContact O-C 2.99Å; A19-T32 WeakPolarHBondContact O-CA 3.38Å; A20-T32 HydrophobicContact CB-CG2 4.39Å; M30-T32 HydrophobicContact CE-CG2 3.83Å; M30-T32 HydrophobicContact CG-CG2 4.08Å; M30-T32 HydrophobicContact SD-CG2 4.23Å; T32-L39 CarbonylContact O-C 3.47Å; T32-L39 VanDerWaalsContact O-CA 3.31Å; T32-L39 WeakPolarHBondContact O-CA 3.39Å; T32-K40 PolarHBondContact N-O 3.07Å; T32-K40 PolarHBondContact O-N 3.24Å; T32-K40 PolarHBondContact OG1-O 3Å; T32-W42 PolarHBondContact OG1-NE1 3.31Å; T32-I296 HydrophobicContact CG2-CD1 3.21Å
33	G	96.7	Very high	93.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	147.6	171.6	0	0	0	0	0	110.3	V17 T18 A19	V17-G33 WeakPolarHBondContact CA-O 3.41Å; V17-G33 VanDerWaalsContact CG1-O 3.26Å; V17-G33 WeakPolarHBondContact CG1-O 3.45Å; T18-G33 PolarHBondContact N-O 3.47Å; T18-G33 PolarHBondContact OG1-O 3.19Å; A19-G33 PolarHBondContact N-O 2.84Å; A19-G33 PolarHBondContact O-N 3.41Å
34	G	95.5	Very high	93.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	176	177	0	0	0	0	0	113.9	A16 T18 D36 R37 I60	A16-G34 WeakPolarHBondContact O-CA 3.31Å; T18-G34 WeakPolarHBondContact OG1-CA 3.47Å; G34-D36 PolarHBondContact O-N 2.86Å; G34-R37 PolarHBondContact O-N 3.47Å; G34-I60 PolarHBondContact O-N 2.68Å
35	E	96.3	Very high	93.7	Very high	103 Å²	103	30.1 Å²	30.1	48%	0.481	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.4	177.5	-62.4	172.7	158.6	0	0	112.5	G15 A16 T18 R37	G15-E35 VanDerWaalsContact CA-OE2 3.24Å; G15-E35 WeakPolarHBondContact CA-OE2 3.35Å; A16-E35 HydrophobicContact CB-CG 4.43Å; A16-E35 PolarHBondContact N-OE2 3.18Å; A16-E35 PolarHBondContact O-N 3.46Å; T18-E35 HydrophobicContact CG2-CG 3.95Å; E35-R37 PolarHBondContact O-N 3.42Å; E35-R37 VanDerWaalsContact O-N 3.1Å
36	D	94.4	Very high	93.9	Very high	29 Å²	29	29 Å²	29	16%	0.155	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-1.9	170.7	72.2	-1	0	0	0	113.9	H12 G34 R38 K40	H12-D36 IonicContact CE1-OD1 2.81Å; H12-D36 IonicContact CG-OD1 3.01Å; H12-D36 IonicContact CG-OD2 2.71Å; H12-D36 IonicContact ND1-OD1 3.39Å; H12-D36 PolarHBondContact ND1-OD1 3.24Å; H12-D36 IonicContact ND1-OD2 3.8Å; H12-D36 PolarHBondContact ND1-OD2 3.38Å; G34-D36 PolarHBondContact O-N 2.86Å; D36-R38 PolarHBondContact O-N 3.27Å; D36-R38 WeakPolarHBondContact OD1-CB 3.34Å; D36-R38 PolarHBondContact OD1-N 2.99Å; D36-K40 WeakPolarHBondContact OD2-CE 3.46Å; D36-K40 IonicContact OD2-NZ 3.72Å; D36-K40 PolarHBondContact OD2-NZ 3.35Å
37	R	95.5	Very high	93.8	Very high	123 Å²	123	32.1 Å²	32.1	46%	0.464	16%	0.159	S	C	.	.	S	Bend	trans	66.8	14.7	178.2	-50.1	168.2	-81.7	-165.9	-4.9	113.6	G34 E35 H56 T57	G34-R37 PolarHBondContact O-N 3.47Å; E35-R37 PolarHBondContact O-N 3.42Å; E35-R37 VanDerWaalsContact O-N 3.1Å; R37-H56 WeakPolarHBondContact CB-O 3.48Å; R37-T57 VanDerWaalsContact CD-O 3.27Å; R37-T57 WeakPolarHBondContact CD-O 3.43Å
38	R	95.6	Very high	93.8	Very high	89 Å²	89	34.3 Å²	34.3	34%	0.336	17%	0.174	S	C	.	.			trans	-105.5	147.9	177.8	-62.6	177.4	167.7	-123.2	-2.9	110.3	H12 D36 S52 L53 T54 D435	H12-R38 PolarHBondContact CE1-O 3.25Å; H12-R38 VanDerWaalsContact CE1-O 3.23Å; D36-R38 PolarHBondContact O-N 3.27Å; D36-R38 WeakPolarHBondContact OD1-CB 3.34Å; D36-R38 PolarHBondContact OD1-N 2.99Å; R38-S52 PolarHBondContact NH1-OG 3.25Å; R38-L53 WeakPolarHBondContact CA-O 3.49Å; R38-T54 HydrophobicContact CG-CG2 4.4Å; R38-D435 IonicContact CZ-OD2 3.84Å; R38-D435 IonicContact NH1-OD2 3.68Å; R38-D435 PolarHBondContact NH1-OD2 3.31Å; R38-D435 IonicContact NH2-OD2 3.44Å
39	L	96.3	Very high	93.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.5	163.4	-178.1	145	0	0	0	108.7	A31 T32 L41 L53 I60 C63 V72 A74	A31-L39 HydrophobicContact CB-CD1 4.48Å; A31-L39 HydrophobicContact CB-CD2 4.24Å; T32-L39 CarbonylContact O-C 3.47Å; T32-L39 VanDerWaalsContact O-CA 3.31Å; T32-L39 WeakPolarHBondContact O-CA 3.39Å; L39-L41 HydrophobicContact CD2-CD2 3.67Å; L39-L41 HydrophobicContact CD2-CG 4.31Å; L39-L53 HydrophobicContact CB-CB 4.45Å; L39-L53 HydrophobicContact CD2-CD1 3.93Å; L39-L53 PolarHBondContact N-O 3.28Å; L39-L53 PolarHBondContact O-N 3.16Å; L39-I60 HydrophobicContact CB-CD1 4.02Å; L39-C63 HydrophobicContact CD1-CB 3.64Å; L39-V72 HydrophobicContact CD1-CG2 3.86Å; L39-V72 HydrophobicContact CD2-CG1 3.93Å; L39-V72 HydrophobicContact CD2-CG2 4.17Å; L39-A74 HydrophobicContact CD1-CB 3.69Å
40	K	95.7	Very high	93.9	Very high	26 Å²	26	32 Å²	32	11%	0.113	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.7	-178.7	-68.3	169.8	-173.4	161.6	0	110.9	A11 A31 T32 D36 W42 L51	A11-K40 WeakPolarHBondContact O-CD 3.36Å; A11-K40 PolarHBondContact O-NZ 2.88Å; A31-K40 CarbonylContact C-O 3.51Å; A31-K40 WeakPolarHBondContact CA-O 3.36Å; T32-K40 PolarHBondContact N-O 3.07Å; T32-K40 PolarHBondContact O-N 3.24Å; T32-K40 PolarHBondContact OG1-O 3Å; D36-K40 WeakPolarHBondContact OD2-CE 3.46Å; D36-K40 IonicContact OD2-NZ 3.72Å; D36-K40 PolarHBondContact OD2-NZ 3.35Å; K40-W42 HydrophobicContact CB-CZ2 3.81Å; K40-W42 HydrophobicContact CD-CZ2 3.91Å; K40-W42 HydrophobicContact CG-CZ2 4.47Å; K40-W42 PolarHBondContact O-NE1 2.96Å; K40-L51 CarbonylContact C-O 3.56Å; K40-L51 VanDerWaalsContact CA-O 3.32Å; K40-L51 WeakPolarHBondContact CA-O 3.29Å
41	L	95.6	Very high	93.7	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	143.8	176.4	-57	-172.1	0	0	0	111.5	M30 A31 L39 I50 L51 F65 L86 F446	M30-L41 CarbonylContact O-C 3.56Å; M30-L41 WeakPolarHBondContact O-CA 3.46Å; A31-L41 HydrophobicContact CB-CD2 3.47Å; A31-L41 VanDerWaalsContact CB-CD2 3.47Å; L39-L41 HydrophobicContact CD2-CD2 3.67Å; L39-L41 HydrophobicContact CD2-CG 4.31Å; L41-I50 PolarHBondContact O-N 3Å; L41-L51 HydrophobicContact CB-CB 4.19Å; L41-L51 HydrophobicContact CD1-CB 4.28Å; L41-L51 HydrophobicContact CD1-CD2 3.73Å; L41-L51 HydrophobicContact CG-CB 4.32Å; L41-L51 HydrophobicContact CG-CD2 4.34Å; L41-L51 PolarHBondContact N-O 2.96Å; L41-F65 HydrophobicContact CD2-CE1 3.98Å; L41-F65 HydrophobicContact CD2-CZ 3.92Å; L41-L86 HydrophobicContact CD1-CD1 3.92Å; L41-L86 HydrophobicContact CD1-CD2 3.73Å; L41-L86 HydrophobicContact CD1-CG 4.41Å; L41-F446 HydrophobicContact CD1-CE2 4.23Å; L41-F446 HydrophobicContact CD1-CZ 3.9Å
42	W	95	Very high	93.6	Very high	10 Å²	10	32 Å²	32	4%	0.038	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	146.6	-173.6	-45.4	80.8	0	0	0	110.4	A11 V29 M30 T32 K40 C49	A11-W42 HydrophobicContact CB-CH2 4.11Å; A11-W42 HydrophobicContact CB-CZ2 3.59Å; V29-W42 WeakPolarHBondContact CA-O 3.33Å; M30-W42 HydrophobicContact CB-CB 4.39Å; M30-W42 HydrophobicContact CE-CB 3.85Å; M30-W42 HydrophobicContact CE-CD2 4.49Å; M30-W42 HydrophobicContact CE-CG 3.74Å; M30-W42 PolarHBondContact N-O 2.94Å; M30-W42 PolarHBondContact O-N 3.12Å; T32-W42 PolarHBondContact OG1-NE1 3.31Å; K40-W42 HydrophobicContact CB-CZ2 3.81Å; K40-W42 HydrophobicContact CD-CZ2 3.91Å; K40-W42 HydrophobicContact CG-CZ2 4.47Å; K40-W42 PolarHBondContact O-NE1 2.96Å; W42-C49 HydrophobicContact CD2-CB 4.43Å; W42-C49 HydrophobicContact CE3-CB 3.98Å; W42-C49 HydrophobicContact CH2-CB 3.72Å; W42-C49 HydrophobicContact CZ2-CB 4.18Å; W42-C49 HydrophobicContact CZ3-CB 3.61Å
43	A	93	Very high	93.5	Very high	7 Å²	7	32 Å²	32	6%	0.058	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.2	165.1	0	0	0	0	0	108.9	G45 K46 I50 E441 I445	A43-G45 PolarHBondContact O-N 3.06Å; A43-G45 VanDerWaalsContact O-N 3.1Å; A43-K46 HydrophobicContact CB-CB 4.12Å; A43-K46 HydrophobicContact CB-CD 4.01Å; A43-K46 HydrophobicContact CB-CG 4.19Å; A43-K46 PolarHBondContact O-N 2.72Å; A43-I50 HydrophobicContact CB-CD1 3.95Å; A43-I50 VanDerWaalsContact N-CD1 3.33Å; A43-E441 HydrophobicContact CB-CG 4.38Å; A43-I445 HydrophobicContact CB-CD1 4.22Å
44	V	91.3	Very high	93.4	Very high	18 Å²	18	32.7 Å²	32.7	11%	0.109	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	114.1	178.4	174.9	0	0	0	0	109.3	L6 L22 R28 M30 V287	L6-V44 HydrophobicContact CD2-CG1 3.67Å; L22-V44 HydrophobicContact CD2-CG2 3.87Å; R28-V44 PolarHBondContact O-N 3.25Å; M30-V44 HydrophobicContact CB-CG2 4.48Å; V44-V287 HydrophobicContact CG1-CG1 3.8Å; V44-V287 HydrophobicContact CG1-CG2 4.37Å; V44-V287 HydrophobicContact CG2-CG1 4.39Å
45	G	88.9	Confident	93.2	Very high	38 Å²	38	32.9 Å²	32.9	39%	0.392	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	6.8	-175.1	0	0	0	0	0	115.1	A43	A43-G45 PolarHBondContact O-N 3.06Å; A43-G45 VanDerWaalsContact O-N 3.1Å
46	K	90.3	Very high	93.1	Very high	65 Å²	65	28.3 Å²	28.3	28%	0.283	15%	0.152	S	C	.	.			trans	-116.5	131.1	165.1	-67.8	-173.2	164.6	-171	0	111.3	Q7 A43 S48 E441	Q7-K46 VanDerWaalsContact CD-C 3.49Å; Q7-K46 VanDerWaalsContact NE2-C 3.31Å; Q7-K46 PolarHBondContact NE2-O 3.16Å; Q7-K46 PolarHBondContact OE1-O 3.47Å; A43-K46 HydrophobicContact CB-CB 4.12Å; A43-K46 HydrophobicContact CB-CD 4.01Å; A43-K46 HydrophobicContact CB-CG 4.19Å; A43-K46 PolarHBondContact O-N 2.72Å; K46-S48 VanDerWaalsContact C-N 3.28Å; K46-S48 PolarHBondContact O-N 3.19Å; K46-E441 HydrophobicContact CD-CG 4.2Å; K46-E441 VanDerWaalsContact CE-OE1 3.25Å; K46-E441 WeakPolarHBondContact CE-OE1 3.37Å; K46-E441 IonicContact NZ-OE1 3.7Å; K46-E441 PolarHBondContact NZ-OE1 2.85Å; K46-E441 IonicContact NZ-OE2 3.22Å; K46-E441 PolarHBondContact NZ-OE2 3.35Å
47	P	87.3	Confident	93.1	Very high	93 Å²	93	31.3 Å²	31.3	60%	0.604	17%	0.171	S	C	*	.			trans	-77.5	-10.2	175.6	32.4	-35.8	0	0	0	113.7
48	S	88.8	Confident	93.1	Very high	45 Å²	45	26.5 Å²	26.5	32%	0.315	16%	0.157	S	C	.	.	S	Bend	trans	-74.5	129.7	173.3	43.6	0	0	0	0	111.1	K46	K46-S48 VanDerWaalsContact C-N 3.28Å; K46-S48 PolarHBondContact O-N 3.19Å
49	C	91.9	Very high	93.2	Very high	19 Å²	19	23 Å²	23	13%	0.128	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	133.9	159.1	178.7	0	0	0	0	108.1	W42 L51 N437	W42-C49 HydrophobicContact CD2-CB 4.43Å; W42-C49 HydrophobicContact CE3-CB 3.98Å; W42-C49 HydrophobicContact CH2-CB 3.72Å; W42-C49 HydrophobicContact CZ2-CB 4.18Å; W42-C49 HydrophobicContact CZ3-CB 3.61Å; C49-L51 PolarHBondContact SG-O 3.37Å; C49-L51 VanDerWaalsContact SG-O 3.36Å; C49-N437 WeakPolarHBondContact O-CB 3.45Å; C49-N437 PolarHBondContact SG-ND2 3.12Å; C49-N437 VanDerWaalsContact SG-ND2 3.41Å
50	I	93.1	Very high	93.2	Very high	2 Å²	2	23 Å²	23	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-47.3	175.9	-59.1	164.6	0	0	0	109.8	L41 A43 N437 D438 E441 Y442 I445 F446	L41-I50 PolarHBondContact O-N 3Å; A43-I50 HydrophobicContact CB-CD1 3.95Å; A43-I50 VanDerWaalsContact N-CD1 3.33Å; I50-N437 PolarHBondContact O-N 2.72Å; I50-D438 PolarHBondContact O-N 3.33Å; I50-E441 HydrophobicContact CD1-CG 4.38Å; I50-E441 HydrophobicContact CG1-CG 4.41Å; I50-Y442 HydrophobicContact CG2-CD2 4.3Å; I50-Y442 HydrophobicContact CG2-CG 4.48Å; I50-I445 HydrophobicContact CD1-CD1 3.77Å; I50-F446 HydrophobicContact CG2-CE2 4.44Å
51	L	93.2	Very high	93.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	135.2	-168.5	178.5	70.2	0	0	0	110	K40 L41 C49 L53 L86 V89 A434 D435 I436	K40-L51 CarbonylContact C-O 3.56Å; K40-L51 VanDerWaalsContact CA-O 3.32Å; K40-L51 WeakPolarHBondContact CA-O 3.29Å; L41-L51 HydrophobicContact CB-CB 4.19Å; L41-L51 HydrophobicContact CD1-CB 4.28Å; L41-L51 HydrophobicContact CD1-CD2 3.73Å; L41-L51 HydrophobicContact CG-CB 4.32Å; L41-L51 HydrophobicContact CG-CD2 4.34Å; L41-L51 PolarHBondContact N-O 2.96Å; C49-L51 PolarHBondContact SG-O 3.37Å; C49-L51 VanDerWaalsContact SG-O 3.36Å; L51-L53 HydrophobicContact CD1-CD2 4.26Å; L51-L53 HydrophobicContact CD2-CD1 4.01Å; L51-L53 HydrophobicContact CD2-CD2 3.82Å; L51-L53 HydrophobicContact CD2-CG 3.87Å; L51-L53 HydrophobicContact CG-CD2 4.02Å; L51-L53 HydrophobicContact CG-CG 4.01Å; L51-L86 HydrophobicContact CD2-CD2 4.31Å; L51-V89 HydrophobicContact CD1-CG1 3.51Å; L51-V89 HydrophobicContact CD2-CG1 4.09Å; L51-V89 HydrophobicContact CG-CG1 4.41Å; L51-A434 HydrophobicContact CD1-CB 4.46Å; L51-D435 CarbonylContact C-O 3.51Å; L51-D435 WeakPolarHBondContact CA-O 3.34Å; L51-I436 HydrophobicContact CD1-CB 4.48Å; L51-I436 HydrophobicContact CD1-CG1 3.74Å
52	S	94.8	Very high	93.4	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.014	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.8	172.5	160.6	0	0	0	0	109.9	R38 A434 D435	R38-S52 PolarHBondContact NH1-OG 3.25Å; S52-A434 WeakPolarHBondContact O-CA 3.45Å; S52-D435 PolarHBondContact N-O 2.82Å; S52-D435 PolarHBondContact O-N 3.15Å
53	L	94.9	Very high	93.5	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.3	-177.6	-66.3	173.5	0	0	0	110.7	R38 L39 L51 V72 W84 L86 V89 A434	R38-L53 WeakPolarHBondContact CA-O 3.49Å; L39-L53 HydrophobicContact CB-CB 4.45Å; L39-L53 HydrophobicContact CD2-CD1 3.93Å; L39-L53 PolarHBondContact N-O 3.28Å; L39-L53 PolarHBondContact O-N 3.16Å; L51-L53 HydrophobicContact CD1-CD2 4.26Å; L51-L53 HydrophobicContact CD2-CD1 4.01Å; L51-L53 HydrophobicContact CD2-CD2 3.82Å; L51-L53 HydrophobicContact CD2-CG 3.87Å; L51-L53 HydrophobicContact CG-CD2 4.02Å; L51-L53 HydrophobicContact CG-CG 4.01Å; L53-V72 HydrophobicContact CD1-CG1 4.02Å; L53-W84 HydrophobicContact CB-CZ2 4.43Å; L53-W84 HydrophobicContact CD1-CB 3.92Å; L53-W84 HydrophobicContact CD1-CD2 4.06Å; L53-W84 HydrophobicContact CD1-CG 3.7Å; L53-W84 HydrophobicContact CD2-CG 4.36Å; L53-W84 HydrophobicContact CG-CG 4.42Å; L53-L86 HydrophobicContact CD1-CD2 4.14Å; L53-V89 HydrophobicContact CD2-CG1 4.02Å; L53-A434 HydrophobicContact CD2-CB 3.69Å
54	T	94.3	Very high	93.7	Very high	15 Å²	15	24.7 Å²	24.7	9%	0.092	16%	0.155	C	C	.	.			trans	-102.8	170.6	176.5	81.2	0	0	0	0	112.6	R38 S430 A433	R38-T54 HydrophobicContact CG-CG2 4.4Å; T54-S430 PolarHBondContact OG1-O 3.49Å; T54-S430 VanDerWaalsContact OG1-O 3.06Å; T54-A433 HydrophobicContact CG2-CB 4.22Å; T54-A433 PolarHBondContact N-O 3.39Å; T54-A433 PolarHBondContact OG1-N 2.85Å; T54-A433 VanDerWaalsContact OG1-N 3.13Å; T54-A433 PolarHBondContact OG1-O 3.32Å; T54-A433 VanDerWaalsContact OG1-O 3.1Å
55	G	91.4	Very high	93.9	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.031	15%	0.152	C	C	.	.			trans	135.1	-18.9	160.4	0	0	0	0	0	115.6	R82 L431	G55-R82 VanDerWaalsContact C-NE 3.3Å; G55-R82 PolarHBondContact O-NE 3.37Å; G55-R82 PolarHBondContact O-NH2 3.41Å; G55-L431 WeakPolarHBondContact CA-O 3.32Å
56	H	94.3	Very high	94.2	Very high	8 Å²	8	22.9 Å²	22.9	4%	0.037	14%	0.137	C	C	.	.			trans	-68	145.9	167.6	-76.3	-72.6	0	0	0	110.7	R37 I60 A74 S76 S80 W84	R37-H56 WeakPolarHBondContact CB-O 3.48Å; H56-I60 HydrophobicContact CB-CD1 4.47Å; H56-I60 HydrophobicContact CB-CG1 4.22Å; H56-A74 PolarHBondContact NE2-O 2.88Å; H56-S76 WeakPolarHBondContact ND1-CB 3.46Å; H56-S80 PolarHBondContact CE1-O 3.32Å; H56-S80 PolarHBondContact CE1-OG 2.98Å; H56-S80 PolarHBondContact ND1-OG 2.96Å; H56-W84 AromaticContact CD2-CH2 3.67Å; H56-W84 AromaticContact NE2-CH2 3.57Å
57	T	94	Very high	94.2	Very high	91 Å²	91	24.8 Å²	24.8	56%	0.558	15%	0.146	S	C	*	.	S	Bend	trans	-95.5	-11.4	177.1	50.6	0	0	0	0	112.5	R37 L431	R37-T57 VanDerWaalsContact CD-O 3.27Å; R37-T57 WeakPolarHBondContact CD-O 3.43Å; T57-L431 HydrophobicContact CG2-CD2 4.31Å
58	S	95.8	Very high	94.3	Very high	22 Å²	22	25.6 Å²	25.6	15%	0.154	14%	0.142	C	C	.	.	S	Bend	trans	-134.4	168.1	178.6	61.2	0	0	0	0	110.8	S76 S78	S58-S76 WeakPolarHBondContact OG-CB 3.33Å; S58-S76 PolarHBondContact OG-OG 3.31Å; S58-S78 VanDerWaalsContact OG-CB 3.22Å; S58-S78 WeakPolarHBondContact OG-CB 3.49Å; S58-S78 PolarHBondContact OG-N 3.47Å; S58-S78 VanDerWaalsContact OG-N 3.09Å; S58-S78 PolarHBondContact OG-OG 3.3Å
59	S	96.3	Very high	94.4	Very high	15 Å²	15	24.5 Å²	24.5	11%	0.105	13%	0.132	C	C	.	.			trans	-51.3	149.3	179.7	-177.4	0	0	0	0	112.7	T18 E61 S76 L77	T18-S59 PolarHBondContact OG1-OG 2.98Å; S59-E61 WeakPolarHBondContact CB-OE1 3.25Å; S59-E61 PolarHBondContact OG-OE1 3Å; S59-S76 CarbonylContact O-C 3.59Å; S59-S76 WeakPolarHBondContact O-CA 3.41Å; S59-S76 VanDerWaalsContact O-CB 3.27Å; S59-S76 WeakPolarHBondContact O-CB 3.17Å; S59-L77 PolarHBondContact O-N 2.9Å
60	I	97.4	Very high	94.4	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	105.5	-177.9	-63.3	-179.6	0	0	0	109.7	T18 G34 L39 H56 A62 A74 G75	T18-I60 WeakPolarHBondContact CB-O 3.45Å; T18-I60 PolarHBondContact OG1-O 3.23Å; G34-I60 PolarHBondContact O-N 2.68Å; L39-I60 HydrophobicContact CB-CD1 4.02Å; H56-I60 HydrophobicContact CB-CD1 4.47Å; H56-I60 HydrophobicContact CB-CG1 4.22Å; I60-A62 WeakPolarHBondContact CG2-O 3.34Å; I60-A74 HydrophobicContact CD1-CB 4.36Å; I60-A74 HydrophobicContact CG2-CB 3.83Å; I60-G75 CarbonylContact C-O 3.54Å
61	E	97.2	Very high	94.5	Very high	54 Å²	54	29.2 Å²	29.2	25%	0.252	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-11.1	-172.2	-56.1	-54	128.5	0	0	113.5	S59 G75 L77 A101 I102	S59-E61 WeakPolarHBondContact CB-OE1 3.25Å; S59-E61 PolarHBondContact OG-OE1 3Å; E61-G75 PolarHBondContact N-O 2.91Å; E61-L77 HydrophobicContact CG-CB 3.9Å; E61-L77 HydrophobicContact CG-CD1 4.32Å; E61-A101 HydrophobicContact CB-CB 4.37Å; E61-A101 HydrophobicContact CG-CB 4.1Å; E61-I102 CarbonylContact C-O 3.47Å; E61-I102 WeakPolarHBondContact CB-O 3.45Å
62	A	97.3	Very high	94.7	Very high	5 Å²	5	29.2 Å²	29.2	4%	0.041	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.5	172.7	0	0	0	0	0	111.2	I60 A74 G75 I102 L105	I60-A62 WeakPolarHBondContact CG2-O 3.34Å; A62-A74 CarbonylContact O-C 3.59Å; A62-A74 VanDerWaalsContact O-CA 3.29Å; A62-A74 WeakPolarHBondContact O-CA 3.44Å; A62-G75 PolarHBondContact N-O 3.23Å; A62-G75 VanDerWaalsContact N-O 3.14Å; A62-G75 PolarHBondContact O-N 2.72Å; A62-I102 HydrophobicContact CB-CG2 4.19Å; A62-I102 VanDerWaalsContact CB-O 3.27Å; A62-I102 WeakPolarHBondContact CB-O 3.42Å; A62-L105 HydrophobicContact CB-CD1 4.35Å; A62-L105 HydrophobicContact CB-CG 4.49Å
63	C	97.4	Very high	94.8	Very high	11 Å²	11	29.1 Å²	29.1	7%	0.074	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.5	164.8	54	0	0	0	0	110.6	T21 L39 A73 A74	T21-C63 WeakPolarHBondContact CB-O 3.45Å; T21-C63 HydrophobicContact CG2-CB 4.22Å; T21-C63 WeakPolarHBondContact CG2-O 3.34Å; L39-C63 HydrophobicContact CD1-CB 3.64Å; C63-A73 CarbonylContact C-O 3.51Å; C63-A73 WeakPolarHBondContact CA-O 3.28Å; C63-A74 HydrophobicContact CB-CB 4.47Å
64	E	97.2	Very high	94.9	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.047	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	145.4	173.9	-162.8	70.4	160.6	0	0	109.8	T21 R24 V72 A73 L105 F107 R148	T21-E64 WeakPolarHBondContact CB-OE2 3.4Å; T21-E64 PolarHBondContact OG1-OE2 3.44Å; R24-E64 IonicContact CZ-OE1 2.96Å; R24-E64 IonicContact CZ-OE2 3.18Å; R24-E64 IonicContact NE-OE1 2.77Å; R24-E64 PolarHBondContact NE-OE1 3.42Å; R24-E64 IonicContact NH2-OE1 2.72Å; R24-E64 PolarHBondContact NH2-OE1 3.32Å; R24-E64 IonicContact NH2-OE2 3.82Å; R24-E64 PolarHBondContact NH2-OE2 3.04Å; R24-E64 VanDerWaalsContact NH2-OE2 3.08Å; E64-V72 WeakPolarHBondContact O-CG2 3.47Å; E64-A73 PolarHBondContact N-O 2.96Å; E64-A73 PolarHBondContact O-N 3.15Å; E64-L105 HydrophobicContact CB-CB 4.2Å; E64-F107 WeakPolarHBondContact O-CE2 3.41Å; E64-R148 IonicContact OE1-CZ 3.23Å; E64-R148 IonicContact OE1-NH1 3.05Å; E64-R148 PolarHBondContact OE1-NH1 3.47Å; E64-R148 IonicContact OE1-NH2 3.87Å; E64-R148 PolarHBondContact OE1-NH2 3.01Å
65	F	95.8	Very high	95.1	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	155.6	170.4	-73.2	-80	0	0	0	111.6	T21 V29 A31 L41 V72 L86 F107	T21-F65 HydrophobicContact CG2-CD2 3.93Å; T21-F65 HydrophobicContact CG2-CE2 4.08Å; V29-F65 HydrophobicContact CB-CZ 4.21Å; V29-F65 HydrophobicContact CG2-CE1 4.18Å; V29-F65 HydrophobicContact CG2-CE2 4.06Å; V29-F65 HydrophobicContact CG2-CZ 3.82Å; A31-F65 HydrophobicContact CB-CD2 4.45Å; A31-F65 HydrophobicContact CB-CE1 4.28Å; A31-F65 HydrophobicContact CB-CE2 3.66Å; A31-F65 HydrophobicContact CB-CZ 3.56Å; L41-F65 HydrophobicContact CD2-CE1 3.98Å; L41-F65 HydrophobicContact CD2-CZ 3.92Å; F65-V72 HydrophobicContact CD1-CB 4.32Å; F65-V72 HydrophobicContact CD1-CG2 4.37Å; F65-L86 HydrophobicContact CD1-CD1 4.23Å; F65-L86 HydrophobicContact CE1-CD1 4.01Å; F65-F107 WeakPolarHBondContact O-CD2 3.49Å
66	S	94.3	Very high	95.3	Very high	11 Å²	11	28.2 Å²	28.2	8%	0.077	15%	0.145	C	C	.	.			trans	-65.9	157.3	160.9	63.2	0	0	0	0	111.1	E68 E69 D70 R71	S66-E68 PolarHBondContact O-N 2.84Å; S66-E68 VanDerWaalsContact O-N 3.13Å; S66-E69 PolarHBondContact O-N 3.02Å; S66-E69 PolarHBondContact OG-N 3.19Å; S66-D70 WeakPolarHBondContact CB-OD1 3.44Å; S66-D70 PolarHBondContact OG-N 3.31Å; S66-D70 PolarHBondContact OG-OD1 2.83Å; S66-R71 PolarHBondContact N-O 2.98Å; S66-R71 PolarHBondContact OG-N 3.21Å; S66-R71 VanDerWaalsContact OG-N 3.09Å; S66-R71 PolarHBondContact OG-O 3.34Å
67	Q	90.8	Very high	95.5	Very high	104 Å²	104	32.1 Å²	32.1	49%	0.486	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.6	178.1	-174.9	59.8	21.5	0	0	113.2	K25	K25-Q67 WeakPolarHBondContact CB-O 3.44Å; K25-Q67 WeakPolarHBondContact CD-O 3.22Å
68	E	89.3	Confident	95.6	Very high	111 Å²	111	30.7 Å²	30.7	52%	0.519	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.2	177.9	-71.1	-59.7	124.4	0	0	114.2	K25 S66 D70	K25-E68 PolarHBondContact NZ-O 3.34Å; K25-E68 IonicContact NZ-OE1 2.7Å; K25-E68 IonicContact NZ-OE2 3.81Å; K25-E68 PolarHBondContact NZ-OE2 3.47Å; S66-E68 PolarHBondContact O-N 2.84Å; S66-E68 VanDerWaalsContact O-N 3.13Å; E68-D70 PolarHBondContact O-N 3.08Å
69	E	92.2	Very high	95.6	Very high	22 Å²	22	29.6 Å²	29.6	10%	0.103	15%	0.152	C	C	.	.	S	Bend	trans	63.7	22.1	-172.9	-59.5	172.9	-174.9	0	0	114.1	G23 R24 K25 S26 V29 S66	G23-E69 WeakPolarHBondContact CA-OE1 3.3Å; R24-E69 PolarHBondContact N-OE1 3.11Å; K25-E69 WeakPolarHBondContact CA-OE1 3.46Å; K25-E69 HydrophobicContact CB-CG 4.29Å; K25-E69 WeakPolarHBondContact CB-OE1 3.33Å; K25-E69 PolarHBondContact N-OE1 3.12Å; S26-E69 WeakPolarHBondContact CB-OE2 3.32Å; S26-E69 PolarHBondContact N-OE1 2.89Å; S26-E69 VanDerWaalsContact OG-CD 3.31Å; S26-E69 PolarHBondContact OG-OE1 2.96Å; S26-E69 PolarHBondContact OG-OE2 2.84Å; V29-E69 HydrophobicContact CG2-CG 4.32Å; V29-E69 WeakPolarHBondContact CG2-OE2 3.33Å; S66-E69 PolarHBondContact O-N 3.02Å; S66-E69 PolarHBondContact OG-N 3.19Å
70	D	92.4	Very high	95.6	Very high	66 Å²	66	29.8 Å²	29.8	35%	0.353	15%	0.153	S	C	.	.	S	Bend	trans	-87.4	-18.3	175.8	71.3	-31.7	0	0	0	113.6	S66 E68 L86	S66-D70 WeakPolarHBondContact CB-OD1 3.44Å; S66-D70 PolarHBondContact OG-N 3.31Å; S66-D70 PolarHBondContact OG-OD1 2.83Å; E68-D70 PolarHBondContact O-N 3.08Å; D70-L86 WeakPolarHBondContact O-CB 3.42Å; D70-L86 PolarHBondContact O-N 3.21Å
71	R	94.2	Very high	95.5	Very high	54 Å²	54	29.8 Å²	29.8	20%	0.204	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.8	-174.3	-68.7	167	-175.1	-122.8	-26.1	110.5	S66 W84 D85 F107	S66-R71 PolarHBondContact N-O 2.98Å; S66-R71 PolarHBondContact OG-N 3.21Å; S66-R71 VanDerWaalsContact OG-N 3.09Å; S66-R71 PolarHBondContact OG-O 3.34Å; R71-W84 VanDerWaalsContact CA-O 3.3Å; R71-W84 WeakPolarHBondContact CA-O 3.38Å; R71-W84 WeakPolarHBondContact CB-O 3.29Å; R71-D85 IonicContact CZ-OD2 2.73Å; R71-D85 IonicContact NE-OD2 2.86Å; R71-D85 IonicContact NH2-OD2 2.78Å; R71-D85 PolarHBondContact NH2-OD2 2.93Å; R71-F107 HydrophobicContact CB-CE1 4.4Å; R71-F107 HydrophobicContact CB-CZ 4.27Å
72	V	96.4	Very high	95.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140	170.5	69.7	0	0	0	0	109.3	A31 L39 L53 E64 F65 I83 W84 L86	A31-V72 HydrophobicContact CB-CG2 4.08Å; L39-V72 HydrophobicContact CD1-CG2 3.86Å; L39-V72 HydrophobicContact CD2-CG1 3.93Å; L39-V72 HydrophobicContact CD2-CG2 4.17Å; L53-V72 HydrophobicContact CD1-CG1 4.02Å; E64-V72 WeakPolarHBondContact O-CG2 3.47Å; F65-V72 HydrophobicContact CD1-CB 4.32Å; F65-V72 HydrophobicContact CD1-CG2 4.37Å; V72-I83 WeakPolarHBondContact O-CA 3.26Å; V72-W84 HydrophobicContact CG1-CB 4.13Å; V72-W84 HydrophobicContact CG1-CE3 4.04Å; V72-W84 PolarHBondContact N-O 3.2Å; V72-W84 VanDerWaalsContact N-O 3.17Å; V72-W84 PolarHBondContact O-N 3.08Å; V72-L86 HydrophobicContact CB-CD2 4.4Å; V72-L86 HydrophobicContact CG1-CD2 3.77Å
73	A	96.9	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145	168.5	0	0	0	0	0	109.4	C63 E64 R82 I83 L105 F107	C63-A73 CarbonylContact C-O 3.51Å; C63-A73 WeakPolarHBondContact CA-O 3.28Å; E64-A73 PolarHBondContact N-O 2.96Å; E64-A73 PolarHBondContact O-N 3.15Å; A73-R82 CarbonylContact C-O 3.58Å; A73-R82 VanDerWaalsContact CA-O 3.29Å; A73-R82 WeakPolarHBondContact CA-O 3.25Å; A73-I83 HydrophobicContact CB-CG1 4.12Å; A73-L105 HydrophobicContact CB-CD1 4.02Å; A73-F107 HydrophobicContact CB-CE2 3.52Å; A73-F107 HydrophobicContact CB-CZ 3.6Å
74	A	97.9	Very high	95.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.5	171.5	0	0	0	0	0	110.2	L39 H56 I60 A62 C63 V81 R82 W84 L105	L39-A74 HydrophobicContact CD1-CB 3.69Å; H56-A74 PolarHBondContact NE2-O 2.88Å; I60-A74 HydrophobicContact CD1-CB 4.36Å; I60-A74 HydrophobicContact CG2-CB 3.83Å; A62-A74 CarbonylContact O-C 3.59Å; A62-A74 VanDerWaalsContact O-CA 3.29Å; A62-A74 WeakPolarHBondContact O-CA 3.44Å; C63-A74 HydrophobicContact CB-CB 4.47Å; A74-V81 CarbonylContact O-C 3.34Å; A74-V81 VanDerWaalsContact O-CA 3.24Å; A74-V81 WeakPolarHBondContact O-CA 3.31Å; A74-V81 WeakPolarHBondContact O-CG1 3.44Å; A74-R82 PolarHBondContact N-O 3.36Å; A74-R82 PolarHBondContact O-N 3.11Å; A74-W84 HydrophobicContact CB-CH2 3.76Å; A74-W84 HydrophobicContact CB-CZ3 3.47Å; A74-W84 VanDerWaalsContact CB-CZ3 3.47Å; A74-L105 VanDerWaalsContact C-CD1 3.49Å
75	G	97.5	Very high	95.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.5	177.8	0	0	0	0	0	109.5	I60 E61 A62 S80	I60-G75 CarbonylContact C-O 3.54Å; E61-G75 PolarHBondContact N-O 2.91Å; A62-G75 PolarHBondContact N-O 3.23Å; A62-G75 VanDerWaalsContact N-O 3.14Å; A62-G75 PolarHBondContact O-N 2.72Å; G75-S80 WeakPolarHBondContact CA-O 3.44Å
76	S	97.6	Very high	95	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	163.8	-174.9	70.2	0	0	0	0	113.8	H56 S58 S59 S78 G79 S80 I102	H56-S76 WeakPolarHBondContact ND1-CB 3.46Å; S58-S76 WeakPolarHBondContact OG-CB 3.33Å; S58-S76 PolarHBondContact OG-OG 3.31Å; S59-S76 CarbonylContact O-C 3.59Å; S59-S76 WeakPolarHBondContact O-CA 3.41Å; S59-S76 VanDerWaalsContact O-CB 3.27Å; S59-S76 WeakPolarHBondContact O-CB 3.17Å; S76-S78 PolarHBondContact O-N 3.21Å; S76-S78 PolarHBondContact OG-OG 3.04Å; S76-S78 VanDerWaalsContact OG-OG 3.13Å; S76-G79 PolarHBondContact O-N 2.62Å; S76-S80 PolarHBondContact N-O 3.37Å; S76-S80 PolarHBondContact OG-N 3.45Å; S76-S80 PolarHBondContact OG-O 2.86Å; S76-S80 PolarHBondContact OG-OG 3.27Å; S76-I102 PolarHBondContact O-N 2.89Å
77	L	97.4	Very high	94.8	Very high	90 Å²	90	33.2 Å²	33.2	47%	0.471	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-36.5	172.8	-178.1	63.4	0	0	0	112.1	S59 E61 G79 S100 A101	S59-L77 PolarHBondContact O-N 2.9Å; E61-L77 HydrophobicContact CG-CB 3.9Å; E61-L77 HydrophobicContact CG-CD1 4.32Å; L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 2.9Å; L77-S100 CarbonylContact O-C 3.54Å; L77-A101 HydrophobicContact CD1-CB 4.09Å; L77-A101 WeakPolarHBondContact O-CA 3.49Å; L77-A101 PolarHBondContact O-N 3.44Å
78	S	96.4	Very high	94.7	Very high	60 Å²	60	33.8 Å²	33.8	42%	0.42	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	11.7	176.6	71.9	0	0	0	0	115.8	S58 S76 S80	S58-S78 VanDerWaalsContact OG-CB 3.22Å; S58-S78 WeakPolarHBondContact OG-CB 3.49Å; S58-S78 PolarHBondContact OG-N 3.47Å; S58-S78 VanDerWaalsContact OG-N 3.09Å; S58-S78 PolarHBondContact OG-OG 3.3Å; S76-S78 PolarHBondContact O-N 3.21Å; S76-S78 PolarHBondContact OG-OG 3.04Å; S76-S78 VanDerWaalsContact OG-OG 3.13Å; S78-S80 VanDerWaalsContact C-N 3.31Å; S78-S80 PolarHBondContact O-N 3.14Å
79	G	95.5	Very high	94.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	72.5	16.9	178.6	0	0	0	0	0	115.7	S76 L77 S100 I102	S76-G79 PolarHBondContact O-N 2.62Å; L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 2.9Å; G79-S100 WeakPolarHBondContact CA-O 3.3Å; G79-S100 PolarHBondContact N-O 3.25Å; G79-I102 VanDerWaalsContact C-CD1 3.4Å
80	S	96	Very high	94.8	Very high	19 Å²	19	34.1 Å²	34.1	13%	0.133	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.2	172.2	75.5	0	0	0	0	110.9	H56 G75 S76 S78 L95 I102	H56-S80 PolarHBondContact CE1-O 3.32Å; H56-S80 PolarHBondContact CE1-OG 2.98Å; H56-S80 PolarHBondContact ND1-OG 2.96Å; G75-S80 WeakPolarHBondContact CA-O 3.44Å; S76-S80 PolarHBondContact N-O 3.37Å; S76-S80 PolarHBondContact OG-N 3.45Å; S76-S80 PolarHBondContact OG-O 2.86Å; S76-S80 PolarHBondContact OG-OG 3.27Å; S78-S80 VanDerWaalsContact C-N 3.31Å; S78-S80 PolarHBondContact O-N 3.14Å; S80-L95 WeakPolarHBondContact CA-O 3.43Å; S80-I102 VanDerWaalsContact O-CD1 3.22Å; S80-I102 WeakPolarHBondContact O-CD1 3.46Å
81	V	96.7	Very high	94.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.1	170.4	-176.4	0	0	0	0	108.4	A74 I83 L95 I102 L105	A74-V81 CarbonylContact O-C 3.34Å; A74-V81 VanDerWaalsContact O-CA 3.24Å; A74-V81 WeakPolarHBondContact O-CA 3.31Å; A74-V81 WeakPolarHBondContact O-CG1 3.44Å; V81-I83 HydrophobicContact CG1-CG1 4.45Å; V81-L95 HydrophobicContact CB-CB 4.2Å; V81-L95 HydrophobicContact CB-CD1 4.41Å; V81-L95 HydrophobicContact CG1-CD1 4.43Å; V81-L95 PolarHBondContact N-O 2.86Å; V81-L95 PolarHBondContact O-N 2.72Å; V81-I102 HydrophobicContact CG2-CD1 3.5Å; V81-I102 VanDerWaalsContact CG2-CD1 3.5Å; V81-I102 HydrophobicContact CG2-CG1 4.31Å; V81-L105 HydrophobicContact CG1-CD1 4.31Å; V81-L105 HydrophobicContact CG1-CD2 3.91Å; V81-L105 HydrophobicContact CG2-CD2 4.04Å
82	R	95.9	Very high	94.7	Very high	39 Å²	39	32 Å²	32	15%	0.147	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149.1	168	-71.4	175.9	175.8	-101.1	6.9	109.9	G55 A73 A74 W84 R93 A94	G55-R82 VanDerWaalsContact C-NE 3.3Å; G55-R82 PolarHBondContact O-NE 3.37Å; G55-R82 PolarHBondContact O-NH2 3.41Å; A73-R82 CarbonylContact C-O 3.58Å; A73-R82 VanDerWaalsContact CA-O 3.29Å; A73-R82 WeakPolarHBondContact CA-O 3.25Å; A74-R82 PolarHBondContact N-O 3.36Å; A74-R82 PolarHBondContact O-N 3.11Å; R82-W84 HydrophobicContact CB-CE3 4.21Å; R82-W84 HydrophobicContact CB-CH2 3.4Å; R82-W84 VanDerWaalsContact CB-CH2 3.4Å; R82-W84 HydrophobicContact CB-CZ2 3.86Å; R82-W84 HydrophobicContact CB-CZ3 3.58Å; R82-W84 HydrophobicContact CG-CH2 4.43Å; R82-W84 VanDerWaalsContact O-CZ3 3.32Å; R82-W84 WeakPolarHBondContact O-CZ3 3.5Å; R82-R93 WeakPolarHBondContact CA-O 3.34Å; R82-A94 HydrophobicContact CG-CB 4.05Å
83	I	95.8	Very high	94.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124	-179.6	-56.9	173.2	0	0	0	107.6	V72 A73 V81 I91 V92 R93 L95 F107 V114 V128	V72-I83 WeakPolarHBondContact O-CA 3.26Å; A73-I83 HydrophobicContact CB-CG1 4.12Å; V81-I83 HydrophobicContact CG1-CG1 4.45Å; I83-I91 CarbonylContact O-C 3.34Å; I83-V92 HydrophobicContact CG2-CB 4.5Å; I83-V92 PolarHBondContact O-N 3.18Å; I83-R93 PolarHBondContact N-O 2.71Å; I83-R93 PolarHBondContact O-N 3.42Å; I83-L95 HydrophobicContact CD1-CD1 3.94Å; I83-F107 HydrophobicContact CG2-CE1 4.35Å; I83-F107 HydrophobicContact CG2-CZ 4.22Å; I83-V114 HydrophobicContact CD1-CB 4.37Å; I83-V114 HydrophobicContact CD1-CG2 3.77Å; I83-V128 HydrophobicContact CD1-CB 4.35Å; I83-V128 HydrophobicContact CD1-CG1 3.94Å; I83-V128 HydrophobicContact CD1-CG2 3.58Å; I83-V128 HydrophobicContact CG2-CG1 4.41Å
84	W	95.6	Very high	94.4	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	145.9	177.1	-60.4	-109.7	0	0	0	110.7	L53 H56 R71 V72 A74 R82 K90 I91	L53-W84 HydrophobicContact CB-CZ2 4.43Å; L53-W84 HydrophobicContact CD1-CB 3.92Å; L53-W84 HydrophobicContact CD1-CD2 4.06Å; L53-W84 HydrophobicContact CD1-CG 3.7Å; L53-W84 HydrophobicContact CD2-CG 4.36Å; L53-W84 HydrophobicContact CG-CG 4.42Å; H56-W84 AromaticContact CD2-CH2 3.67Å; H56-W84 AromaticContact NE2-CH2 3.57Å; R71-W84 VanDerWaalsContact CA-O 3.3Å; R71-W84 WeakPolarHBondContact CA-O 3.38Å; R71-W84 WeakPolarHBondContact CB-O 3.29Å; V72-W84 HydrophobicContact CG1-CB 4.13Å; V72-W84 HydrophobicContact CG1-CE3 4.04Å; V72-W84 PolarHBondContact N-O 3.2Å; V72-W84 VanDerWaalsContact N-O 3.17Å; V72-W84 PolarHBondContact O-N 3.08Å; A74-W84 HydrophobicContact CB-CH2 3.76Å; A74-W84 HydrophobicContact CB-CZ3 3.47Å; A74-W84 VanDerWaalsContact CB-CZ3 3.47Å; R82-W84 HydrophobicContact CB-CE3 4.21Å; R82-W84 HydrophobicContact CB-CH2 3.4Å; R82-W84 VanDerWaalsContact CB-CH2 3.4Å; R82-W84 HydrophobicContact CB-CZ2 3.86Å; R82-W84 HydrophobicContact CB-CZ3 3.58Å; R82-W84 HydrophobicContact CG-CH2 4.43Å; R82-W84 VanDerWaalsContact O-CZ3 3.32Å; R82-W84 WeakPolarHBondContact O-CZ3 3.5Å; W84-K90 CarbonylContact C-O 3.56Å; W84-K90 VanDerWaalsContact CA-O 3.24Å; W84-K90 WeakPolarHBondContact CA-O 3.36Å; W84-I91 HydrophobicContact CG-CG1 4.32Å
85	D	93.5	Very high	94.2	Very high	19 Å²	19	39.2 Å²	39.2	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.7	164.9	-165.4	-68.6	0	0	0	107.9	R71 E87 E88 V89 K90 V92	R71-D85 IonicContact CZ-OD2 2.73Å; R71-D85 IonicContact NE-OD2 2.86Å; R71-D85 IonicContact NH2-OD2 2.78Å; R71-D85 PolarHBondContact NH2-OD2 2.93Å; D85-E87 PolarHBondContact OD1-N 3.24Å; D85-E88 HydrophobicContact CB-CB 4.25Å; D85-E88 PolarHBondContact OD1-N 3.26Å; D85-V89 WeakPolarHBondContact O-CA 3.42Å; D85-V89 PolarHBondContact O-N 3.12Å; D85-K90 PolarHBondContact N-O 3.32Å; D85-K90 PolarHBondContact O-N 3.47Å; D85-V92 HydrophobicContact CB-CG2 3.59Å
86	L	92.8	Very high	93.9	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-19.8	-174.1	-58.4	-175.3	0	0	0	112.4	L41 L51 L53 F65 D70 V72 Y442 F446	L41-L86 HydrophobicContact CD1-CD1 3.92Å; L41-L86 HydrophobicContact CD1-CD2 3.73Å; L41-L86 HydrophobicContact CD1-CG 4.41Å; L51-L86 HydrophobicContact CD2-CD2 4.31Å; L53-L86 HydrophobicContact CD1-CD2 4.14Å; F65-L86 HydrophobicContact CD1-CD1 4.23Å; F65-L86 HydrophobicContact CE1-CD1 4.01Å; D70-L86 WeakPolarHBondContact O-CB 3.42Å; D70-L86 PolarHBondContact O-N 3.21Å; V72-L86 HydrophobicContact CB-CD2 4.4Å; V72-L86 HydrophobicContact CG1-CD2 3.77Å; L86-Y442 VanDerWaalsContact O-CE2 3.28Å; L86-Y442 WeakPolarHBondContact O-CE2 3.11Å; L86-Y442 PolarHBondContact O-OH 3.41Å; L86-F446 HydrophobicContact CB-CD1 3.82Å; L86-F446 HydrophobicContact CB-CE1 4.04Å; L86-F446 HydrophobicContact CB-CG 4.35Å; L86-F446 HydrophobicContact CD1-CD1 4.21Å; L86-F446 HydrophobicContact CD1-CE1 3.58Å; L86-F446 HydrophobicContact CD1-CZ 4.1Å; L86-F446 HydrophobicContact CG-CE1 4.44Å
87	E	90.3	Very high	93.6	Very high	108 Å²	108	45.5 Å²	45.5	51%	0.505	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-44.4	173.7	-174.6	174.4	-168.6	0	0	110.7	D85 Y442 K447	D85-E87 PolarHBondContact OD1-N 3.24Å; E87-Y442 PolarHBondContact O-OH 2.82Å; E87-K447 HydrophobicContact CG-CG 4.28Å; E87-K447 WeakPolarHBondContact O-CE 3.44Å; E87-K447 PolarHBondContact O-NZ 2.85Å
88	E	88.9	Confident	93.6	Very high	116 Å²	116	41.7 Å²	41.7	54%	0.542	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-19.7	175	-72.9	-156.5	-152.3	0	0	114.1	D85 K90	D85-E88 HydrophobicContact CB-CB 4.25Å; D85-E88 PolarHBondContact OD1-N 3.26Å; E88-K90 HydrophobicContact CB-CB 4.4Å; E88-K90 HydrophobicContact CB-CD 4.27Å; E88-K90 HydrophobicContact CB-CG 4.38Å; E88-K90 IonicContact OE2-NZ 2.74Å; E88-K90 PolarHBondContact OE2-NZ 2.89Å
89	V	90.3	Very high	93.6	Very high	22 Å²	22	44.7 Å²	44.7	13%	0.133	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	46	-173.1	-155.8	0	0	0	0	112.3	L51 L53 D85 A434 I436 Y442	L51-V89 HydrophobicContact CD1-CG1 3.51Å; L51-V89 HydrophobicContact CD2-CG1 4.09Å; L51-V89 HydrophobicContact CG-CG1 4.41Å; L53-V89 HydrophobicContact CD2-CG1 4.02Å; D85-V89 WeakPolarHBondContact O-CA 3.42Å; D85-V89 PolarHBondContact O-N 3.12Å; V89-A434 HydrophobicContact CG1-CB 3.39Å; V89-I436 HydrophobicContact CG2-CD1 4.31Å; V89-Y442 HydrophobicContact CG2-CE1 4.41Å; V89-Y442 HydrophobicContact CG2-CE2 3.79Å; V89-Y442 WeakPolarHBondContact CG2-OH 3.22Å
90	K	92.1	Very high	93.7	Very high	119 Å²	119	46 Å²	46	52%	0.517	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.5	-175.3	-69.6	175.1	-154.7	154.7	0	112.5	W84 D85 E88 V92	W84-K90 CarbonylContact C-O 3.56Å; W84-K90 VanDerWaalsContact CA-O 3.24Å; W84-K90 WeakPolarHBondContact CA-O 3.36Å; D85-K90 PolarHBondContact N-O 3.32Å; D85-K90 PolarHBondContact O-N 3.47Å; E88-K90 HydrophobicContact CB-CB 4.4Å; E88-K90 HydrophobicContact CB-CD 4.27Å; E88-K90 HydrophobicContact CB-CG 4.38Å; E88-K90 IonicContact OE2-NZ 2.74Å; E88-K90 PolarHBondContact OE2-NZ 2.89Å; K90-V92 PolarHBondContact O-N 3.13Å
91	I	92.6	Very high	93.7	Very high	40 Å²	40	45.3 Å²	45.3	21%	0.205	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	110.9	170.9	-55.2	-170.1	0	0	0	109.3	I83 W84 R93 N432	I83-I91 CarbonylContact O-C 3.34Å; W84-I91 HydrophobicContact CG-CG1 4.32Å; I91-R93 WeakPolarHBondContact CG2-O 3.24Å; I91-N432 WeakPolarHBondContact CD1-OD1 3.15Å
92	V	92.5	Very high	93.8	Very high	36 Å²	36	45.3 Å²	45.3	22%	0.218	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	-45.4	173.7	-172.6	0	0	0	0	109.7	I83 D85 K90 V128	I83-V92 HydrophobicContact CG2-CB 4.5Å; I83-V92 PolarHBondContact O-N 3.18Å; D85-V92 HydrophobicContact CB-CG2 3.59Å; K90-V92 PolarHBondContact O-N 3.13Å; V92-V128 HydrophobicContact CG1-CG1 4.07Å
93	R	92.9	Very high	93.9	Very high	77 Å²	77	46.9 Å²	46.9	29%	0.291	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	145.2	179.6	-68.3	-62.4	174.4	-109	5.6	111.8	R82 I83 I91 L95 V128 S129 R130	R82-R93 WeakPolarHBondContact CA-O 3.34Å; I83-R93 PolarHBondContact N-O 2.71Å; I83-R93 PolarHBondContact O-N 3.42Å; I91-R93 WeakPolarHBondContact CG2-O 3.24Å; R93-L95 HydrophobicContact CB-CD2 4.26Å; R93-L95 HydrophobicContact CB-CG 4.28Å; R93-V128 HydrophobicContact CG-CG1 4.08Å; R93-V128 WeakPolarHBondContact CG-O 3.32Å; R93-V128 PolarHBondContact NE-O 2.82Å; R93-S129 PolarHBondContact NH2-O 2.88Å; R93-R130 PolarHBondContact NE-O 3.32Å
94	A	93.9	Very high	93.9	Very high	63 Å²	63	47.3 Å²	47.3	52%	0.521	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.3	155.3	0	0	0	0	0	107.4	R82	R82-A94 HydrophobicContact CG-CB 4.05Å
95	L	93.8	Very high	94	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.052	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.7	-175.3	-54.7	167	0	0	0	107.8	S80 V81 I83 R93 W126	S80-L95 WeakPolarHBondContact CA-O 3.43Å; V81-L95 HydrophobicContact CB-CB 4.2Å; V81-L95 HydrophobicContact CB-CD1 4.41Å; V81-L95 HydrophobicContact CG1-CD1 4.43Å; V81-L95 PolarHBondContact N-O 2.86Å; V81-L95 PolarHBondContact O-N 2.72Å; I83-L95 HydrophobicContact CD1-CD1 3.94Å; R93-L95 HydrophobicContact CB-CD2 4.26Å; R93-L95 HydrophobicContact CB-CG 4.28Å; L95-W126 HydrophobicContact CB-CD2 4.25Å; L95-W126 HydrophobicContact CB-CE3 3.89Å; L95-W126 HydrophobicContact CB-CH2 4.49Å; L95-W126 HydrophobicContact CB-CZ3 4.02Å; L95-W126 HydrophobicContact CD1-CB 3.73Å; L95-W126 HydrophobicContact CD1-CD2 3.97Å; L95-W126 HydrophobicContact CD1-CE3 4.16Å; L95-W126 HydrophobicContact CD1-CG 3.79Å; L95-W126 HydrophobicContact CD2-CE3 4.08Å; L95-W126 HydrophobicContact CG-CE3 4.26Å
96	S	92.1	Very high	94.2	Very high	97 Å²	97	47.4 Å²	47.4	68%	0.678	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.6	-179.4	-177.7	0	0	0	0	109.6	W126	S96-W126 WeakPolarHBondContact O-CH2 3.19Å
97	G	91.2	Very high	94.4	Very high	36 Å²	36	48.6 Å²	48.6	37%	0.371	27%	0.271	S	S	.	.			trans	147.4	-4.3	177.7	0	0	0	0	0	116	K124	G97-K124 WeakPolarHBondContact O-CE 3.37Å; G97-K124 PolarHBondContact O-NZ 2.97Å; G97-K124 VanDerWaalsContact O-NZ 3.16Å
98	H	96.5	Very high	94.6	Very high	9 Å²	9	44.7 Å²	44.7	4%	0.042	25%	0.252	C	S	.	.			trans	-80	153	156.8	-81.3	-68.9	0	0	0	109.6	S116 S118 D120 L122	H98-S116 PolarHBondContact CD2-OG 2.91Å; H98-S116 VanDerWaalsContact CD2-OG 3.28Å; H98-S116 PolarHBondContact NE2-OG 3.32Å; H98-S118 VanDerWaalsContact CE1-CB 3.47Å; H98-S118 WeakPolarHBondContact CE1-CB 3.36Å; H98-S118 WeakPolarHBondContact ND1-CB 3.25Å; H98-D120 VanDerWaalsContact CA-OD2 3.24Å; H98-D120 WeakPolarHBondContact CA-OD2 3.46Å; H98-D120 WeakPolarHBondContact CB-OD2 3.46Å; H98-D120 IonicContact CE1-OD1 3.56Å; H98-D120 IonicContact CG-OD2 3.48Å; H98-D120 VanDerWaalsContact ND1-CG 3.28Å; H98-D120 IonicContact ND1-OD1 2.99Å; H98-D120 PolarHBondContact ND1-OD1 3.2Å; H98-D120 IonicContact ND1-OD2 2.83Å; H98-D120 PolarHBondContact ND1-OD2 3Å; H98-L122 PolarHBondContact CE1-O 3.23Å
99	T	96.3	Very high	94.7	Very high	123 Å²	123	41.4 Å²	41.4	76%	0.755	24%	0.241	S	C	*	.	S	Bend	trans	-106	5	-178	57.6	0	0	0	0	113.9	D120	T99-D120 PolarHBondContact N-OD2 3.03Å; T99-D120 WeakPolarHBondContact OG1-CB 3.42Å
100	S	97.1	Very high	94.6	Very high	28 Å²	28	48.4 Å²	48.4	20%	0.196	27%	0.266	C	S	.	.	S	Bend	trans	-158.4	-175.5	178.6	70.5	0	0	0	0	111.2	L77 G79 I102 S118 M119 D120	L77-S100 CarbonylContact O-C 3.54Å; G79-S100 WeakPolarHBondContact CA-O 3.3Å; G79-S100 PolarHBondContact N-O 3.25Å; S100-I102 PolarHBondContact O-N 2.68Å; S100-S118 PolarHBondContact O-OG 3.36Å; S100-S118 PolarHBondContact OG-OG 3.18Å; S100-M119 WeakPolarHBondContact OG-CB 3.29Å; S100-D120 PolarHBondContact OG-N 3.44Å
101	A	97.4	Very high	94.2	Very high	5 Å²	5	44 Å²	44	4%	0.041	25%	0.254	C	S	.	.			trans	-50.4	136.5	-176.3	0	0	0	0	0	113.2	E61 L77 S118 M119	E61-A101 HydrophobicContact CB-CB 4.37Å; E61-A101 HydrophobicContact CG-CB 4.1Å; L77-A101 HydrophobicContact CD1-CB 4.09Å; L77-A101 WeakPolarHBondContact O-CA 3.49Å; L77-A101 PolarHBondContact O-N 3.44Å; A101-S118 CarbonylContact O-C 3.6Å; A101-S118 WeakPolarHBondContact O-CA 3.37Å; A101-S118 VanDerWaalsContact O-CB 3.3Å; A101-S118 WeakPolarHBondContact O-CB 3.31Å; A101-S118 PolarHBondContact O-OG 2.99Å; A101-M119 HydrophobicContact CB-CE 3.7Å; A101-M119 HydrophobicContact CB-CG 4.19Å; A101-M119 HydrophobicContact CB-SD 4.18Å; A101-M119 PolarHBondContact O-N 3.34Å
102	I	98.2	Very high	94	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	114.5	168.7	-66	139.3	0	0	0	107.2	E61 A62 S76 G79 S80 V81 S100 L105 G117	E61-I102 CarbonylContact C-O 3.47Å; E61-I102 WeakPolarHBondContact CB-O 3.45Å; A62-I102 HydrophobicContact CB-CG2 4.19Å; A62-I102 VanDerWaalsContact CB-O 3.27Å; A62-I102 WeakPolarHBondContact CB-O 3.42Å; S76-I102 PolarHBondContact O-N 2.89Å; G79-I102 VanDerWaalsContact C-CD1 3.4Å; S80-I102 VanDerWaalsContact O-CD1 3.22Å; S80-I102 WeakPolarHBondContact O-CD1 3.46Å; V81-I102 HydrophobicContact CG2-CD1 3.5Å; V81-I102 VanDerWaalsContact CG2-CD1 3.5Å; V81-I102 HydrophobicContact CG2-CG1 4.31Å; S100-I102 PolarHBondContact O-N 2.68Å; I102-L105 HydrophobicContact CG2-CD1 4.37Å; I102-L105 HydrophobicContact CG2-CD2 4.1Å; I102-L105 HydrophobicContact CG2-CG 3.88Å; I102-G117 WeakPolarHBondContact CA-O 3.2Å
103	K	97.4	Very high	94.1	Very high	71 Å²	71	48.1 Å²	48.1	31%	0.309	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-20.5	-179.8	-55.1	-172.4	82.1	176.2	0	112.8	G117 M119 N145 E161	K103-G117 PolarHBondContact N-O 3.17Å; K103-M119 HydrophobicContact CD-CG 3.78Å; K103-M119 HydrophobicContact CD-SD 4.48Å; K103-M119 HydrophobicContact CG-CG 3.85Å; K103-N145 PolarHBondContact NZ-OD1 2.65Å; K103-E161 IonicContact NZ-OE1 2.77Å; K103-E161 PolarHBondContact NZ-OE1 2.61Å
104	T	97.5	Very high	94.3	Very high	10 Å²	10	44.5 Å²	44.5	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	141.9	-172.6	-172.8	0	0	0	0	111.3	S116 G117 V144 M146 I147	T104-S116 WeakPolarHBondContact O-CA 3.36Å; T104-G117 PolarHBondContact N-O 3.47Å; T104-G117 PolarHBondContact O-N 3.35Å; T104-V144 HydrophobicContact CG2-CG1 4.24Å; T104-M146 WeakPolarHBondContact OG1-CA 3.41Å; T104-I147 HydrophobicContact CG2-CB 3.81Å; T104-I147 HydrophobicContact CG2-CG2 3.72Å; T104-I147 WeakPolarHBondContact OG1-CG2 3.36Å; T104-I147 PolarHBondContact OG1-N 2.77Å
105	L	97.6	Very high	94.4	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.4	174.9	-75.1	164.9	0	0	0	109	A62 E64 A73 A74 V81 I102 V114 A115	A62-L105 HydrophobicContact CB-CD1 4.35Å; A62-L105 HydrophobicContact CB-CG 4.49Å; E64-L105 HydrophobicContact CB-CB 4.2Å; A73-L105 HydrophobicContact CB-CD1 4.02Å; A74-L105 VanDerWaalsContact C-CD1 3.49Å; V81-L105 HydrophobicContact CG1-CD1 4.31Å; V81-L105 HydrophobicContact CG1-CD2 3.91Å; V81-L105 HydrophobicContact CG2-CD2 4.04Å; I102-L105 HydrophobicContact CG2-CD1 4.37Å; I102-L105 HydrophobicContact CG2-CD2 4.1Å; I102-L105 HydrophobicContact CG2-CG 3.88Å; L105-V114 HydrophobicContact CD2-CG1 3.89Å; L105-A115 WeakPolarHBondContact CA-O 3.36Å
106	D	97.6	Very high	94.6	Very high	21 Å²	21	41 Å²	41	11%	0.112	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	149.1	168.8	-159.2	39.3	0	0	0	110.6	V114 A115 I147 R148 F149	D106-V114 WeakPolarHBondContact O-CA 3.46Å; D106-A115 PolarHBondContact N-O 3.22Å; D106-A115 PolarHBondContact O-N 2.95Å; D106-I147 HydrophobicContact CB-CG2 3.96Å; D106-R148 IonicContact OD1-CZ 3.29Å; D106-R148 IonicContact OD1-NH1 3.84Å; D106-R148 PolarHBondContact OD1-NH1 3.03Å; D106-R148 VanDerWaalsContact OD2-CA 3.29Å; D106-R148 WeakPolarHBondContact OD2-CA 3.48Å; D106-F149 HydrophobicContact CB-CD2 4Å; D106-F149 HydrophobicContact CB-CE2 4.42Å; D106-F149 WeakPolarHBondContact O-CE2 3.34Å; D106-F149 WeakPolarHBondContact OD2-CD2 3.39Å; D106-F149 PolarHBondContact OD2-N 2.97Å
107	F	96.4	Very high	94.9	Very high	26 Å²	26	36.4 Å²	36.4	11%	0.114	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	139.1	173.8	-81	-92.8	0	0	0	110.3	E64 F65 R71 A73 I83 V114 F149	E64-F107 WeakPolarHBondContact O-CE2 3.41Å; F65-F107 WeakPolarHBondContact O-CD2 3.49Å; R71-F107 HydrophobicContact CB-CE1 4.4Å; R71-F107 HydrophobicContact CB-CZ 4.27Å; A73-F107 HydrophobicContact CB-CE2 3.52Å; A73-F107 HydrophobicContact CB-CZ 3.6Å; I83-F107 HydrophobicContact CG2-CE1 4.35Å; I83-F107 HydrophobicContact CG2-CZ 4.22Å; F107-V114 HydrophobicContact CD1-CG2 3.51Å; F107-V114 HydrophobicContact CE1-CG2 3.47Å; F107-V114 VanDerWaalsContact CE1-CG2 3.47Å; F107-V114 HydrophobicContact CG-CG2 4.12Å; F107-V114 HydrophobicContact CZ-CG2 4.06Å; F107-F149 VanDerWaalsContact C-CD2 3.43Å; F107-F149 WeakPolarHBondContact O-CD2 3.08Å
108	H	95.2	Very high	95.2	Very high	26 Å²	26	34.7 Å²	34.7	12%	0.12	18%	0.181	C	C	.	.			trans	-68.7	137	173	178.8	-59.6	0	0	0	110.3	Y110 G111 F113 F149 G153	H108-Y110 PolarHBondContact ND1-N 2.7Å; H108-Y110 PolarHBondContact O-N 3.31Å; H108-G111 PolarHBondContact CE1-N 2.82Å; H108-G111 PolarHBondContact ND1-N 3.47Å; H108-F113 HydrophobicContact CB-CB 3.78Å; H108-F113 HydrophobicContact CB-CD2 4.35Å; H108-F113 WeakPolarHBondContact CB-O 3.43Å; H108-F113 AromaticContact CD2-CD2 3.78Å; H108-F113 PolarHBondContact N-O 3.05Å; H108-F149 HydrophobicContact CB-CD1 4.05Å; H108-F149 HydrophobicContact CB-CD2 4.15Å; H108-F149 HydrophobicContact CB-CE1 3.81Å; H108-F149 HydrophobicContact CB-CE2 3.93Å; H108-F149 HydrophobicContact CB-CG 4.21Å; H108-F149 HydrophobicContact CB-CZ 3.75Å; H108-F149 AromaticContact CD2-CD1 3.8Å; H108-F149 AromaticContact CD2-CE1 3.68Å; H108-G153 PolarHBondContact NE2-O 3.4Å
109	P	90.4	Very high	95.3	Very high	46 Å²	46	38.3 Å²	38.3	30%	0.299	20%	0.2	S	C	.	.	S	Bend	trans	-63.2	-38	-172.1	20.8	-33	0	0	0	115.5
110	Y	87.9	Confident	95.3	Very high	170 Å²	170	33.7 Å²	33.7	67%	0.667	17%	0.17	S	C	*	.	S	Bend	trans	-113.1	-29.4	-174.1	-47.9	-67	0	0	0	116.5	H108 P151	H108-Y110 PolarHBondContact ND1-N 2.7Å; H108-Y110 PolarHBondContact O-N 3.31Å; Y110-P151 VanDerWaalsContact CE2-O 3.28Å; Y110-P151 WeakPolarHBondContact CE2-O 3.34Å; Y110-P151 PolarHBondContact OH-O 3.02Å
111	G	83	Confident	95.3	Very high	25 Å²	25	34.4 Å²	34.4	26%	0.258	17%	0.174	S	C	.	.	S	Bend	trans	-109.1	162.6	-176.8	0	0	0	0	0	112.9	H108 F113	H108-G111 PolarHBondContact CE1-N 2.82Å; H108-G111 PolarHBondContact ND1-N 3.47Å; G111-F113 PolarHBondContact O-N 3.36Å
112	N	90.1	Very high	95.4	Very high	100 Å²	100	35.1 Å²	35.1	54%	0.535	18%	0.176	S	C	.	.	S	Bend	trans	-78.4	56.5	-179.7	-73.1	-32.3	0	0	0	112.3	V128	N112-V128 HydrophobicContact CB-CB 4.37Å; N112-V128 WeakPolarHBondContact O-CB 3.21Å; N112-V128 WeakPolarHBondContact O-CG2 3.49Å; N112-V128 PolarHBondContact O-N 2.84Å
113	F	94.1	Very high	95.3	Very high	64 Å²	64	35.1 Å²	35.1	28%	0.281	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	148.2	178.3	-51.7	-62.7	0	0	0	111.8	H108 G111 L125 W126 D127 I134 F149	H108-F113 HydrophobicContact CB-CB 3.78Å; H108-F113 HydrophobicContact CB-CD2 4.35Å; H108-F113 WeakPolarHBondContact CB-O 3.43Å; H108-F113 AromaticContact CD2-CD2 3.78Å; H108-F113 PolarHBondContact N-O 3.05Å; G111-F113 PolarHBondContact O-N 3.36Å; F113-L125 HydrophobicContact CB-CD1 4.01Å; F113-W126 VanDerWaalsContact CA-O 3.26Å; F113-W126 WeakPolarHBondContact CA-O 3.49Å; F113-D127 HydrophobicContact CD1-CB 4.41Å; F113-D127 HydrophobicContact CE1-CB 4.4Å; F113-I134 HydrophobicContact CD1-CD1 3.54Å; F113-I134 HydrophobicContact CE1-CD1 3.48Å; F113-I134 VanDerWaalsContact CE1-CD1 3.48Å; F113-F149 HydrophobicContact CB-CZ 4.47Å
114	V	96.3	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.6	171.4	169.4	0	0	0	0	108.1	I83 L105 D106 F107 W126 V128	I83-V114 HydrophobicContact CD1-CB 4.37Å; I83-V114 HydrophobicContact CD1-CG2 3.77Å; L105-V114 HydrophobicContact CD2-CG1 3.89Å; D106-V114 WeakPolarHBondContact O-CA 3.46Å; F107-V114 HydrophobicContact CD1-CG2 3.51Å; F107-V114 HydrophobicContact CE1-CG2 3.47Å; F107-V114 VanDerWaalsContact CE1-CG2 3.47Å; F107-V114 HydrophobicContact CG-CG2 4.12Å; F107-V114 HydrophobicContact CZ-CG2 4.06Å; V114-W126 PolarHBondContact N-O 3.19Å; V114-W126 VanDerWaalsContact N-O 3.09Å; V114-W126 PolarHBondContact O-N 2.74Å; V114-V128 HydrophobicContact CB-CG2 4.46Å; V114-V128 HydrophobicContact CG2-CG2 3.81Å
115	A	97.4	Very high	95.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.2	170.8	0	0	0	0	0	110.3	L105 D106 K124 I147 F149 I156	L105-A115 WeakPolarHBondContact CA-O 3.36Å; D106-A115 PolarHBondContact N-O 3.22Å; D106-A115 PolarHBondContact O-N 2.95Å; A115-K124 CarbonylContact C-O 3.57Å; A115-K124 VanDerWaalsContact CA-O 3.29Å; A115-K124 WeakPolarHBondContact CA-O 3.46Å; A115-I147 HydrophobicContact CB-CD1 3.55Å; A115-I147 HydrophobicContact CB-CG1 4.28Å; A115-F149 HydrophobicContact CB-CD2 4.45Å; A115-F149 HydrophobicContact CB-CE2 3.53Å; A115-F149 HydrophobicContact CB-CZ 3.61Å; A115-I156 HydrophobicContact CB-CD1 3.61Å; A115-I156 HydrophobicContact CB-CG1 4.37Å
116	S	97.9	Very high	95.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.8	178.1	58.8	0	0	0	0	111.7	H98 T104 V123 K124 W126	H98-S116 PolarHBondContact CD2-OG 2.91Å; H98-S116 VanDerWaalsContact CD2-OG 3.28Å; H98-S116 PolarHBondContact NE2-OG 3.32Å; T104-S116 WeakPolarHBondContact O-CA 3.36Å; S116-V123 WeakPolarHBondContact O-CA 3.42Å; S116-K124 PolarHBondContact N-O 3.5Å; S116-K124 PolarHBondContact O-N 3.45Å; S116-W126 PolarHBondContact OG-NE1 2.98Å
117	G	97.8	Very high	94.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.4	168.8	0	0	0	0	0	110.7	I102 K103 T104	I102-G117 WeakPolarHBondContact CA-O 3.2Å; K103-G117 PolarHBondContact N-O 3.17Å; T104-G117 PolarHBondContact N-O 3.47Å; T104-G117 PolarHBondContact O-N 3.35Å
118	S	98.1	Very high	94.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	165.9	-170.2	173.1	0	0	0	0	112.5	H98 S100 A101 D120 T121 L122 V144	H98-S118 VanDerWaalsContact CE1-CB 3.47Å; H98-S118 WeakPolarHBondContact CE1-CB 3.36Å; H98-S118 WeakPolarHBondContact ND1-CB 3.25Å; S100-S118 PolarHBondContact O-OG 3.36Å; S100-S118 PolarHBondContact OG-OG 3.18Å; A101-S118 CarbonylContact O-C 3.6Å; A101-S118 WeakPolarHBondContact O-CA 3.37Å; A101-S118 VanDerWaalsContact O-CB 3.3Å; A101-S118 WeakPolarHBondContact O-CB 3.31Å; A101-S118 PolarHBondContact O-OG 2.99Å; S118-D120 VanDerWaalsContact CB-OD1 3.3Å; S118-D120 WeakPolarHBondContact CB-OD1 3.43Å; S118-D120 PolarHBondContact O-N 3.19Å; S118-D120 PolarHBondContact OG-N 3.27Å; S118-D120 PolarHBondContact OG-OD1 3.32Å; S118-T121 PolarHBondContact O-N 3.16Å; S118-L122 PolarHBondContact N-O 2.84Å; S118-V144 PolarHBondContact O-N 3.48Å
119	M	97.7	Very high	94.2	Very high	86 Å²	86	32.8 Å²	32.8	42%	0.424	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.8	168.2	-58.7	-166.1	-41.8	0	0	113.3	S100 A101 K103 T121	S100-M119 WeakPolarHBondContact OG-CB 3.29Å; A101-M119 HydrophobicContact CB-CE 3.7Å; A101-M119 HydrophobicContact CB-CG 4.19Å; A101-M119 HydrophobicContact CB-SD 4.18Å; A101-M119 PolarHBondContact O-N 3.34Å; K103-M119 HydrophobicContact CD-CG 3.78Å; K103-M119 HydrophobicContact CD-SD 4.48Å; K103-M119 HydrophobicContact CG-CG 3.85Å; M119-T121 PolarHBondContact O-N 3.23Å
120	D	97	Very high	93.6	Very high	25 Å²	25	39 Å²	39	13%	0.134	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	9.7	173.3	70.2	10.8	0	0	0	113.4	H98 T99 S100 S118 L122	H98-D120 VanDerWaalsContact CA-OD2 3.24Å; H98-D120 WeakPolarHBondContact CA-OD2 3.46Å; H98-D120 WeakPolarHBondContact CB-OD2 3.46Å; H98-D120 IonicContact CE1-OD1 3.56Å; H98-D120 IonicContact CG-OD2 3.48Å; H98-D120 VanDerWaalsContact ND1-CG 3.28Å; H98-D120 IonicContact ND1-OD1 2.99Å; H98-D120 PolarHBondContact ND1-OD1 3.2Å; H98-D120 IonicContact ND1-OD2 2.83Å; H98-D120 PolarHBondContact ND1-OD2 3Å; T99-D120 PolarHBondContact N-OD2 3.03Å; T99-D120 WeakPolarHBondContact OG1-CB 3.42Å; S100-D120 PolarHBondContact OG-N 3.44Å; S118-D120 VanDerWaalsContact CB-OD1 3.3Å; S118-D120 WeakPolarHBondContact CB-OD1 3.43Å; S118-D120 PolarHBondContact O-N 3.19Å; S118-D120 PolarHBondContact OG-N 3.27Å; S118-D120 PolarHBondContact OG-OD1 3.32Å; D120-L122 PolarHBondContact O-N 3.4Å; D120-L122 VanDerWaalsContact O-N 3.12Å; D120-L122 WeakPolarHBondContact OD1-CB 3.29Å; D120-L122 WeakPolarHBondContact OD1-CG 3.44Å; D120-L122 PolarHBondContact OD1-N 3.09Å
121	T	97.3	Very high	92.6	Very high	44 Å²	44	40.3 Å²	40.3	27%	0.27	20%	0.2	S	C	.	.	S	Bend	trans	60.8	6.6	-176	93.8	0	0	0	0	115.2	S118 M119 H140 G142	S118-T121 PolarHBondContact O-N 3.16Å; M119-T121 PolarHBondContact O-N 3.23Å; T121-H140 VanDerWaalsContact CB-O 3.32Å; T121-H140 WeakPolarHBondContact CB-O 3.46Å; T121-H140 PolarHBondContact OG1-O 3.16Å; T121-G142 VanDerWaalsContact CB-O 3.31Å; T121-G142 WeakPolarHBondContact CB-O 3.32Å; T121-G142 WeakPolarHBondContact CG2-O 3.33Å
122	L	97.6	Very high	92.5	Very high	19 Å²	19	40.4 Å²	40.4	10%	0.099	20%	0.201	C	C	.	.			trans	-91	151.4	178.3	-50.9	178.2	0	0	0	111.6	H98 S118 D120 T136 R138	H98-L122 PolarHBondContact CE1-O 3.23Å; S118-L122 PolarHBondContact N-O 2.84Å; D120-L122 PolarHBondContact O-N 3.4Å; D120-L122 VanDerWaalsContact O-N 3.12Å; D120-L122 WeakPolarHBondContact OD1-CB 3.29Å; D120-L122 WeakPolarHBondContact OD1-CG 3.44Å; D120-L122 PolarHBondContact OD1-N 3.09Å; L122-T136 HydrophobicContact CB-CG2 4.25Å; L122-T136 HydrophobicContact CD1-CG2 3.9Å; L122-T136 HydrophobicContact CD2-CG2 4.19Å; L122-T136 HydrophobicContact CG-CG2 4.35Å; L122-R138 HydrophobicContact CD2-CG 3.84Å
123	V	97.5	Very high	92.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.6	160.1	169.8	0	0	0	0	108.4	S116 T136 Y137 V144 I147	S116-V123 WeakPolarHBondContact O-CA 3.42Å; V123-T136 CarbonylContact O-C 3.59Å; V123-Y137 HydrophobicContact CB-CD2 4.47Å; V123-Y137 HydrophobicContact CG1-CD2 4.01Å; V123-Y137 PolarHBondContact N-O 2.96Å; V123-Y137 PolarHBondContact O-N 3.16Å; V123-V144 HydrophobicContact CG2-CG1 4Å; V123-V144 HydrophobicContact CG2-CG2 3.93Å; V123-I147 HydrophobicContact CB-CD1 4.37Å; V123-I147 HydrophobicContact CG1-CD1 3.36Å; V123-I147 HydrophobicContact CG2-CD1 4.19Å
124	K	96.6	Very high	92.5	Very high	18 Å²	18	38.4 Å²	38.4	8%	0.078	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.8	177.5	-69.3	178.6	-173	-87.9	0	111.2	G97 A115 S116 W126 N135 T136	G97-K124 WeakPolarHBondContact O-CE 3.37Å; G97-K124 PolarHBondContact O-NZ 2.97Å; G97-K124 VanDerWaalsContact O-NZ 3.16Å; A115-K124 CarbonylContact C-O 3.57Å; A115-K124 VanDerWaalsContact CA-O 3.29Å; A115-K124 WeakPolarHBondContact CA-O 3.46Å; S116-K124 PolarHBondContact N-O 3.5Å; S116-K124 PolarHBondContact O-N 3.45Å; K124-W126 HydrophobicContact CB-CZ2 3.78Å; K124-W126 HydrophobicContact CD-CH2 3.97Å; K124-W126 HydrophobicContact CD-CZ2 3.53Å; K124-W126 HydrophobicContact CG-CZ2 4.29Å; K124-N135 WeakPolarHBondContact CA-O 3.49Å; K124-T136 HydrophobicContact CG-CG2 4.2Å; K124-T136 PolarHBondContact NZ-OG1 3.41Å
125	L	96.4	Very high	92.4	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.7	171.4	177.1	70.7	0	0	0	108.9	F113 C133 I134 N135 Y137 F149 I156 L170	F113-L125 HydrophobicContact CB-CD1 4.01Å; L125-C133 CarbonylContact O-C 3.6Å; L125-I134 HydrophobicContact CD2-CB 4.14Å; L125-I134 HydrophobicContact CD2-CD1 4.05Å; L125-I134 HydrophobicContact CD2-CG2 4.35Å; L125-I134 HydrophobicContact CG-CB 4.27Å; L125-I134 HydrophobicContact CG-CD1 4.07Å; L125-I134 HydrophobicContact CG-CG1 4.47Å; L125-I134 PolarHBondContact O-N 2.95Å; L125-N135 HydrophobicContact CB-CB 4.35Å; L125-N135 PolarHBondContact N-O 3.05Å; L125-Y137 HydrophobicContact CB-CE2 4.02Å; L125-F149 HydrophobicContact CD1-CE1 4.11Å; L125-F149 HydrophobicContact CD1-CZ 3.8Å; L125-I156 HydrophobicContact CD1-CD1 4.24Å; L125-L170 HydrophobicContact CD1-CD2 3.85Å; L125-L170 HydrophobicContact CD2-CD2 3.62Å; L125-L170 HydrophobicContact CG-CD2 4.32Å
126	W	95.3	Very high	92.3	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.9	-175.7	-52.2	92.9	0	0	0	110.9	L95 S96 F113 V114 S116 K124 C133	L95-W126 HydrophobicContact CB-CD2 4.25Å; L95-W126 HydrophobicContact CB-CE3 3.89Å; L95-W126 HydrophobicContact CB-CH2 4.49Å; L95-W126 HydrophobicContact CB-CZ3 4.02Å; L95-W126 HydrophobicContact CD1-CB 3.73Å; L95-W126 HydrophobicContact CD1-CD2 3.97Å; L95-W126 HydrophobicContact CD1-CE3 4.16Å; L95-W126 HydrophobicContact CD1-CG 3.79Å; L95-W126 HydrophobicContact CD2-CE3 4.08Å; L95-W126 HydrophobicContact CG-CE3 4.26Å; S96-W126 WeakPolarHBondContact O-CH2 3.19Å; F113-W126 VanDerWaalsContact CA-O 3.26Å; F113-W126 WeakPolarHBondContact CA-O 3.49Å; V114-W126 PolarHBondContact N-O 3.19Å; V114-W126 VanDerWaalsContact N-O 3.09Å; V114-W126 PolarHBondContact O-N 2.74Å; S116-W126 PolarHBondContact OG-NE1 2.98Å; K124-W126 HydrophobicContact CB-CZ2 3.78Å; K124-W126 HydrophobicContact CD-CH2 3.97Å; K124-W126 HydrophobicContact CD-CZ2 3.53Å; K124-W126 HydrophobicContact CG-CZ2 4.29Å; W126-C133 HydrophobicContact CD2-CB 4.48Å; W126-C133 HydrophobicContact CE3-CB 3.8Å; W126-C133 HydrophobicContact CH2-CB 4.16Å; W126-C133 HydrophobicContact CZ3-CB 3.61Å
127	D	92.6	Very high	92.2	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.037	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.9	167.1	-166.8	-38.6	0	0	0	108.3	F113 S129 R130 G132 I134	F113-D127 HydrophobicContact CD1-CB 4.41Å; F113-D127 HydrophobicContact CE1-CB 4.4Å; D127-S129 VanDerWaalsContact C-N 3.32Å; D127-S129 WeakPolarHBondContact OD1-CA 3.13Å; D127-S129 WeakPolarHBondContact OD1-CB 3.45Å; D127-S129 PolarHBondContact OD1-N 3.15Å; D127-S129 PolarHBondContact OD1-OG 2.97Å; D127-R130 HydrophobicContact CB-CB 3.94Å; D127-R130 HydrophobicContact CB-CG 4.42Å; D127-R130 VanDerWaalsContact O-O 3.11Å; D127-R130 PolarHBondContact OD1-N 3.47Å; D127-R130 WeakPolarHBondContact OD2-CD 3.31Å; D127-R130 VanDerWaalsContact OD2-CG 3.31Å; D127-R130 WeakPolarHBondContact OD2-CG 3.37Å; D127-R130 IonicContact OD2-CZ 3.8Å; D127-R130 IonicContact OD2-NE 3.43Å; D127-R130 IonicContact OD2-NH1 3.38Å; D127-R130 PolarHBondContact OD2-NH1 3.01Å; D127-G132 PolarHBondContact N-O 3.09Å; D127-I134 HydrophobicContact CB-CD1 3.8Å; D127-I134 HydrophobicContact CB-CG1 3.85Å
128	V	89.3	Confident	92.1	Very high	6 Å²	6	52 Å²	52	4%	0.036	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-26.3	178.3	-173	0	0	0	0	110.9	I83 V92 R93 N112 V114	I83-V128 HydrophobicContact CD1-CB 4.35Å; I83-V128 HydrophobicContact CD1-CG1 3.94Å; I83-V128 HydrophobicContact CD1-CG2 3.58Å; I83-V128 HydrophobicContact CG2-CG1 4.41Å; V92-V128 HydrophobicContact CG1-CG1 4.07Å; R93-V128 HydrophobicContact CG-CG1 4.08Å; R93-V128 WeakPolarHBondContact CG-O 3.32Å; R93-V128 PolarHBondContact NE-O 2.82Å; N112-V128 HydrophobicContact CB-CB 4.37Å; N112-V128 WeakPolarHBondContact O-CB 3.21Å; N112-V128 WeakPolarHBondContact O-CG2 3.49Å; N112-V128 PolarHBondContact O-N 2.84Å; V114-V128 HydrophobicContact CB-CG2 4.46Å; V114-V128 HydrophobicContact CG2-CG2 3.81Å
129	S	86.9	Confident	91.8	Very high	66 Å²	66	53.5 Å²	53.5	46%	0.462	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-43.9	177.9	76.8	0	0	0	0	111.6	R93 D127	R93-S129 PolarHBondContact NH2-O 2.88Å; D127-S129 VanDerWaalsContact C-N 3.32Å; D127-S129 WeakPolarHBondContact OD1-CA 3.13Å; D127-S129 WeakPolarHBondContact OD1-CB 3.45Å; D127-S129 PolarHBondContact OD1-N 3.15Å; D127-S129 PolarHBondContact OD1-OG 2.97Å
130	R	79.2	Confident	91.8	Very high	177 Å²	177	49.8 Å²	49.8	67%	0.668	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	177.4	177.8	-58.8	179.8	178.9	142.5	-8.5	111.3	R93 D127	R93-R130 PolarHBondContact NE-O 3.32Å; D127-R130 HydrophobicContact CB-CB 3.94Å; D127-R130 HydrophobicContact CB-CG 4.42Å; D127-R130 VanDerWaalsContact O-O 3.11Å; D127-R130 PolarHBondContact OD1-N 3.47Å; D127-R130 WeakPolarHBondContact OD2-CD 3.31Å; D127-R130 VanDerWaalsContact OD2-CG 3.31Å; D127-R130 WeakPolarHBondContact OD2-CG 3.37Å; D127-R130 IonicContact OD2-CZ 3.8Å; D127-R130 IonicContact OD2-NE 3.43Å; D127-R130 IonicContact OD2-NH1 3.38Å; D127-R130 PolarHBondContact OD2-NH1 3.01Å
131	K	67	Low	91.7	Very high	197 Å²	197	54.3 Å²	54.3	86%	0.857	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	86.5	172.3	-73.9	-173.1	175.5	-176.5	0	109.5
132	G	80.8	Confident	91.7	Very high	28 Å²	28	52.9 Å²	52.9	29%	0.289	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	171.5	168.3	0	0	0	0	0	117.2	D127	D127-G132 PolarHBondContact N-O 3.09Å
133	C	91.7	Very high	91.7	Very high	49 Å²	49	52.7 Å²	52.7	33%	0.331	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	129.6	164.7	-170.3	0	0	0	0	108.7	L125 W126 N135 T136	L125-C133 CarbonylContact O-C 3.6Å; W126-C133 HydrophobicContact CD2-CB 4.48Å; W126-C133 HydrophobicContact CE3-CB 3.8Å; W126-C133 HydrophobicContact CH2-CB 4.16Å; W126-C133 HydrophobicContact CZ3-CB 3.61Å; C133-N135 PolarHBondContact SG-O 3.17Å; C133-T136 PolarHBondContact SG-OG1 2.86Å
134	I	92.1	Very high	91.7	Very high	73 Å²	73	52.6 Å²	52.6	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-59.4	172.7	-51.3	-179.9	0	0	0	109.2	F113 L125 D127	F113-I134 HydrophobicContact CD1-CD1 3.54Å; F113-I134 HydrophobicContact CE1-CD1 3.48Å; F113-I134 VanDerWaalsContact CE1-CD1 3.48Å; L125-I134 HydrophobicContact CD2-CB 4.14Å; L125-I134 HydrophobicContact CD2-CD1 4.05Å; L125-I134 HydrophobicContact CD2-CG2 4.35Å; L125-I134 HydrophobicContact CG-CB 4.27Å; L125-I134 HydrophobicContact CG-CD1 4.07Å; L125-I134 HydrophobicContact CG-CG1 4.47Å; L125-I134 PolarHBondContact O-N 2.95Å; D127-I134 HydrophobicContact CB-CD1 3.8Å; D127-I134 HydrophobicContact CB-CG1 3.85Å
135	N	93.9	Very high	91.7	Very high	48 Å²	48	53 Å²	53	26%	0.257	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	142.9	-176.6	-75.3	-25.8	0	0	0	110	K124 L125 C133 Y137	K124-N135 WeakPolarHBondContact CA-O 3.49Å; L125-N135 HydrophobicContact CB-CB 4.35Å; L125-N135 PolarHBondContact N-O 3.05Å; C133-N135 PolarHBondContact SG-O 3.17Å; N135-Y137 HydrophobicContact CB-CD2 4.3Å; N135-Y137 HydrophobicContact CB-CE1 4.43Å; N135-Y137 HydrophobicContact CB-CE2 3.71Å; N135-Y137 PolarHBondContact ND2-OH 3.34Å
136	T	95.5	Very high	91.7	Very high	50 Å²	50	53.3 Å²	53.3	31%	0.307	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109	165.7	-65.9	0	0	0	0	107.7	L122 V123 K124 C133	L122-T136 HydrophobicContact CB-CG2 4.25Å; L122-T136 HydrophobicContact CD1-CG2 3.9Å; L122-T136 HydrophobicContact CD2-CG2 4.19Å; L122-T136 HydrophobicContact CG-CG2 4.35Å; V123-T136 CarbonylContact O-C 3.59Å; K124-T136 HydrophobicContact CG-CG2 4.2Å; K124-T136 PolarHBondContact NZ-OG1 3.41Å; C133-T136 PolarHBondContact SG-OG1 2.86Å
137	Y	96.1	Very high	91.8	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.027	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.6	177.4	-57.1	-85.5	0	0	0	109.7	V123 L125 N135 W168 D169	V123-Y137 HydrophobicContact CB-CD2 4.47Å; V123-Y137 HydrophobicContact CG1-CD2 4.01Å; V123-Y137 PolarHBondContact N-O 2.96Å; V123-Y137 PolarHBondContact O-N 3.16Å; L125-Y137 HydrophobicContact CB-CE2 4.02Å; N135-Y137 HydrophobicContact CB-CD2 4.3Å; N135-Y137 HydrophobicContact CB-CE1 4.43Å; N135-Y137 HydrophobicContact CB-CE2 3.71Å; N135-Y137 PolarHBondContact ND2-OH 3.34Å; Y137-W168 HydrophobicContact CD1-CB 3.95Å; Y137-W168 AromaticContact CD1-CD2 3.75Å; Y137-W168 HydrophobicContact CD1-CD2 3.75Å; Y137-W168 AromaticContact CD1-CE3 3.36Å; Y137-W168 HydrophobicContact CD1-CE3 3.36Å; Y137-W168 HydrophobicContact CD1-CG 4.02Å; Y137-W168 HydrophobicContact CD1-CZ3 4.12Å; Y137-W168 HydrophobicContact CE1-CB 3.81Å; Y137-W168 HydrophobicContact CE1-CE3 4.23Å; Y137-W168 HydrophobicContact CE1-CG 4.38Å; Y137-W168 HydrophobicContact CG-CB 4.41Å; Y137-W168 AromaticContact CG-CD2 3.91Å; Y137-W168 HydrophobicContact CG-CD2 3.91Å; Y137-W168 AromaticContact CG-CE3 3.85Å; Y137-W168 HydrophobicContact CG-CE3 3.85Å; Y137-W168 HydrophobicContact CG-CG 4.17Å; Y137-W168 HydrophobicContact CG-CZ3 4.45Å; Y137-D169 PolarHBondContact OH-O 3.05Å; Y137-D169 VanDerWaalsContact OH-O 3.05Å
138	R	95.3	Very high	92	Very high	179 Å²	179	54.6 Å²	54.6	68%	0.675	29%	0.285	S	S	*	.			trans	-128.1	131.7	-175.7	-64.3	179.2	-179.9	-84.5	1.7	108.4	L122 W168	L122-R138 HydrophobicContact CD2-CG 3.84Å; R138-W168 WeakPolarHBondContact O-CH2 3.2Å
139	G	92.8	Very high	92.4	Very high	33 Å²	33	54.9 Å²	54.9	34%	0.34	29%	0.286	S	S	.	.			trans	167.7	-23.9	175	0	0	0	0	0	115.5	K166	G139-K166 VanDerWaalsContact C-CE 3.42Å; G139-K166 WeakPolarHBondContact O-CE 3.42Å; G139-K166 PolarHBondContact O-NZ 3.35Å
140	H	96.5	Very high	92.7	Very high	8 Å²	8	51.9 Å²	51.9	4%	0.037	27%	0.265	C	S	.	.			trans	-71.6	144.4	171.8	-77.4	-70.3	0	0	0	111.2	T121 V144 S158 D162 I164	T121-H140 VanDerWaalsContact CB-O 3.32Å; T121-H140 WeakPolarHBondContact CB-O 3.46Å; T121-H140 PolarHBondContact OG1-O 3.16Å; H140-V144 HydrophobicContact CB-CG2 4.34Å; H140-S158 PolarHBondContact CD2-OG 2.83Å; H140-S158 PolarHBondContact NE2-OG 3.48Å; H140-D162 VanDerWaalsContact CA-OD2 3.26Å; H140-D162 WeakPolarHBondContact CA-OD2 3.32Å; H140-D162 WeakPolarHBondContact CB-OD2 3.5Å; H140-D162 IonicContact CE1-OD1 2.65Å; H140-D162 IonicContact CG-OD2 2.74Å; H140-D162 IonicContact ND1-OD1 3.5Å; H140-D162 PolarHBondContact ND1-OD1 3.29Å; H140-D162 IonicContact ND1-OD2 3.81Å; H140-D162 PolarHBondContact ND1-OD2 3.18Å; H140-I164 PolarHBondContact CE1-O 3.5Å
141	T	96.3	Very high	93.2	Very high	119 Å²	119	46.4 Å²	46.4	73%	0.73	25%	0.252	S	S	*	.	S	Bend	trans	-103.6	-12.1	177.7	54.5	0	0	0	0	112.9	D162	T141-D162 PolarHBondContact N-OD2 3.32Å; T141-D162 VanDerWaalsContact OG1-CB 3.27Å; T141-D162 WeakPolarHBondContact OG1-CB 3.25Å
142	G	96	Very high	94.2	Very high	15 Å²	15	40 Å²	40	16%	0.155	23%	0.228	C	C	.	.	S	Bend	trans	-121.3	-177.9	169.7	0	0	0	0	0	112.4	T121	T121-G142 VanDerWaalsContact CB-O 3.31Å; T121-G142 WeakPolarHBondContact CB-O 3.32Å; T121-G142 WeakPolarHBondContact CG2-O 3.33Å
143	S	97.1	Very high	94.7	Very high	14 Å²	14	39.1 Å²	39.1	10%	0.098	22%	0.218	C	C	.	.			trans	-61.9	145.6	178.7	-44.4	0	0	0	0	111.4	N145 G160 E161	S143-N145 PolarHBondContact O-N 2.86Å; S143-G160 CarbonylContact O-C 3.52Å; S143-G160 VanDerWaalsContact O-CA 3.29Å; S143-G160 WeakPolarHBondContact O-CA 3.29Å; S143-E161 WeakPolarHBondContact CB-OE2 3.49Å; S143-E161 PolarHBondContact N-OE2 3.29Å; S143-E161 PolarHBondContact O-N 3.2Å; S143-E161 VanDerWaalsContact OG-CD 3.26Å; S143-E161 PolarHBondContact OG-OE1 3.42Å; S143-E161 PolarHBondContact OG-OE2 3.05Å
144	V	98	Very high	94.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	108.6	174.7	-174.4	0	0	0	0	109.1	T104 S118 V123 H140 A159	T104-V144 HydrophobicContact CG2-CG1 4.24Å; S118-V144 PolarHBondContact O-N 3.48Å; V123-V144 HydrophobicContact CG2-CG1 4Å; V123-V144 HydrophobicContact CG2-CG2 3.93Å; H140-V144 HydrophobicContact CB-CG2 4.34Å; V144-A159 CarbonylContact C-O 3.53Å
145	N	97.1	Very high	94.7	Very high	26 Å²	26	42 Å²	42	14%	0.139	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-37.5	-175.6	-76.1	-25	0	0	0	113.7	K103 S143 A159 E161 V186	K103-N145 PolarHBondContact NZ-OD1 2.65Å; S143-N145 PolarHBondContact O-N 2.86Å; N145-A159 PolarHBondContact N-O 3.46Å; N145-E161 VanDerWaalsContact ND2-CG 3.34Å; N145-E161 WeakPolarHBondContact ND2-CG 3.38Å; N145-E161 WeakPolarHBondContact OD1-CG 3.45Å; N145-E161 PolarHBondContact OD1-OE1 3.25Å; N145-V186 WeakPolarHBondContact CB-O 3.21Å; N145-V186 PolarHBondContact ND2-O 2.84Å
146	M	97	Very high	94.9	Very high	13 Å²	13	39.7 Å²	39.7	6%	0.064	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	144.8	178.6	-166.8	160.4	-68.6	0	0	111.5	T104 S158 A159 V187 A188 V189	T104-M146 WeakPolarHBondContact OG1-CA 3.41Å; M146-S158 WeakPolarHBondContact O-CA 3.05Å; M146-A159 HydrophobicContact CB-CB 4.45Å; M146-A159 PolarHBondContact N-O 3.46Å; M146-A159 PolarHBondContact O-N 3.04Å; M146-V187 WeakPolarHBondContact CE-O 3.39Å; M146-A188 HydrophobicContact CE-CB 4.35Å; M146-A188 HydrophobicContact SD-CB 4.4Å; M146-V189 HydrophobicContact CB-CG2 4.39Å; M146-V189 HydrophobicContact CG-CB 4.38Å; M146-V189 HydrophobicContact SD-CB 4.21Å; M146-V189 PolarHBondContact SD-N 3.36Å
147	I	97.5	Very high	95	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.9	174.9	-159.9	167.3	0	0	0	109.3	T104 D106 A115 V123 I156 V157	T104-I147 HydrophobicContact CG2-CB 3.81Å; T104-I147 HydrophobicContact CG2-CG2 3.72Å; T104-I147 WeakPolarHBondContact OG1-CG2 3.36Å; T104-I147 PolarHBondContact OG1-N 2.77Å; D106-I147 HydrophobicContact CB-CG2 3.96Å; A115-I147 HydrophobicContact CB-CD1 3.55Å; A115-I147 HydrophobicContact CB-CG1 4.28Å; V123-I147 HydrophobicContact CB-CD1 4.37Å; V123-I147 HydrophobicContact CG1-CD1 3.36Å; V123-I147 HydrophobicContact CG2-CD1 4.19Å; I147-I156 HydrophobicContact CD1-CG2 3.8Å; I147-I156 HydrophobicContact CG1-CG2 3.47Å; I147-I156 VanDerWaalsContact CG1-CG2 3.47Å; I147-V157 CarbonylContact C-O 3.56Å; I147-V157 WeakPolarHBondContact CA-O 3.46Å
148	R	96.9	Very high	95	Very high	39 Å²	39	37 Å²	37	15%	0.147	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	135	173.5	-66.8	-62.8	169	-159.8	0.1	111.8	E64 D106 I156 V157 V189 F191	E64-R148 IonicContact OE1-CZ 3.23Å; E64-R148 IonicContact OE1-NH1 3.05Å; E64-R148 PolarHBondContact OE1-NH1 3.47Å; E64-R148 IonicContact OE1-NH2 3.87Å; E64-R148 PolarHBondContact OE1-NH2 3.01Å; D106-R148 IonicContact OD1-CZ 3.29Å; D106-R148 IonicContact OD1-NH1 3.84Å; D106-R148 PolarHBondContact OD1-NH1 3.03Å; D106-R148 VanDerWaalsContact OD2-CA 3.29Å; D106-R148 WeakPolarHBondContact OD2-CA 3.48Å; R148-I156 WeakPolarHBondContact O-CA 3.33Å; R148-V157 PolarHBondContact N-O 3.24Å; R148-V157 PolarHBondContact O-N 2.83Å; R148-V189 HydrophobicContact CG-CG1 4.5Å; R148-F191 HydrophobicContact CB-CD2 4.2Å; R148-F191 HydrophobicContact CB-CE2 3.74Å
149	F	96.1	Very high	95.1	Very high	11 Å²	11	28.5 Å²	28.5	5%	0.048	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144	164.1	-77.5	-82.6	0	0	0	110.3	D106 F107 H108 F113 A115 L125 I156 L170 F191	D106-F149 HydrophobicContact CB-CD2 4Å; D106-F149 HydrophobicContact CB-CE2 4.42Å; D106-F149 WeakPolarHBondContact O-CE2 3.34Å; D106-F149 WeakPolarHBondContact OD2-CD2 3.39Å; D106-F149 PolarHBondContact OD2-N 2.97Å; F107-F149 VanDerWaalsContact C-CD2 3.43Å; F107-F149 WeakPolarHBondContact O-CD2 3.08Å; H108-F149 HydrophobicContact CB-CD1 4.05Å; H108-F149 HydrophobicContact CB-CD2 4.15Å; H108-F149 HydrophobicContact CB-CE1 3.81Å; H108-F149 HydrophobicContact CB-CE2 3.93Å; H108-F149 HydrophobicContact CB-CG 4.21Å; H108-F149 HydrophobicContact CB-CZ 3.75Å; H108-F149 AromaticContact CD2-CD1 3.8Å; H108-F149 AromaticContact CD2-CE1 3.68Å; F113-F149 HydrophobicContact CB-CZ 4.47Å; A115-F149 HydrophobicContact CB-CD2 4.45Å; A115-F149 HydrophobicContact CB-CE2 3.53Å; A115-F149 HydrophobicContact CB-CZ 3.61Å; L125-F149 HydrophobicContact CD1-CE1 4.11Å; L125-F149 HydrophobicContact CD1-CZ 3.8Å; F149-I156 HydrophobicContact CD1-CD1 4.44Å; F149-I156 HydrophobicContact CD1-CG1 3.74Å; F149-I156 HydrophobicContact CE1-CD1 3.84Å; F149-I156 HydrophobicContact CE1-CG1 3.64Å; F149-I156 HydrophobicContact CG-CG1 4.36Å; F149-I156 HydrophobicContact CZ-CD1 4.04Å; F149-I156 HydrophobicContact CZ-CG1 4.18Å; F149-L170 HydrophobicContact CD1-CD1 3.82Å; F149-L170 HydrophobicContact CE1-CD1 3.68Å; F149-L170 HydrophobicContact CE1-CD2 3.97Å; F149-L170 HydrophobicContact CE1-CG 4.48Å; F149-F191 WeakPolarHBondContact O-CE2 3.07Å
150	S	93.8	Very high	95.3	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.028	15%	0.145	C	C	.	.			trans	-63.2	148.7	168.3	59.4	0	0	0	0	111	D152 G153 K154 W155	S150-D152 VanDerWaalsContact CB-OD1 3.29Å; S150-D152 WeakPolarHBondContact CB-OD1 3.18Å; S150-D152 PolarHBondContact O-N 3.28Å; S150-D152 VanDerWaalsContact O-N 3.07Å; S150-D152 PolarHBondContact OG-OD1 2.91Å; S150-G153 PolarHBondContact O-N 3.3Å; S150-G153 PolarHBondContact OG-N 3.04Å; S150-K154 PolarHBondContact OG-N 2.89Å; S150-W155 PolarHBondContact N-O 3.4Å; S150-W155 PolarHBondContact OG-N 3.38Å; S150-W155 PolarHBondContact OG-O 3.48Å
151	P	90.2	Very high	95.3	Very high	61 Å²	61	30 Å²	30	40%	0.396	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.4	178.8	-26.4	35.2	0	0	0	114.6	Y110 F191	Y110-P151 VanDerWaalsContact CE2-O 3.28Å; Y110-P151 WeakPolarHBondContact CE2-O 3.34Å; Y110-P151 PolarHBondContact OH-O 3.02Å; P151-F191 HydrophobicContact CG-CB 3.78Å; P151-F191 HydrophobicContact CG-CG 4.14Å
152	D	88.7	Confident	95.3	Very high	63 Å²	63	26.1 Å²	26.1	34%	0.337	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.7	174.7	78.3	-19.9	0	0	0	113.9	S150 K154	S150-D152 VanDerWaalsContact CB-OD1 3.29Å; S150-D152 WeakPolarHBondContact CB-OD1 3.18Å; S150-D152 PolarHBondContact O-N 3.28Å; S150-D152 VanDerWaalsContact O-N 3.07Å; S150-D152 PolarHBondContact OG-OD1 2.91Å; D152-K154 VanDerWaalsContact C-N 3.31Å; D152-K154 PolarHBondContact O-N 3.36Å; D152-K154 PolarHBondContact OD1-N 3.34Å; D152-K154 WeakPolarHBondContact OD2-CD 3.36Å; D152-K154 WeakPolarHBondContact OD2-CE 3.42Å; D152-K154 VanDerWaalsContact OD2-CG 3.28Å; D152-K154 WeakPolarHBondContact OD2-CG 3.49Å; D152-K154 IonicContact OD2-NZ 2.94Å; D152-K154 PolarHBondContact OD2-NZ 3.09Å
153	G	91	Very high	95.3	Very high	9 Å²	9	25.5 Å²	25.5	9%	0.093	13%	0.128	C	C	.	.	S	Bend	trans	69.2	18.6	179.8	0	0	0	0	0	115.2	H108 S150 L170	H108-G153 PolarHBondContact NE2-O 3.4Å; S150-G153 PolarHBondContact O-N 3.3Å; S150-G153 PolarHBondContact OG-N 3.04Å; G153-L170 VanDerWaalsContact O-CD1 3.28Å; G153-L170 WeakPolarHBondContact O-CD1 3.45Å
154	K	91.2	Very high	95.3	Very high	123 Å²	123	26.5 Å²	26.5	54%	0.535	13%	0.131	S	C	.	.	S	Bend	trans	-91.1	-32.1	177.9	-63.5	-166.1	-160	97.4	0	114	S150 D152 L170	S150-K154 PolarHBondContact OG-N 2.89Å; D152-K154 VanDerWaalsContact C-N 3.31Å; D152-K154 PolarHBondContact O-N 3.36Å; D152-K154 PolarHBondContact OD1-N 3.34Å; D152-K154 WeakPolarHBondContact OD2-CD 3.36Å; D152-K154 WeakPolarHBondContact OD2-CE 3.42Å; D152-K154 VanDerWaalsContact OD2-CG 3.28Å; D152-K154 WeakPolarHBondContact OD2-CG 3.49Å; D152-K154 IonicContact OD2-NZ 2.94Å; D152-K154 PolarHBondContact OD2-NZ 3.09Å; K154-L170 VanDerWaalsContact O-CB 3.25Å; K154-L170 WeakPolarHBondContact O-CB 3.36Å; K154-L170 WeakPolarHBondContact O-CG 3.45Å; K154-L170 PolarHBondContact O-N 3Å; K154-L170 VanDerWaalsContact O-N 3.1Å
155	W	92.6	Very high	95.3	Very high	59 Å²	59	26.5 Å²	26.5	22%	0.223	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	159.2	-172.1	-51.8	-26.6	0	0	0	112.1	S150 L167 W168 L176 L212 F215	S150-W155 PolarHBondContact N-O 3.4Å; S150-W155 PolarHBondContact OG-N 3.38Å; S150-W155 PolarHBondContact OG-O 3.48Å; W155-L167 HydrophobicContact CE3-CD2 4.08Å; W155-L167 HydrophobicContact CZ3-CD2 4.36Å; W155-W168 CarbonylContact C-O 3.56Å; W155-W168 WeakPolarHBondContact CA-O 3.39Å; W155-W168 WeakPolarHBondContact CB-O 3.49Å; W155-L176 HydrophobicContact CB-CD1 4.49Å; W155-L176 HydrophobicContact CD2-CD1 3.78Å; W155-L176 HydrophobicContact CG-CD1 3.66Å; W155-L176 HydrophobicContact CZ2-CD1 4.33Å; W155-L176 VanDerWaalsContact NE1-CD1 3.32Å; W155-L212 HydrophobicContact CZ3-CB 4.47Å; W155-F215 HydrophobicContact CH2-CE1 4.05Å; W155-F215 AromaticContact CH2-CZ 3.78Å; W155-F215 HydrophobicContact CH2-CZ 3.78Å; W155-F215 HydrophobicContact CZ2-CZ 4.48Å; W155-F215 AromaticContact CZ3-CE1 3.79Å; W155-F215 HydrophobicContact CZ3-CE1 3.79Å; W155-F215 HydrophobicContact CZ3-CZ 4.01Å
156	I	96.6	Very high	95.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.8	163.4	-72.2	167	0	0	0	108.4	A115 L125 I147 R148 F149 L167 W168 L170	A115-I156 HydrophobicContact CB-CD1 3.61Å; A115-I156 HydrophobicContact CB-CG1 4.37Å; L125-I156 HydrophobicContact CD1-CD1 4.24Å; I147-I156 HydrophobicContact CD1-CG2 3.8Å; I147-I156 HydrophobicContact CG1-CG2 3.47Å; I147-I156 VanDerWaalsContact CG1-CG2 3.47Å; R148-I156 WeakPolarHBondContact O-CA 3.33Å; F149-I156 HydrophobicContact CD1-CD1 4.44Å; F149-I156 HydrophobicContact CD1-CG1 3.74Å; F149-I156 HydrophobicContact CE1-CD1 3.84Å; F149-I156 HydrophobicContact CE1-CG1 3.64Å; F149-I156 HydrophobicContact CG-CG1 4.36Å; F149-I156 HydrophobicContact CZ-CD1 4.04Å; F149-I156 HydrophobicContact CZ-CG1 4.18Å; I156-L167 CarbonylContact O-C 3.58Å; I156-L167 WeakPolarHBondContact O-CA 3.39Å; I156-W168 HydrophobicContact CB-CB 4.35Å; I156-W168 PolarHBondContact N-O 3.36Å; I156-W168 PolarHBondContact O-N 2.97Å; I156-L170 HydrophobicContact CD1-CD2 3.54Å; I156-L170 HydrophobicContact CG1-CD2 3.84Å; I156-L170 HydrophobicContact CG1-CG 4.42Å
157	V	97.4	Very high	95.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.5	160.1	173.8	0	0	0	0	108.6	I147 R148 I165 K166 L167 V189 F191 L198	I147-V157 CarbonylContact C-O 3.56Å; I147-V157 WeakPolarHBondContact CA-O 3.46Å; R148-V157 PolarHBondContact N-O 3.24Å; R148-V157 PolarHBondContact O-N 2.83Å; V157-I165 HydrophobicContact CG1-CG2 3.43Å; V157-I165 VanDerWaalsContact CG1-CG2 3.43Å; V157-K166 WeakPolarHBondContact CA-O 3.32Å; V157-L167 HydrophobicContact CG2-CD1 3.89Å; V157-L167 HydrophobicContact CG2-CD2 4.43Å; V157-L167 HydrophobicContact CG2-CG 3.79Å; V157-V189 HydrophobicContact CB-CG1 4.43Å; V157-V189 HydrophobicContact CG1-CG1 3.76Å; V157-F191 HydrophobicContact CB-CE2 4.47Å; V157-F191 HydrophobicContact CB-CZ 4.12Å; V157-F191 HydrophobicContact CG2-CE1 4.04Å; V157-F191 HydrophobicContact CG2-CE2 4.22Å; V157-F191 HydrophobicContact CG2-CZ 3.42Å; V157-F191 VanDerWaalsContact CG2-CZ 3.42Å; V157-L198 HydrophobicContact CG1-CD1 4.5Å; V157-L198 HydrophobicContact CG1-CD2 4Å; V157-L198 HydrophobicContact CG2-CD1 4.13Å; V157-L198 HydrophobicContact CG2-CD2 4.16Å
158	S	97.9	Very high	95.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.1	168.1	63.9	0	0	0	0	111.3	H140 M146 I165 K166 W168	H140-S158 PolarHBondContact CD2-OG 2.83Å; H140-S158 PolarHBondContact NE2-OG 3.48Å; M146-S158 WeakPolarHBondContact O-CA 3.05Å; S158-I165 CarbonylContact O-C 3.59Å; S158-I165 VanDerWaalsContact O-CA 3.32Å; S158-I165 WeakPolarHBondContact O-CA 3.44Å; S158-K166 PolarHBondContact N-O 3.5Å; S158-K166 PolarHBondContact O-N 3.29Å; S158-W168 PolarHBondContact OG-NE1 2.79Å
159	A	97.4	Very high	95.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.7	-175.9	0	0	0	0	0	110	V144 N145 M146 I165 V186 V189	V144-A159 CarbonylContact C-O 3.53Å; N145-A159 PolarHBondContact N-O 3.46Å; M146-A159 HydrophobicContact CB-CB 4.45Å; M146-A159 PolarHBondContact N-O 3.46Å; M146-A159 PolarHBondContact O-N 3.04Å; A159-I165 HydrophobicContact CB-CG1 4.23Å; A159-V186 HydrophobicContact CB-CB 3.86Å; A159-V186 HydrophobicContact CB-CG1 3.58Å; A159-V189 HydrophobicContact CB-CG2 3.51Å
160	G	96.4	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	168.2	-171.9	0	0	0	0	0	115.6	S143 D162 G163 I164 V186	S143-G160 CarbonylContact O-C 3.52Å; S143-G160 VanDerWaalsContact O-CA 3.29Å; S143-G160 WeakPolarHBondContact O-CA 3.29Å; G160-D162 WeakPolarHBondContact CA-OD1 3.48Å; G160-D162 PolarHBondContact O-N 3.42Å; G160-G163 PolarHBondContact O-N 3.09Å; G160-I164 PolarHBondContact N-O 2.96Å; G160-I164 VanDerWaalsContact N-O 3.12Å; G160-V186 PolarHBondContact O-N 2.83Å
161	E	96.7	Very high	94.7	Very high	73 Å²	73	30.6 Å²	30.6	34%	0.341	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18	164.2	-69.9	173.1	170.4	0	0	112.5	K103 S143 N145 G163 P185	K103-E161 IonicContact NZ-OE1 2.77Å; K103-E161 PolarHBondContact NZ-OE1 2.61Å; S143-E161 WeakPolarHBondContact CB-OE2 3.49Å; S143-E161 PolarHBondContact N-OE2 3.29Å; S143-E161 PolarHBondContact O-N 3.2Å; S143-E161 VanDerWaalsContact OG-CD 3.26Å; S143-E161 PolarHBondContact OG-OE1 3.42Å; S143-E161 PolarHBondContact OG-OE2 3.05Å; N145-E161 VanDerWaalsContact ND2-CG 3.34Å; N145-E161 WeakPolarHBondContact ND2-CG 3.38Å; N145-E161 WeakPolarHBondContact OD1-CG 3.45Å; N145-E161 PolarHBondContact OD1-OE1 3.25Å; E161-G163 PolarHBondContact O-N 2.93Å; E161-P185 HydrophobicContact CB-CG 4.48Å; E161-P185 HydrophobicContact CG-CB 4.48Å
162	D	96	Very high	94.7	Very high	37 Å²	37	30 Å²	30	20%	0.198	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-5	172.7	54.3	16.7	0	0	0	114.1	H140 T141 G160 I164	H140-D162 VanDerWaalsContact CA-OD2 3.26Å; H140-D162 WeakPolarHBondContact CA-OD2 3.32Å; H140-D162 WeakPolarHBondContact CB-OD2 3.5Å; H140-D162 IonicContact CE1-OD1 2.65Å; H140-D162 IonicContact CG-OD2 2.74Å; H140-D162 IonicContact ND1-OD1 3.5Å; H140-D162 PolarHBondContact ND1-OD1 3.29Å; H140-D162 IonicContact ND1-OD2 3.81Å; H140-D162 PolarHBondContact ND1-OD2 3.18Å; T141-D162 PolarHBondContact N-OD2 3.32Å; T141-D162 VanDerWaalsContact OG1-CB 3.27Å; T141-D162 WeakPolarHBondContact OG1-CB 3.25Å; G160-D162 WeakPolarHBondContact CA-OD1 3.48Å; G160-D162 PolarHBondContact O-N 3.42Å; D162-I164 HydrophobicContact CB-CD1 4.41Å; D162-I164 HydrophobicContact CB-CG1 4.41Å; D162-I164 PolarHBondContact O-N 3.33Å; D162-I164 PolarHBondContact OD1-N 2.88Å
163	G	95.6	Very high	94.8	Very high	3 Å²	3	28.5 Å²	28.5	3%	0.031	16%	0.164	C	C	.	.	S	Bend	trans	77.5	4.9	-177.3	0	0	0	0	0	113.8	G160 E161 G184	G160-G163 PolarHBondContact O-N 3.09Å; E161-G163 PolarHBondContact O-N 2.93Å; G163-G184 WeakPolarHBondContact CA-O 3.45Å
164	I	96.8	Very high	94.8	Very high	34 Å²	34	35.7 Å²	35.7	17%	0.174	19%	0.188	C	C	.	.			trans	-101.7	144.3	-175.7	-55.5	173.4	0	0	0	109.3	H140 G160 D162 K166 E178	H140-I164 PolarHBondContact CE1-O 3.5Å; G160-I164 PolarHBondContact N-O 2.96Å; G160-I164 VanDerWaalsContact N-O 3.12Å; D162-I164 HydrophobicContact CB-CD1 4.41Å; D162-I164 HydrophobicContact CB-CG1 4.41Å; D162-I164 PolarHBondContact O-N 3.33Å; D162-I164 PolarHBondContact OD1-N 2.88Å; I164-K166 HydrophobicContact CG2-CG 4.04Å; I164-E178 HydrophobicContact CG2-CG 3.45Å; I164-E178 VanDerWaalsContact CG2-CG 3.45Å
165	I	97.7	Very high	95	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.8	167.2	-60.9	123.1	0	0	0	108.5	V157 S158 A159 L167 L179 V186 L198 T200 Y210	V157-I165 HydrophobicContact CG1-CG2 3.43Å; V157-I165 VanDerWaalsContact CG1-CG2 3.43Å; S158-I165 CarbonylContact O-C 3.59Å; S158-I165 VanDerWaalsContact O-CA 3.32Å; S158-I165 WeakPolarHBondContact O-CA 3.44Å; A159-I165 HydrophobicContact CB-CG1 4.23Å; I165-L167 HydrophobicContact CG2-CD1 4.28Å; I165-L179 HydrophobicContact CB-CB 4.14Å; I165-L179 HydrophobicContact CG2-CD1 4.2Å; I165-L179 PolarHBondContact N-O 2.87Å; I165-L179 PolarHBondContact O-N 3.38Å; I165-V186 HydrophobicContact CD1-CG1 4.37Å; I165-V186 HydrophobicContact CD1-CG2 4.08Å; I165-V186 HydrophobicContact CG1-CG1 4.15Å; I165-V186 HydrophobicContact CG1-CG2 4.13Å; I165-L198 HydrophobicContact CG2-CD2 4.2Å; I165-T200 HydrophobicContact CD1-CG2 3.71Å; I165-T200 HydrophobicContact CG1-CG2 4.11Å; I165-Y210 HydrophobicContact CD1-CE2 4.2Å
166	K	97.4	Very high	95.1	Very high	10 Å²	10	33 Å²	33	4%	0.043	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.5	-179.5	-71.7	170.6	-178.4	-85	0	110.6	G139 V157 S158 I164 W168 E178	G139-K166 VanDerWaalsContact C-CE 3.42Å; G139-K166 WeakPolarHBondContact O-CE 3.42Å; G139-K166 PolarHBondContact O-NZ 3.35Å; V157-K166 WeakPolarHBondContact CA-O 3.32Å; S158-K166 PolarHBondContact N-O 3.5Å; S158-K166 PolarHBondContact O-N 3.29Å; I164-K166 HydrophobicContact CG2-CG 4.04Å; K166-W168 HydrophobicContact CB-CZ2 3.7Å; K166-W168 HydrophobicContact CD-CH2 4.14Å; K166-W168 HydrophobicContact CD-CZ2 3.71Å; K166-W168 HydrophobicContact CG-CZ2 4.3Å; K166-E178 HydrophobicContact CG-CG 4.24Å; K166-E178 VanDerWaalsContact NZ-CD 3.35Å; K166-E178 IonicContact NZ-OE1 2.69Å; K166-E178 IonicContact NZ-OE2 3.17Å; K166-E178 PolarHBondContact NZ-OE2 2.86Å
167	L	97.1	Very high	95	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.4	174.5	-83.9	71	0	0	0	109.8	W155 I156 V157 I165 Q175 L176 A177 L179 L212 F215	W155-L167 HydrophobicContact CE3-CD2 4.08Å; W155-L167 HydrophobicContact CZ3-CD2 4.36Å; I156-L167 CarbonylContact O-C 3.58Å; I156-L167 WeakPolarHBondContact O-CA 3.39Å; V157-L167 HydrophobicContact CG2-CD1 3.89Å; V157-L167 HydrophobicContact CG2-CD2 4.43Å; V157-L167 HydrophobicContact CG2-CG 3.79Å; I165-L167 HydrophobicContact CG2-CD1 4.28Å; L167-Q175 CarbonylContact O-C 3.58Å; L167-Q175 WeakPolarHBondContact O-CA 3.41Å; L167-L176 HydrophobicContact CB-CB 4.29Å; L167-L176 PolarHBondContact O-N 3.23Å; L167-A177 HydrophobicContact CB-CB 4.3Å; L167-A177 PolarHBondContact N-O 3.37Å; L167-L179 HydrophobicContact CD1-CD1 3.67Å; L167-L179 HydrophobicContact CD1-CG 4.02Å; L167-L212 HydrophobicContact CD2-CD2 4.04Å; L167-F215 HydrophobicContact CD2-CD1 3.83Å; L167-F215 HydrophobicContact CD2-CE1 3.51Å
168	W	96.5	Very high	94.9	Very high	7 Å²	7	37.6 Å²	37.6	3%	0.027	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.6	-175.9	-49.9	94.2	0	0	0	111	Y137 R138 W155 I156 S158 K166 R174 Q175	Y137-W168 HydrophobicContact CD1-CB 3.95Å; Y137-W168 AromaticContact CD1-CD2 3.75Å; Y137-W168 HydrophobicContact CD1-CD2 3.75Å; Y137-W168 AromaticContact CD1-CE3 3.36Å; Y137-W168 HydrophobicContact CD1-CE3 3.36Å; Y137-W168 HydrophobicContact CD1-CG 4.02Å; Y137-W168 HydrophobicContact CD1-CZ3 4.12Å; Y137-W168 HydrophobicContact CE1-CB 3.81Å; Y137-W168 HydrophobicContact CE1-CE3 4.23Å; Y137-W168 HydrophobicContact CE1-CG 4.38Å; Y137-W168 HydrophobicContact CG-CB 4.41Å; Y137-W168 AromaticContact CG-CD2 3.91Å; Y137-W168 HydrophobicContact CG-CD2 3.91Å; Y137-W168 AromaticContact CG-CE3 3.85Å; Y137-W168 HydrophobicContact CG-CE3 3.85Å; Y137-W168 HydrophobicContact CG-CG 4.17Å; Y137-W168 HydrophobicContact CG-CZ3 4.45Å; R138-W168 WeakPolarHBondContact O-CH2 3.2Å; W155-W168 CarbonylContact C-O 3.56Å; W155-W168 WeakPolarHBondContact CA-O 3.39Å; W155-W168 WeakPolarHBondContact CB-O 3.49Å; I156-W168 HydrophobicContact CB-CB 4.35Å; I156-W168 PolarHBondContact N-O 3.36Å; I156-W168 PolarHBondContact O-N 2.97Å; S158-W168 PolarHBondContact OG-NE1 2.79Å; K166-W168 HydrophobicContact CB-CZ2 3.7Å; K166-W168 HydrophobicContact CD-CH2 4.14Å; K166-W168 HydrophobicContact CD-CZ2 3.71Å; K166-W168 HydrophobicContact CG-CZ2 4.3Å; W168-R174 WeakPolarHBondContact CA-O 3.38Å; W168-Q175 HydrophobicContact CE3-CB 3.78Å; W168-Q175 HydrophobicContact CE3-CG 4.08Å; W168-Q175 HydrophobicContact CH2-CB 4.3Å; W168-Q175 HydrophobicContact CH2-CG 4.16Å; W168-Q175 HydrophobicContact CZ3-CB 3.55Å; W168-Q175 HydrophobicContact CZ3-CG 3.86Å
169	D	94.3	Very high	94.8	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.102	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	125.9	170.5	-160.6	-34.7	0	0	0	109.5	Y137 S171 A172 G173 R174 L176	Y137-D169 PolarHBondContact OH-O 3.05Å; Y137-D169 VanDerWaalsContact OH-O 3.05Å; D169-S171 WeakPolarHBondContact OD1-CA 3.36Å; D169-S171 WeakPolarHBondContact OD1-CB 3.42Å; D169-S171 PolarHBondContact OD1-N 2.89Å; D169-S171 PolarHBondContact OD1-OG 3.12Å; D169-A172 HydrophobicContact CB-CB 3.94Å; D169-A172 PolarHBondContact OD1-N 3.15Å; D169-A172 WeakPolarHBondContact OD2-CB 3.49Å; D169-G173 WeakPolarHBondContact O-CA 3.31Å; D169-G173 PolarHBondContact O-N 3.41Å; D169-R174 HydrophobicContact CB-CG 4.42Å; D169-R174 PolarHBondContact N-O 3.33Å; D169-L176 HydrophobicContact CB-CD1 3.82Å; D169-L176 HydrophobicContact CB-CD2 3.91Å; D169-L176 HydrophobicContact CB-CG 3.75Å
170	L	91.8	Very high	94.6	Very high	30 Å²	30	42.5 Å²	42.5	16%	0.157	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-36.5	172.6	-66.7	170.3	0	0	0	111.8	L125 F149 G153 K154 I156	L125-L170 HydrophobicContact CD1-CD2 3.85Å; L125-L170 HydrophobicContact CD2-CD2 3.62Å; L125-L170 HydrophobicContact CG-CD2 4.32Å; F149-L170 HydrophobicContact CD1-CD1 3.82Å; F149-L170 HydrophobicContact CE1-CD1 3.68Å; F149-L170 HydrophobicContact CE1-CD2 3.97Å; F149-L170 HydrophobicContact CE1-CG 4.48Å; G153-L170 VanDerWaalsContact O-CD1 3.28Å; G153-L170 WeakPolarHBondContact O-CD1 3.45Å; K154-L170 VanDerWaalsContact O-CB 3.25Å; K154-L170 WeakPolarHBondContact O-CB 3.36Å; K154-L170 WeakPolarHBondContact O-CG 3.45Å; K154-L170 PolarHBondContact O-N 3Å; K154-L170 VanDerWaalsContact O-N 3.1Å; I156-L170 HydrophobicContact CD1-CD2 3.54Å; I156-L170 HydrophobicContact CG1-CD2 3.84Å; I156-L170 HydrophobicContact CG1-CG 4.42Å
171	S	89.6	Confident	94.4	Very high	113 Å²	113	43.5 Å²	43.5	79%	0.79	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-42.6	-176.6	73.3	0	0	0	0	112.2	D169	D169-S171 WeakPolarHBondContact OD1-CA 3.36Å; D169-S171 WeakPolarHBondContact OD1-CB 3.42Å; D169-S171 PolarHBondContact OD1-N 2.89Å; D169-S171 PolarHBondContact OD1-OG 3.12Å
172	A	90	Very high	94.3	Very high	50 Å²	50	40.7 Å²	40.7	41%	0.413	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-9.1	178.9	0	0	0	0	0	114.1	D169 R174	D169-A172 HydrophobicContact CB-CB 3.94Å; D169-A172 PolarHBondContact OD1-N 3.15Å; D169-A172 WeakPolarHBondContact OD2-CB 3.49Å; A172-R174 VanDerWaalsContact C-N 3.3Å; A172-R174 HydrophobicContact CB-CG 3.92Å; A172-R174 PolarHBondContact O-N 2.67Å
173	G	90.5	Very high	94.2	Very high	30 Å²	30	45 Å²	45	31%	0.309	26%	0.26	S	S	.	.			trans	64.6	27.1	175.7	0	0	0	0	0	115.1	D169	D169-G173 WeakPolarHBondContact O-CA 3.31Å; D169-G173 PolarHBondContact O-N 3.41Å
174	R	92.4	Very high	94.1	Very high	161 Å²	161	45.5 Å²	45.5	61%	0.608	27%	0.265	S	S	*	.	S	Bend	trans	-134.6	163.4	-172.2	65.9	-178.6	179.6	173.2	1.5	112.9	W168 D169 A172	W168-R174 WeakPolarHBondContact CA-O 3.38Å; D169-R174 HydrophobicContact CB-CG 4.42Å; D169-R174 PolarHBondContact N-O 3.33Å; A172-R174 VanDerWaalsContact C-N 3.3Å; A172-R174 HydrophobicContact CB-CG 3.92Å; A172-R174 PolarHBondContact O-N 2.67Å
175	Q	94.5	Very high	94.1	Very high	66 Å²	66	46.3 Å²	46.3	31%	0.308	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	134.6	168.4	-155.8	178.6	-77	0	0	109.1	L167 W168 E178	L167-Q175 CarbonylContact O-C 3.58Å; L167-Q175 WeakPolarHBondContact O-CA 3.41Å; W168-Q175 HydrophobicContact CE3-CB 3.78Å; W168-Q175 HydrophobicContact CE3-CG 4.08Å; W168-Q175 HydrophobicContact CH2-CB 4.3Å; W168-Q175 HydrophobicContact CH2-CG 4.16Å; W168-Q175 HydrophobicContact CZ3-CB 3.55Å; W168-Q175 HydrophobicContact CZ3-CG 3.86Å; Q175-E178 PolarHBondContact NE2-OE2 2.98Å
176	L	93.5	Very high	94.1	Very high	60 Å²	60	46.3 Å²	46.3	31%	0.314	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-52.8	173.8	-74.1	168.8	0	0	0	111.1	W155 L167 D169	W155-L176 HydrophobicContact CB-CD1 4.49Å; W155-L176 HydrophobicContact CD2-CD1 3.78Å; W155-L176 HydrophobicContact CG-CD1 3.66Å; W155-L176 HydrophobicContact CZ2-CD1 4.33Å; W155-L176 VanDerWaalsContact NE1-CD1 3.32Å; L167-L176 HydrophobicContact CB-CB 4.29Å; L167-L176 PolarHBondContact O-N 3.23Å; D169-L176 HydrophobicContact CB-CD1 3.82Å; D169-L176 HydrophobicContact CB-CD2 3.91Å; D169-L176 HydrophobicContact CB-CG 3.75Å
177	A	94.8	Very high	94	Very high	12 Å²	12	47.6 Å²	47.6	10%	0.099	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	161.1	-174.1	0	0	0	0	0	110.7	L167 F215	L167-A177 HydrophobicContact CB-CB 4.3Å; L167-A177 PolarHBondContact N-O 3.37Å; A177-F215 HydrophobicContact CB-CB 4.01Å; A177-F215 HydrophobicContact CB-CD1 3.67Å; A177-F215 HydrophobicContact CB-CD2 3.96Å; A177-F215 HydrophobicContact CB-CE1 4.12Å; A177-F215 HydrophobicContact CB-CE2 4.37Å; A177-F215 HydrophobicContact CB-CG 3.59Å; A177-F215 HydrophobicContact CB-CZ 4.45Å
178	E	95.7	Very high	93.9	Very high	84 Å²	84	47.7 Å²	47.7	39%	0.393	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	115.2	175.2	-170	164.5	141.1	0	0	108.1	I164 K166 Q175 V180	I164-E178 HydrophobicContact CG2-CG 3.45Å; I164-E178 VanDerWaalsContact CG2-CG 3.45Å; K166-E178 HydrophobicContact CG-CG 4.24Å; K166-E178 VanDerWaalsContact NZ-CD 3.35Å; K166-E178 IonicContact NZ-OE1 2.69Å; K166-E178 IonicContact NZ-OE2 3.17Å; K166-E178 PolarHBondContact NZ-OE2 2.86Å; Q175-E178 PolarHBondContact NE2-OE2 2.98Å; E178-V180 HydrophobicContact CG-CG2 4.13Å
179	L	95.7	Very high	94	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	99.5	-179.2	-51.9	175.3	0	0	0	107.1	I165 L167 L198 Y210 L212 F215	I165-L179 HydrophobicContact CB-CB 4.14Å; I165-L179 HydrophobicContact CG2-CD1 4.2Å; I165-L179 PolarHBondContact N-O 2.87Å; I165-L179 PolarHBondContact O-N 3.38Å; L167-L179 HydrophobicContact CD1-CD1 3.67Å; L167-L179 HydrophobicContact CD1-CG 4.02Å; L179-L198 HydrophobicContact CD1-CD2 4.01Å; L179-Y210 HydrophobicContact CB-CD1 3.98Å; L179-Y210 HydrophobicContact CB-CE1 3.77Å; L179-Y210 HydrophobicContact CD1-CD1 3.97Å; L179-Y210 HydrophobicContact CD1-CD2 4.26Å; L179-Y210 HydrophobicContact CD1-CG 3.81Å; L179-Y210 HydrophobicContact CD2-CD1 3.95Å; L179-Y210 HydrophobicContact CD2-CE1 4.45Å; L179-Y210 HydrophobicContact CG-CD1 4.18Å; L179-Y210 HydrophobicContact CG-CE1 4.47Å; L179-L212 HydrophobicContact CD1-CD2 4.47Å; L179-F215 HydrophobicContact CD2-CB 3.93Å; L179-F215 VanDerWaalsContact CD2-O 3.31Å; L179-F215 WeakPolarHBondContact CD2-O 3.43Å
180	V	94	Very high	94.1	Very high	99 Å²	99	48 Å²	48	60%	0.6	29%	0.285	S	S	*	.			trans	-90.4	145.9	174.8	-175.9	0	0	0	0	108.7	E178	E178-V180 HydrophobicContact CG-CG2 4.13Å
181	G	90.8	Very high	94.2	Very high	22 Å²	22	47.8 Å²	47.8	23%	0.227	28%	0.283	C	S	.	.			trans	166.4	-43.3	170	0	0	0	0	0	113.6	R208	G181-R208 VanDerWaalsContact CA-NH1 3.35Å; G181-R208 PolarHBondContact O-NH1 3.44Å; G181-R208 PolarHBondContact O-NH2 2.7Å
182	H	95.3	Very high	94.5	Very high	14 Å²	14	42.6 Å²	42.6	7%	0.065	25%	0.247	C	C	.	.			trans	-63.8	142.9	177.4	-76.2	-65.3	0	0	0	111.4	V186 T200 S202 D204 T206 R208	H182-V186 HydrophobicContact CB-CG2 4.04Å; H182-T200 PolarHBondContact NE2-OG1 2.85Å; H182-S202 WeakPolarHBondContact ND1-CB 3.37Å; H182-D204 WeakPolarHBondContact CA-OD2 3.46Å; H182-D204 WeakPolarHBondContact CB-OD2 3.35Å; H182-D204 IonicContact CE1-OD1 3.59Å; H182-D204 IonicContact CG-OD2 3.61Å; H182-D204 IonicContact ND1-OD1 3.86Å; H182-D204 PolarHBondContact ND1-OD1 2.96Å; H182-D204 IonicContact ND1-OD2 2.77Å; H182-D204 PolarHBondContact ND1-OD2 3.21Å; H182-T206 PolarHBondContact CE1-O 3.02Å; H182-T206 PolarHBondContact CE1-OG1 3.48Å; H182-T206 VanDerWaalsContact CE1-OG1 3.25Å; H182-T206 PolarHBondContact ND1-OG1 2.95Å; H182-T206 VanDerWaalsContact ND1-OG1 3.13Å; H182-R208 PolarHBondContact ND1-NE 3.23Å
183	T	94.3	Very high	94.4	Very high	126 Å²	126	42.9 Å²	42.9	77%	0.773	24%	0.244	S	C	*	.	S	Bend	trans	-101.9	5.7	-177.9	57.9	0	0	0	0	113.2	D204	T183-D204 PolarHBondContact N-OD2 3.31Å; T183-D204 VanDerWaalsContact OG1-CB 3.27Å; T183-D204 WeakPolarHBondContact OG1-CB 3.5Å
184	G	94.1	Very high	94.3	Very high	14 Å²	14	46.5 Å²	46.5	14%	0.144	26%	0.261	C	S	.	.	S	Bend	trans	-155.1	175.9	176.3	0	0	0	0	0	112.2	G163 V186 S202	G163-G184 WeakPolarHBondContact CA-O 3.45Å; G184-V186 PolarHBondContact O-N 2.8Å; G184-S202 VanDerWaalsContact C-OG 3.23Å; G184-S202 PolarHBondContact O-OG 3.17Å
185	P	96.3	Very high	94.2	Very high	51 Å²	51	42.7 Å²	42.7	33%	0.331	26%	0.255	S	S	.	.			trans	-47.2	125.7	-176.7	-32.4	36	0	0	0	113.7	E161 S202 A203	E161-P185 HydrophobicContact CB-CG 4.48Å; E161-P185 HydrophobicContact CG-CB 4.48Å; P185-S202 CarbonylContact O-C 3.59Å; P185-S202 VanDerWaalsContact O-CA 3.3Å; P185-S202 WeakPolarHBondContact O-CA 3.22Å; P185-S202 PolarHBondContact O-OG 3.19Å; P185-S202 VanDerWaalsContact O-OG 3.05Å; P185-A203 HydrophobicContact CB-CB 4.41Å; P185-A203 PolarHBondContact O-N 3.3Å
186	V	97.1	Very high	94.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.2	174	-176.8	0	0	0	0	108	N145 A159 G160 I165 H182 G184 V189 A201	N145-V186 WeakPolarHBondContact CB-O 3.21Å; N145-V186 PolarHBondContact ND2-O 2.84Å; A159-V186 HydrophobicContact CB-CB 3.86Å; A159-V186 HydrophobicContact CB-CG1 3.58Å; G160-V186 PolarHBondContact O-N 2.83Å; I165-V186 HydrophobicContact CD1-CG1 4.37Å; I165-V186 HydrophobicContact CD1-CG2 4.08Å; I165-V186 HydrophobicContact CG1-CG1 4.15Å; I165-V186 HydrophobicContact CG1-CG2 4.13Å; H182-V186 HydrophobicContact CB-CG2 4.04Å; G184-V186 PolarHBondContact O-N 2.8Å; V186-V189 HydrophobicContact CG1-CG2 4.25Å; V186-A201 CarbonylContact C-O 3.55Å; V186-A201 WeakPolarHBondContact CG1-O 3.47Å
187	V	95.8	Very high	94.2	Very high	37 Å²	37	42.1 Å²	42.1	22%	0.224	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-20.8	-169.3	-64.4	0	0	0	0	113.9	M146 A201 R232	M146-V187 WeakPolarHBondContact CE-O 3.39Å; V187-A201 HydrophobicContact CG2-CB 4.35Å; V187-A201 WeakPolarHBondContact CG2-O 3.5Å; V187-A201 PolarHBondContact N-O 2.75Å; V187-R232 PolarHBondContact O-NH1 3.49Å
188	A	96.1	Very high	94.3	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.017	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.5	176.3	0	0	0	0	0	112.3	M146 T200 A201 I233	M146-A188 HydrophobicContact CE-CB 4.35Å; M146-A188 HydrophobicContact SD-CB 4.4Å; A188-T200 CarbonylContact O-C 3.54Å; A188-T200 WeakPolarHBondContact O-CA 3.21Å; A188-A201 HydrophobicContact CB-CB 4.29Å; A188-A201 PolarHBondContact N-O 2.86Å; A188-A201 PolarHBondContact O-N 2.96Å; A188-I233 HydrophobicContact CB-CD1 4.49Å; A188-I233 HydrophobicContact CB-CG1 3.84Å
189	V	97	Very high	94.3	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.036	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	133.4	-178.2	178.4	0	0	0	0	108.4	M146 R148 V157 A159 V186 L198 A199 T200	M146-V189 HydrophobicContact CB-CG2 4.39Å; M146-V189 HydrophobicContact CG-CB 4.38Å; M146-V189 HydrophobicContact SD-CB 4.21Å; M146-V189 PolarHBondContact SD-N 3.36Å; R148-V189 HydrophobicContact CG-CG1 4.5Å; V157-V189 HydrophobicContact CB-CG1 4.43Å; V157-V189 HydrophobicContact CG1-CG1 3.76Å; A159-V189 HydrophobicContact CB-CG2 3.51Å; V186-V189 HydrophobicContact CG1-CG2 4.25Å; V189-L198 HydrophobicContact CG1-CD1 3.63Å; V189-L198 HydrophobicContact CG1-CD2 4.41Å; V189-L198 HydrophobicContact CG1-CG 4.21Å; V189-A199 WeakPolarHBondContact CA-O 3.31Å; V189-T200 HydrophobicContact CG1-CG2 4.41Å; V189-T200 HydrophobicContact CG2-CG2 4.19Å
190	T	96.3	Very high	94.4	Very high	27 Å²	27	37.3 Å²	37.3	17%	0.166	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	139.6	175.7	-171	0	0	0	0	111	A199 I233 F235 L242	T190-A199 HydrophobicContact CG2-CB 3.84Å; T190-A199 PolarHBondContact N-O 3.25Å; T190-A199 PolarHBondContact O-N 3.43Å; T190-I233 HydrophobicContact CG2-CB 4.32Å; T190-I233 HydrophobicContact CG2-CD1 3.84Å; T190-I233 HydrophobicContact CG2-CG1 3.74Å; T190-F235 HydrophobicContact CG2-CD2 3.74Å; T190-F235 HydrophobicContact CG2-CE2 3.94Å; T190-L242 HydrophobicContact CG2-CD1 4.24Å
191	F	95.5	Very high	94.5	Very high	26 Å²	26	32.6 Å²	32.6	11%	0.114	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	145.2	175.2	-71.6	-89.5	0	0	0	110.5	R148 F149 P151 V157 L198 L212 F235	R148-F191 HydrophobicContact CB-CD2 4.2Å; R148-F191 HydrophobicContact CB-CE2 3.74Å; F149-F191 WeakPolarHBondContact O-CE2 3.07Å; P151-F191 HydrophobicContact CG-CB 3.78Å; P151-F191 HydrophobicContact CG-CG 4.14Å; V157-F191 HydrophobicContact CB-CE2 4.47Å; V157-F191 HydrophobicContact CB-CZ 4.12Å; V157-F191 HydrophobicContact CG2-CE1 4.04Å; V157-F191 HydrophobicContact CG2-CE2 4.22Å; V157-F191 HydrophobicContact CG2-CZ 3.42Å; V157-F191 VanDerWaalsContact CG2-CZ 3.42Å; F191-L198 HydrophobicContact CD1-CD1 3.75Å; F191-L198 HydrophobicContact CD2-CD1 4.21Å; F191-L198 HydrophobicContact CE1-CD1 3.78Å; F191-L198 HydrophobicContact CE2-CD1 4.21Å; F191-L198 HydrophobicContact CG-CD1 4Å; F191-L198 HydrophobicContact CZ-CD1 4.02Å; F191-L212 HydrophobicContact CD1-CD1 3.8Å; F191-L212 HydrophobicContact CE1-CD1 3.56Å; F191-F235 WeakPolarHBondContact O-CD2 3.41Å
192	H	94.3	Very high	94.7	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.019	19%	0.19	C	C	.	.			trans	-66.5	138.5	166.9	-166.2	-96.1	0	0	0	110.1	T194 V195 L197 F235 G239 Y255	H192-T194 VanDerWaalsContact C-N 3.26Å; H192-T194 PolarHBondContact CE1-OG1 2.89Å; H192-T194 PolarHBondContact ND1-N 3.19Å; H192-T194 PolarHBondContact ND1-OG1 2.95Å; H192-T194 PolarHBondContact O-N 2.85Å; H192-V195 HydrophobicContact CB-CB 4.34Å; H192-V195 WeakPolarHBondContact ND1-CB 3.41Å; H192-V195 WeakPolarHBondContact ND1-CG2 3.43Å; H192-V195 PolarHBondContact ND1-N 3.42Å; H192-V195 VanDerWaalsContact ND1-N 3.19Å; H192-L197 HydrophobicContact CB-CB 3.84Å; H192-L197 HydrophobicContact CB-CD2 4.45Å; H192-L197 PolarHBondContact N-O 2.81Å; H192-F235 HydrophobicContact CB-CD2 4.24Å; H192-F235 HydrophobicContact CB-CE2 4.05Å; H192-F235 HydrophobicContact CB-CZ 4.28Å; H192-F235 AromaticContact CD2-CD1 3.55Å; H192-F235 AromaticContact CD2-CE1 3.63Å; H192-F235 AromaticContact CD2-CG 3.92Å; H192-G239 WeakPolarHBondContact NE2-CA 3.09Å; H192-G239 PolarHBondContact NE2-O 3.28Å; H192-Y255 AromaticContact NE2-CE1 3.82Å; H192-Y255 AromaticContact NE2-CZ 3.81Å
193	P	89.5	Confident	94.7	Very high	56 Å²	56	33.2 Å²	33.2	36%	0.364	21%	0.206	S	C	.	.	S	Bend	trans	-68.1	-21.4	-173.1	25.3	-35.6	0	0	0	114.5	P237	P193-P237 WeakPolarHBondContact CB-O 3.37Å; P193-P237 WeakPolarHBondContact CG-O 3.43Å
194	T	87.1	Confident	94.6	Very high	106 Å²	106	28.4 Å²	28.4	65%	0.65	18%	0.175	S	C	*	.	S	Bend	trans	-133.8	-8.3	-170.7	55.6	0	0	0	0	115.2	H192	H192-T194 VanDerWaalsContact C-N 3.26Å; H192-T194 PolarHBondContact CE1-OG1 2.89Å; H192-T194 PolarHBondContact ND1-N 3.19Å; H192-T194 PolarHBondContact ND1-OG1 2.95Å; H192-T194 PolarHBondContact O-N 2.85Å
195	V	91	Very high	94.6	Very high	80 Å²	80	30.4 Å²	30.4	49%	0.485	18%	0.181	S	C	.	.	S	Bend	trans	-125.6	150.6	-174.7	-178.9	0	0	0	0	107.9	H192 L197	H192-V195 HydrophobicContact CB-CB 4.34Å; H192-V195 WeakPolarHBondContact ND1-CB 3.41Å; H192-V195 WeakPolarHBondContact ND1-CG2 3.43Å; H192-V195 PolarHBondContact ND1-N 3.42Å; H192-V195 VanDerWaalsContact ND1-N 3.19Å; V195-L197 HydrophobicContact CB-CB 4.37Å; V195-L197 HydrophobicContact CG1-CB 4.09Å; V195-L197 PolarHBondContact O-N 2.82Å
196	L	92.4	Very high	94.5	Very high	96 Å²	96	29.2 Å²	29.2	50%	0.503	17%	0.172	S	C	.	.	S	Bend	trans	-73.7	60.3	174.1	-71.6	177	0	0	0	111.1	L212	L196-L212 HydrophobicContact CB-CB 4.16Å; L196-L212 WeakPolarHBondContact O-CB 3.41Å; L196-L212 PolarHBondContact O-N 3.4Å
197	L	94.6	Very high	94.4	Very high	18 Å²	18	29.2 Å²	29.2	9%	0.094	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135	-174.9	-172.4	78.4	0	0	0	110	H192 V195 L209 Y210 V218 F235 Y255	H192-L197 HydrophobicContact CB-CB 3.84Å; H192-L197 HydrophobicContact CB-CD2 4.45Å; H192-L197 PolarHBondContact N-O 2.81Å; V195-L197 HydrophobicContact CB-CB 4.37Å; V195-L197 HydrophobicContact CG1-CB 4.09Å; V195-L197 PolarHBondContact O-N 2.82Å; L197-L209 HydrophobicContact CD1-CB 4.27Å; L197-L209 HydrophobicContact CD2-CD1 4.31Å; L197-Y210 WeakPolarHBondContact CA-O 3.15Å; L197-V218 HydrophobicContact CD1-CG2 3.85Å; L197-F235 HydrophobicContact CD2-CZ 4.07Å; L197-Y255 HydrophobicContact CD2-CD2 3.79Å; L197-Y255 HydrophobicContact CD2-CE2 4.16Å
198	L	96.7	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.4	177.3	-170.8	76.1	0	0	0	109.7	V157 I165 L179 V189 F191 T200 L209 Y210 L212	V157-L198 HydrophobicContact CG1-CD1 4.5Å; V157-L198 HydrophobicContact CG1-CD2 4Å; V157-L198 HydrophobicContact CG2-CD1 4.13Å; V157-L198 HydrophobicContact CG2-CD2 4.16Å; I165-L198 HydrophobicContact CG2-CD2 4.2Å; L179-L198 HydrophobicContact CD1-CD2 4.01Å; V189-L198 HydrophobicContact CG1-CD1 3.63Å; V189-L198 HydrophobicContact CG1-CD2 4.41Å; V189-L198 HydrophobicContact CG1-CG 4.21Å; F191-L198 HydrophobicContact CD1-CD1 3.75Å; F191-L198 HydrophobicContact CD2-CD1 4.21Å; F191-L198 HydrophobicContact CE1-CD1 3.78Å; F191-L198 HydrophobicContact CE2-CD1 4.21Å; F191-L198 HydrophobicContact CG-CD1 4Å; F191-L198 HydrophobicContact CZ-CD1 4.02Å; L198-T200 HydrophobicContact CD2-CG2 3.79Å; L198-T200 HydrophobicContact CG-CG2 4.01Å; L198-L209 CarbonylContact O-C 3.53Å; L198-L209 WeakPolarHBondContact O-CA 3.3Å; L198-Y210 PolarHBondContact N-O 2.97Å; L198-Y210 PolarHBondContact O-N 2.87Å; L198-L212 HydrophobicContact CB-CD1 4.1Å; L198-L212 HydrophobicContact CB-CD2 3.84Å; L198-L212 HydrophobicContact CB-CG 4.07Å; L198-L212 HydrophobicContact CD2-CD2 4.39Å
199	A	97.1	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.2	166.6	0	0	0	0	0	110.3	V189 T190 R208 L209 I233 F235 L242	V189-A199 WeakPolarHBondContact CA-O 3.31Å; T190-A199 HydrophobicContact CG2-CB 3.84Å; T190-A199 PolarHBondContact N-O 3.25Å; T190-A199 PolarHBondContact O-N 3.43Å; A199-R208 CarbonylContact C-O 3.57Å; A199-R208 WeakPolarHBondContact CA-O 3.38Å; A199-L209 HydrophobicContact CB-CD2 3.49Å; A199-L209 VanDerWaalsContact CB-CD2 3.49Å; A199-I233 HydrophobicContact CB-CD1 3.87Å; A199-I233 WeakPolarHBondContact O-CD1 3.33Å; A199-F235 HydrophobicContact CB-CE2 3.6Å; A199-F235 HydrophobicContact CB-CZ 3.71Å; A199-L242 HydrophobicContact CB-CD1 4.14Å; A199-L242 HydrophobicContact CB-CD2 4.06Å
200	T	97.5	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.1	177.2	64.1	0	0	0	0	110.7	I165 H182 A188 V189 L198 V207 R208 Y210	I165-T200 HydrophobicContact CD1-CG2 3.71Å; I165-T200 HydrophobicContact CG1-CG2 4.11Å; H182-T200 PolarHBondContact NE2-OG1 2.85Å; A188-T200 CarbonylContact O-C 3.54Å; A188-T200 WeakPolarHBondContact O-CA 3.21Å; V189-T200 HydrophobicContact CG1-CG2 4.41Å; V189-T200 HydrophobicContact CG2-CG2 4.19Å; L198-T200 HydrophobicContact CD2-CG2 3.79Å; L198-T200 HydrophobicContact CG-CG2 4.01Å; T200-V207 CarbonylContact O-C 3.6Å; T200-V207 VanDerWaalsContact O-CA 3.24Å; T200-V207 WeakPolarHBondContact O-CA 3.27Å; T200-V207 WeakPolarHBondContact O-CG1 3.36Å; T200-R208 PolarHBondContact N-O 2.97Å; T200-R208 PolarHBondContact O-N 3.36Å; T200-Y210 HydrophobicContact CG2-CD2 4.41Å; T200-Y210 HydrophobicContact CG2-CE2 4.45Å; T200-Y210 WeakPolarHBondContact OG1-CE2 3.42Å
201	A	96.1	Very high	94.3	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.3	177	0	0	0	0	0	110.7	V186 V187 A188 V207 V230 I233	V186-A201 CarbonylContact C-O 3.55Å; V186-A201 WeakPolarHBondContact CG1-O 3.47Å; V187-A201 HydrophobicContact CG2-CB 4.35Å; V187-A201 WeakPolarHBondContact CG2-O 3.5Å; V187-A201 PolarHBondContact N-O 2.75Å; A188-A201 HydrophobicContact CB-CB 4.29Å; A188-A201 PolarHBondContact N-O 2.86Å; A188-A201 PolarHBondContact O-N 2.96Å; A201-V207 HydrophobicContact CB-CG2 3.94Å; A201-V230 HydrophobicContact CB-CB 4.14Å; A201-V230 HydrophobicContact CB-CG1 3.59Å; A201-I233 HydrophobicContact CB-CD1 4.07Å; A201-I233 HydrophobicContact CB-CG1 4.43Å; A201-I233 HydrophobicContact CB-CG2 3.85Å
202	S	95.8	Very high	94.2	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	161.6	-177.6	168.8	0	0	0	0	112.6	H182 G184 P185 D204 H205 T206	H182-S202 WeakPolarHBondContact ND1-CB 3.37Å; G184-S202 VanDerWaalsContact C-OG 3.23Å; G184-S202 PolarHBondContact O-OG 3.17Å; P185-S202 CarbonylContact O-C 3.59Å; P185-S202 VanDerWaalsContact O-CA 3.3Å; P185-S202 WeakPolarHBondContact O-CA 3.22Å; P185-S202 PolarHBondContact O-OG 3.19Å; P185-S202 VanDerWaalsContact O-OG 3.05Å; S202-D204 VanDerWaalsContact CB-OD1 3.3Å; S202-D204 WeakPolarHBondContact CB-OD1 3.37Å; S202-D204 PolarHBondContact O-N 3.2Å; S202-D204 PolarHBondContact OG-N 3.45Å; S202-D204 PolarHBondContact OG-OD1 3.25Å; S202-H205 PolarHBondContact O-N 3.14Å; S202-T206 PolarHBondContact N-O 3.31Å
203	A	93.9	Very high	94.1	Very high	49 Å²	49	34.7 Å²	34.7	41%	0.405	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-9.6	165	0	0	0	0	0	113.5	P185 H205	P185-A203 HydrophobicContact CB-CB 4.41Å; P185-A203 PolarHBondContact O-N 3.3Å; A203-H205 PolarHBondContact O-N 3Å
204	D	93.1	Very high	94.2	Very high	25 Å²	25	37 Å²	37	13%	0.134	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	7.2	168.9	75.7	5	0	0	0	114.7	H182 T183 S202 T206 R208	H182-D204 WeakPolarHBondContact CA-OD2 3.46Å; H182-D204 WeakPolarHBondContact CB-OD2 3.35Å; H182-D204 IonicContact CE1-OD1 3.59Å; H182-D204 IonicContact CG-OD2 3.61Å; H182-D204 IonicContact ND1-OD1 3.86Å; H182-D204 PolarHBondContact ND1-OD1 2.96Å; H182-D204 IonicContact ND1-OD2 2.77Å; H182-D204 PolarHBondContact ND1-OD2 3.21Å; T183-D204 PolarHBondContact N-OD2 3.31Å; T183-D204 VanDerWaalsContact OG1-CB 3.27Å; T183-D204 WeakPolarHBondContact OG1-CB 3.5Å; S202-D204 VanDerWaalsContact CB-OD1 3.3Å; S202-D204 WeakPolarHBondContact CB-OD1 3.37Å; S202-D204 PolarHBondContact O-N 3.2Å; S202-D204 PolarHBondContact OG-N 3.45Å; S202-D204 PolarHBondContact OG-OD1 3.25Å; D204-T206 VanDerWaalsContact CG-OG1 3.3Å; D204-T206 PolarHBondContact O-N 3.18Å; D204-T206 WeakPolarHBondContact OD1-CB 3.25Å; D204-T206 PolarHBondContact OD1-N 3.37Å; D204-T206 PolarHBondContact OD1-OG1 3.38Å; D204-T206 PolarHBondContact OD2-OG1 2.96Å; D204-R208 IonicContact OD2-NH2 3.74Å
205	H	93.3	Very high	94.4	Very high	56 Å²	56	35.3 Å²	35.3	26%	0.259	19%	0.186	S	C	.	.	S	Bend	trans	65.9	13	-177.5	-47.3	-71.4	0	0	0	115	S202 A203 L225 T228 N229	S202-H205 PolarHBondContact O-N 3.14Å; A203-H205 PolarHBondContact O-N 3Å; H205-L225 WeakPolarHBondContact O-CB 3.46Å; H205-T228 PolarHBondContact ND1-O 3.45Å; H205-N229 PolarHBondContact CE1-OD1 3.42Å
206	T	94.3	Very high	94.6	Very high	25 Å²	25	34.8 Å²	34.8	15%	0.153	18%	0.183	C	C	.	.			trans	-106.4	149.2	175.7	71.3	0	0	0	0	112.8	H182 S202 D204 R208 V220	H182-T206 PolarHBondContact CE1-O 3.02Å; H182-T206 PolarHBondContact CE1-OG1 3.48Å; H182-T206 VanDerWaalsContact CE1-OG1 3.25Å; H182-T206 PolarHBondContact ND1-OG1 2.95Å; H182-T206 VanDerWaalsContact ND1-OG1 3.13Å; S202-T206 PolarHBondContact N-O 3.31Å; D204-T206 VanDerWaalsContact CG-OG1 3.3Å; D204-T206 PolarHBondContact O-N 3.18Å; D204-T206 WeakPolarHBondContact OD1-CB 3.25Å; D204-T206 PolarHBondContact OD1-N 3.37Å; D204-T206 PolarHBondContact OD1-OG1 3.38Å; D204-T206 PolarHBondContact OD2-OG1 2.96Å; T206-R208 PolarHBondContact OG1-NE 3.42Å; T206-V220 HydrophobicContact CG2-CG1 4.14Å
207	V	95.8	Very high	94.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.9	158.8	-178.6	0	0	0	0	107.9	T200 A201 V220 T221 L225 V230 I233 L242 V244 M258	T200-V207 CarbonylContact O-C 3.6Å; T200-V207 VanDerWaalsContact O-CA 3.24Å; T200-V207 WeakPolarHBondContact O-CA 3.27Å; T200-V207 WeakPolarHBondContact O-CG1 3.36Å; A201-V207 HydrophobicContact CB-CG2 3.94Å; V207-V220 WeakPolarHBondContact O-CA 3.39Å; V207-T221 HydrophobicContact CB-CG2 3.75Å; V207-T221 HydrophobicContact CG2-CG2 4.4Å; V207-T221 PolarHBondContact N-OG1 3.38Å; V207-T221 PolarHBondContact O-N 2.86Å; V207-T221 PolarHBondContact O-OG1 3.46Å; V207-L225 HydrophobicContact CB-CD1 4.46Å; V207-L225 HydrophobicContact CG2-CD1 3.79Å; V207-V230 HydrophobicContact CG2-CG1 4.3Å; V207-V230 HydrophobicContact CG2-CG2 4.29Å; V207-I233 HydrophobicContact CG1-CD1 4.42Å; V207-I233 HydrophobicContact CG1-CG2 4.44Å; V207-I233 HydrophobicContact CG2-CG2 4.11Å; V207-L242 HydrophobicContact CG1-CD2 3.99Å; V207-V244 HydrophobicContact CG2-CG1 3.89Å; V207-V244 HydrophobicContact CG2-CG2 4.14Å; V207-M258 HydrophobicContact CG1-CE 4.5Å
208	R	95.7	Very high	94.7	Very high	33 Å²	33	37.1 Å²	37.1	13%	0.125	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.8	-177.1	-64.9	-178.2	-176.4	-135.5	10.8	110.2	G181 H182 A199 T200 D204 T206 Y210 A219 V220	G181-R208 VanDerWaalsContact CA-NH1 3.35Å; G181-R208 PolarHBondContact O-NH1 3.44Å; G181-R208 PolarHBondContact O-NH2 2.7Å; H182-R208 PolarHBondContact ND1-NE 3.23Å; A199-R208 CarbonylContact C-O 3.57Å; A199-R208 WeakPolarHBondContact CA-O 3.38Å; T200-R208 PolarHBondContact N-O 2.97Å; T200-R208 PolarHBondContact O-N 3.36Å; D204-R208 IonicContact OD2-NH2 3.74Å; T206-R208 PolarHBondContact OG1-NE 3.42Å; R208-Y210 HydrophobicContact CB-CD2 4.35Å; R208-Y210 HydrophobicContact CB-CE2 3.66Å; R208-A219 WeakPolarHBondContact CA-O 3.21Å; R208-V220 HydrophobicContact CG-CB 4.44Å; R208-V220 HydrophobicContact CG-CG1 3.95Å; R208-V220 HydrophobicContact CG-CG2 4.07Å
209	L	96.6	Very high	94.5	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.8	172.6	-63.4	-173.5	0	0	0	109.8	L197 L198 A199 Q217 V218 A219 F235 L242 Y255 M258	L197-L209 HydrophobicContact CD1-CB 4.27Å; L197-L209 HydrophobicContact CD2-CD1 4.31Å; L198-L209 CarbonylContact O-C 3.53Å; L198-L209 WeakPolarHBondContact O-CA 3.3Å; A199-L209 HydrophobicContact CB-CD2 3.49Å; A199-L209 VanDerWaalsContact CB-CD2 3.49Å; L209-Q217 CarbonylContact O-C 3.56Å; L209-Q217 WeakPolarHBondContact O-CA 3.25Å; L209-V218 HydrophobicContact CB-CG2 3.74Å; L209-V218 PolarHBondContact O-N 2.92Å; L209-A219 HydrophobicContact CB-CB 4.18Å; L209-A219 HydrophobicContact CD1-CB 4.21Å; L209-A219 HydrophobicContact CG-CB 4.41Å; L209-A219 PolarHBondContact N-O 3.24Å; L209-A219 PolarHBondContact O-N 3.07Å; L209-F235 HydrophobicContact CD2-CZ 4.17Å; L209-L242 HydrophobicContact CD2-CD2 4.29Å; L209-Y255 WeakPolarHBondContact CD1-O 3.3Å; L209-M258 HydrophobicContact CD1-CG 4.08Å; L209-M258 HydrophobicContact CD1-SD 3.41Å; L209-M258 WeakPolarHBondContact CD1-SD 3.26Å; L209-M258 HydrophobicContact CD2-SD 4.45Å; L209-M258 HydrophobicContact CG-CE 4.44Å; L209-M258 HydrophobicContact CG-SD 3.74Å
210	Y	96.3	Very high	94.3	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.2	176.6	-63.8	-92.6	0	0	0	110.3	I165 L179 L197 L198 T200 R208 T216 Q217	I165-Y210 HydrophobicContact CD1-CE2 4.2Å; L179-Y210 HydrophobicContact CB-CD1 3.98Å; L179-Y210 HydrophobicContact CB-CE1 3.77Å; L179-Y210 HydrophobicContact CD1-CD1 3.97Å; L179-Y210 HydrophobicContact CD1-CD2 4.26Å; L179-Y210 HydrophobicContact CD1-CG 3.81Å; L179-Y210 HydrophobicContact CD2-CD1 3.95Å; L179-Y210 HydrophobicContact CD2-CE1 4.45Å; L179-Y210 HydrophobicContact CG-CD1 4.18Å; L179-Y210 HydrophobicContact CG-CE1 4.47Å; L197-Y210 WeakPolarHBondContact CA-O 3.15Å; L198-Y210 PolarHBondContact N-O 2.97Å; L198-Y210 PolarHBondContact O-N 2.87Å; T200-Y210 HydrophobicContact CG2-CD2 4.41Å; T200-Y210 HydrophobicContact CG2-CE2 4.45Å; T200-Y210 WeakPolarHBondContact OG1-CE2 3.42Å; R208-Y210 HydrophobicContact CB-CD2 4.35Å; R208-Y210 HydrophobicContact CB-CE2 3.66Å; Y210-T216 CarbonylContact C-O 3.57Å; Y210-T216 VanDerWaalsContact CA-O 3.25Å; Y210-T216 WeakPolarHBondContact CA-O 3.32Å; Y210-Q217 HydrophobicContact CD1-CB 3.79Å; Y210-Q217 HydrophobicContact CD1-CG 4.29Å; Y210-Q217 HydrophobicContact CE1-CB 3.61Å; Y210-Q217 HydrophobicContact CE1-CG 3.97Å
211	D	94.5	Very high	94	Very high	29 Å²	29	41.1 Å²	41.1	16%	0.155	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.8	165.2	166.4	31.7	0	0	0	109.1	E213 N214 F215 T216 V218	D211-E213 WeakPolarHBondContact OD1-CB 3.47Å; D211-E213 PolarHBondContact OD1-N 3.03Å; D211-N214 WeakPolarHBondContact OD2-CB 3.12Å; D211-N214 PolarHBondContact OD2-N 3.2Å; D211-N214 PolarHBondContact OD2-ND2 3.21Å; D211-F215 CarbonylContact O-C 3.54Å; D211-F215 WeakPolarHBondContact O-CA 3.45Å; D211-F215 PolarHBondContact O-N 2.95Å; D211-T216 PolarHBondContact N-O 2.86Å; D211-T216 PolarHBondContact O-N 2.71Å; D211-T216 VanDerWaalsContact O-N 3.17Å; D211-V218 HydrophobicContact CB-CG1 3.59Å
212	L	93.4	Very high	93.3	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.3	-177.8	-57.6	-176.5	0	0	0	113.5	W155 L167 L179 F191 L196 L198 F215	W155-L212 HydrophobicContact CZ3-CB 4.47Å; L167-L212 HydrophobicContact CD2-CD2 4.04Å; L179-L212 HydrophobicContact CD1-CD2 4.47Å; F191-L212 HydrophobicContact CD1-CD1 3.8Å; F191-L212 HydrophobicContact CE1-CD1 3.56Å; L196-L212 HydrophobicContact CB-CB 4.16Å; L196-L212 WeakPolarHBondContact O-CB 3.41Å; L196-L212 PolarHBondContact O-N 3.4Å; L198-L212 HydrophobicContact CB-CD1 4.1Å; L198-L212 HydrophobicContact CB-CD2 3.84Å; L198-L212 HydrophobicContact CB-CG 4.07Å; L198-L212 HydrophobicContact CD2-CD2 4.39Å; L212-F215 WeakPolarHBondContact O-CE1 3.41Å
213	E	91.7	Very high	92.5	Very high	146 Å²	146	47.6 Å²	47.6	68%	0.682	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-45.7	165.9	-174.6	168.3	-161.3	0	0	110	D211	D211-E213 WeakPolarHBondContact OD1-CB 3.47Å; D211-E213 PolarHBondContact OD1-N 3.03Å
214	N	90.9	Very high	91.7	Very high	104 Å²	104	49.5 Å²	49.5	56%	0.556	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-5.9	-177.4	-60.8	-74.1	0	0	0	114.7	D211 T216	D211-N214 WeakPolarHBondContact OD2-CB 3.12Å; D211-N214 PolarHBondContact OD2-N 3.2Å; D211-N214 PolarHBondContact OD2-ND2 3.21Å; N214-T216 HydrophobicContact CB-CG2 4.07Å; N214-T216 PolarHBondContact O-N 3.17Å
215	F	92.5	Very high	91.2	Very high	70 Å²	70	48.3 Å²	48.3	31%	0.307	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	35.5	-172.4	-52.6	-63.7	0	0	0	113.8	W155 L167 A177 L179 D211 L212	W155-F215 HydrophobicContact CH2-CE1 4.05Å; W155-F215 AromaticContact CH2-CZ 3.78Å; W155-F215 HydrophobicContact CH2-CZ 3.78Å; W155-F215 HydrophobicContact CZ2-CZ 4.48Å; W155-F215 AromaticContact CZ3-CE1 3.79Å; W155-F215 HydrophobicContact CZ3-CE1 3.79Å; W155-F215 HydrophobicContact CZ3-CZ 4.01Å; L167-F215 HydrophobicContact CD2-CD1 3.83Å; L167-F215 HydrophobicContact CD2-CE1 3.51Å; A177-F215 HydrophobicContact CB-CB 4.01Å; A177-F215 HydrophobicContact CB-CD1 3.67Å; A177-F215 HydrophobicContact CB-CD2 3.96Å; A177-F215 HydrophobicContact CB-CE1 4.12Å; A177-F215 HydrophobicContact CB-CE2 4.37Å; A177-F215 HydrophobicContact CB-CG 3.59Å; A177-F215 HydrophobicContact CB-CZ 4.45Å; L179-F215 HydrophobicContact CD2-CB 3.93Å; L179-F215 VanDerWaalsContact CD2-O 3.31Å; L179-F215 WeakPolarHBondContact CD2-O 3.43Å; D211-F215 CarbonylContact O-C 3.54Å; D211-F215 WeakPolarHBondContact O-CA 3.45Å; D211-F215 PolarHBondContact O-N 2.95Å; L212-F215 WeakPolarHBondContact O-CE1 3.41Å
216	T	94.1	Very high	90.2	Very high	70 Å²	70	50.7 Å²	50.7	43%	0.429	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.4	-178.1	61.6	0	0	0	0	111.7	Y210 D211 N214 V218	Y210-T216 CarbonylContact C-O 3.57Å; Y210-T216 VanDerWaalsContact CA-O 3.25Å; Y210-T216 WeakPolarHBondContact CA-O 3.32Å; D211-T216 PolarHBondContact N-O 2.86Å; D211-T216 PolarHBondContact O-N 2.71Å; D211-T216 VanDerWaalsContact O-N 3.17Å; N214-T216 HydrophobicContact CB-CG2 4.07Å; N214-T216 PolarHBondContact O-N 3.17Å; T216-V218 PolarHBondContact O-N 3.4Å
217	Q	94.3	Very high	89.3	Confident	79 Å²	79	53.8 Å²	53.8	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.7	171.6	-170.7	-163.5	-91.7	0	0	109.2	L209 Y210 V220	L209-Q217 CarbonylContact O-C 3.56Å; L209-Q217 WeakPolarHBondContact O-CA 3.25Å; Y210-Q217 HydrophobicContact CD1-CB 3.79Å; Y210-Q217 HydrophobicContact CD1-CG 4.29Å; Y210-Q217 HydrophobicContact CE1-CB 3.61Å; Y210-Q217 HydrophobicContact CE1-CG 3.97Å; Q217-V220 HydrophobicContact CG-CG2 4.31Å
218	V	94.2	Very high	88.8	Confident	83 Å²	83	55.3 Å²	55.3	50%	0.503	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-30.4	-179.7	-66	0	0	0	0	113.1	L197 L209 D211 T216	L197-V218 HydrophobicContact CD1-CG2 3.85Å; L209-V218 HydrophobicContact CB-CG2 3.74Å; L209-V218 PolarHBondContact O-N 2.92Å; D211-V218 HydrophobicContact CB-CG1 3.59Å; T216-V218 PolarHBondContact O-N 3.4Å
219	A	93.2	Very high	88.5	Confident	22 Å²	22	57.6 Å²	57.6	18%	0.182	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	161.2	-179.7	0	0	0	0	0	113.5	R208 L209 M258	R208-A219 WeakPolarHBondContact CA-O 3.21Å; L209-A219 HydrophobicContact CB-CB 4.18Å; L209-A219 HydrophobicContact CD1-CB 4.21Å; L209-A219 HydrophobicContact CG-CB 4.41Å; L209-A219 PolarHBondContact N-O 3.24Å; L209-A219 PolarHBondContact O-N 3.07Å; A219-M258 HydrophobicContact CB-CB 4.48Å; A219-M258 HydrophobicContact CB-CG 3.42Å; A219-M258 VanDerWaalsContact CB-CG 3.42Å
220	V	93.3	Very high	88.3	Confident	53 Å²	53	57.7 Å²	57.7	32%	0.321	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	143.2	174.5	-169.6	0	0	0	0	108.2	T206 V207 R208 Q217	T206-V220 HydrophobicContact CG2-CG1 4.14Å; V207-V220 WeakPolarHBondContact O-CA 3.39Å; R208-V220 HydrophobicContact CG-CB 4.44Å; R208-V220 HydrophobicContact CG-CG1 3.95Å; R208-V220 HydrophobicContact CG-CG2 4.07Å; Q217-V220 HydrophobicContact CG-CG2 4.31Å
221	T	91.2	Very high	88.2	Confident	9 Å²	9	61.7 Å²	61.7	6%	0.055	35%	0.353	C	S	.	.			trans	-58.6	140.3	169.1	48.2	0	0	0	0	112	V207 L225 Y253 M258	V207-T221 HydrophobicContact CB-CG2 3.75Å; V207-T221 HydrophobicContact CG2-CG2 4.4Å; V207-T221 PolarHBondContact N-OG1 3.38Å; V207-T221 PolarHBondContact O-N 2.86Å; V207-T221 PolarHBondContact O-OG1 3.46Å; T221-L225 HydrophobicContact CG2-CD1 3.74Å; T221-L225 HydrophobicContact CG2-CG 4.36Å; T221-Y253 HydrophobicContact CG2-CE1 4.29Å; T221-M258 HydrophobicContact CG2-CE 3.36Å
222	G	81.5	Confident	88.2	Confident	48 Å²	48	62.7 Å²	62.7	50%	0.495	35%	0.354	S	S	.	.			trans	-68.7	-167.9	168	0	0	0	0	0	113.4	E224	G222-E224 PolarHBondContact O-N 3.4Å
223	S	78.3	Confident	88.3	Confident	88 Å²	88	63.1 Å²	63.1	62%	0.615	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-66.3	-1.1	-176.6	49.3	0	0	0	0	115.9	L225 N226	S223-L225 PolarHBondContact O-N 2.97Å; S223-N226 WeakPolarHBondContact CB-ND2 3.28Å; S223-N226 WeakPolarHBondContact O-CB 3.21Å; S223-N226 PolarHBondContact O-N 3.07Å; S223-N226 VanDerWaalsContact O-N 3.09Å
224	E	77.3	Confident	88.5	Confident	89 Å²	89	56.8 Å²	56.8	42%	0.416	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.6	-179	-57.6	179.6	162.4	0	0	114	G222 R251 Y253 C260	G222-E224 PolarHBondContact O-N 3.4Å; E224-R251 PolarHBondContact O-NH2 3.16Å; E224-Y253 WeakPolarHBondContact OE2-CE1 3.5Å; E224-Y253 PolarHBondContact OE2-OH 3.19Å; E224-C260 WeakPolarHBondContact OE2-CB 3.41Å
225	L	81.7	Confident	88.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-90.7	-6.1	177.9	-64.6	-170.7	0	0	0	113.5	H205 V207 T221 S223 A227 T228 V230 V244 Y253	H205-L225 WeakPolarHBondContact O-CB 3.46Å; V207-L225 HydrophobicContact CB-CD1 4.46Å; V207-L225 HydrophobicContact CG2-CD1 3.79Å; T221-L225 HydrophobicContact CG2-CD1 3.74Å; T221-L225 HydrophobicContact CG2-CG 4.36Å; S223-L225 PolarHBondContact O-N 2.97Å; L225-A227 PolarHBondContact O-N 3.43Å; L225-T228 PolarHBondContact O-N 2.88Å; L225-T228 PolarHBondContact O-OG1 2.95Å; L225-V230 HydrophobicContact CD1-CG2 3.9Å; L225-V244 HydrophobicContact CD1-CG1 4.22Å; L225-V244 HydrophobicContact CD2-CG1 4.26Å; L225-Y253 HydrophobicContact CD2-CE2 4.43Å
226	N	73	Confident	88.6	Confident	106 Å²	106	50.2 Å²	50.2	57%	0.567	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	135.5	-176.5	-73.5	0.7	0	0	0	111.7	S223 T228	S223-N226 WeakPolarHBondContact CB-ND2 3.28Å; S223-N226 WeakPolarHBondContact O-CB 3.21Å; S223-N226 PolarHBondContact O-N 3.07Å; S223-N226 VanDerWaalsContact O-N 3.09Å; N226-T228 PolarHBondContact O-N 3.41Å; N226-T228 VanDerWaalsContact O-N 3.14Å
227	A	76.1	Confident	88.3	Confident	91 Å²	91	49.4 Å²	49.4	75%	0.752	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	13.2	-175.6	0	0	0	0	0	115.7	L225	L225-A227 PolarHBondContact O-N 3.43Å
228	T	85	Confident	87.9	Confident	31 Å²	31	51.3 Å²	51.3	19%	0.19	31%	0.305	C	S	.	.			trans	-110.5	125.9	169.8	65.2	0	0	0	0	110.9	H205 L225 N226 V230 R251	H205-T228 PolarHBondContact ND1-O 3.45Å; L225-T228 PolarHBondContact O-N 2.88Å; L225-T228 PolarHBondContact O-OG1 2.95Å; N226-T228 PolarHBondContact O-N 3.41Å; N226-T228 VanDerWaalsContact O-N 3.14Å; T228-V230 PolarHBondContact O-N 3.48Å; T228-R251 PolarHBondContact OG1-NH1 3.23Å; T228-R251 VanDerWaalsContact OG1-NH1 3.08Å
229	N	88.5	Confident	87.6	Confident	81 Å²	81	47.7 Å²	47.7	43%	0.433	29%	0.285	S	S	.	.			trans	-75.6	117.1	176	-65	1.2	0	0	0	108.5	H205 T246 N247	H205-N229 PolarHBondContact CE1-OD1 3.42Å; N229-T246 VanDerWaalsContact O-CA 3.26Å; N229-T246 WeakPolarHBondContact O-CA 3.5Å; N229-N247 PolarHBondContact O-N 2.91Å
230	V	93.3	Very high	87.4	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.036	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.9	168.5	-171.3	0	0	0	0	108.1	A201 V207 L225 T228 I233 V244	A201-V230 HydrophobicContact CB-CB 4.14Å; A201-V230 HydrophobicContact CB-CG1 3.59Å; V207-V230 HydrophobicContact CG2-CG1 4.3Å; V207-V230 HydrophobicContact CG2-CG2 4.29Å; L225-V230 HydrophobicContact CD1-CG2 3.9Å; T228-V230 PolarHBondContact O-N 3.48Å; V230-I233 HydrophobicContact CG1-CG2 3.99Å; V230-V244 HydrophobicContact CG1-CG1 3.87Å; V230-V244 HydrophobicContact CG2-CG1 4.25Å
231	R	93.8	Very high	87.3	Confident	87 Å²	87	46.4 Å²	46.4	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-48.1	-176	-66.8	-66.5	-62	176.2	0.5	111.7	A245 N247 L274 D275	R231-A245 PolarHBondContact N-O 3.2Å; R231-N247 WeakPolarHBondContact CG-OD1 3.26Å; R231-L274 HydrophobicContact CB-CB 4.2Å; R231-L274 PolarHBondContact NE-O 3.41Å; R231-L274 PolarHBondContact NH2-O 3.42Å; R231-D275 IonicContact NH2-OD1 2.74Å
232	R	95	Very high	87.4	Confident	49 Å²	49	46 Å²	46	19%	0.185	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155.6	178	-67.3	-63.8	176.5	-108.5	1.5	110.6	V187 A245 L274 D275 M277	V187-R232 PolarHBondContact O-NH1 3.49Å; R232-A245 HydrophobicContact CB-CB 4.44Å; R232-A245 WeakPolarHBondContact O-CB 3.35Å; R232-A245 PolarHBondContact O-N 3.13Å; R232-L274 HydrophobicContact CB-CD2 4.22Å; R232-L274 HydrophobicContact CG-CD2 4.39Å; R232-D275 PolarHBondContact NE-O 2.89Å; R232-D275 PolarHBondContact NH2-O 2.82Å; R232-D275 IonicContact NH2-OD1 2.67Å; R232-M277 HydrophobicContact CB-CB 4.2Å; R232-M277 HydrophobicContact CB-CE 4.43Å
233	I	96.1	Very high	88	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.9	172.2	56	174.4	0	0	0	108.9	A188 T190 A199 A201 V207 V230 L242 Y243 V244	A188-I233 HydrophobicContact CB-CD1 4.49Å; A188-I233 HydrophobicContact CB-CG1 3.84Å; T190-I233 HydrophobicContact CG2-CB 4.32Å; T190-I233 HydrophobicContact CG2-CD1 3.84Å; T190-I233 HydrophobicContact CG2-CG1 3.74Å; A199-I233 HydrophobicContact CB-CD1 3.87Å; A199-I233 WeakPolarHBondContact O-CD1 3.33Å; A201-I233 HydrophobicContact CB-CD1 4.07Å; A201-I233 HydrophobicContact CB-CG1 4.43Å; A201-I233 HydrophobicContact CB-CG2 3.85Å; V207-I233 HydrophobicContact CG1-CD1 4.42Å; V207-I233 HydrophobicContact CG1-CG2 4.44Å; V207-I233 HydrophobicContact CG2-CG2 4.11Å; V230-I233 HydrophobicContact CG1-CG2 3.99Å; I233-L242 HydrophobicContact CB-CD1 4.37Å; I233-Y243 CarbonylContact C-O 3.59Å; I233-Y243 WeakPolarHBondContact CA-O 3.47Å; I233-V244 HydrophobicContact CG2-CB 4.43Å; I233-V244 HydrophobicContact CG2-CG1 4.29Å; I233-V244 HydrophobicContact CG2-CG2 4.11Å
234	A	95	Very high	88.8	Confident	14 Å²	14	39.5 Å²	39.5	12%	0.116	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	133.8	174.5	0	0	0	0	0	110.3	Y243 M277	A234-Y243 PolarHBondContact N-O 3.11Å; A234-Y243 VanDerWaalsContact O-CB 3.32Å; A234-Y243 WeakPolarHBondContact O-CB 3.43Å; A234-Y243 WeakPolarHBondContact O-CD2 3.31Å; A234-Y243 PolarHBondContact O-N 2.95Å; A234-M277 HydrophobicContact CB-CE 3.77Å
235	F	93.7	Very high	89.7	Confident	13 Å²	13	35.3 Å²	35.3	6%	0.057	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	152	166.2	-74.4	-75.2	0	0	0	110.9	T190 F191 H192 L197 A199 L209 L242 Y255	T190-F235 HydrophobicContact CG2-CD2 3.74Å; T190-F235 HydrophobicContact CG2-CE2 3.94Å; F191-F235 WeakPolarHBondContact O-CD2 3.41Å; H192-F235 HydrophobicContact CB-CD2 4.24Å; H192-F235 HydrophobicContact CB-CE2 4.05Å; H192-F235 HydrophobicContact CB-CZ 4.28Å; H192-F235 AromaticContact CD2-CD1 3.55Å; H192-F235 AromaticContact CD2-CE1 3.63Å; H192-F235 AromaticContact CD2-CG 3.92Å; L197-F235 HydrophobicContact CD2-CZ 4.07Å; A199-F235 HydrophobicContact CB-CE2 3.6Å; A199-F235 HydrophobicContact CB-CZ 3.71Å; L209-F235 HydrophobicContact CD2-CZ 4.17Å; F235-L242 HydrophobicContact CD1-CB 4.1Å; F235-L242 HydrophobicContact CD1-CD1 3.91Å; F235-L242 HydrophobicContact CD2-CD1 4.24Å; F235-L242 HydrophobicContact CE1-CB 4.03Å; F235-L242 HydrophobicContact CE1-CD1 3.94Å; F235-L242 HydrophobicContact CE1-CG 4.39Å; F235-L242 HydrophobicContact CE2-CD1 4.28Å; F235-L242 HydrophobicContact CG-CD1 4.08Å; F235-L242 HydrophobicContact CZ-CD1 4.14Å; F235-Y255 HydrophobicContact CE1-CD1 4.23Å; F235-Y255 AromaticContact CE1-CG 3.96Å; F235-Y255 HydrophobicContact CE1-CG 3.96Å
236	H	91.3	Very high	90.2	Very high	23 Å²	23	35.3 Å²	35.3	11%	0.106	20%	0.2	C	C	.	.			trans	-59.7	140.8	162.8	-172.3	-109.3	0	0	0	109.9	D238 G239 V240 C241 Y243	H236-D238 IonicContact CE1-OD2 3.01Å; H236-D238 PolarHBondContact CE1-OD2 2.91Å; H236-D238 VanDerWaalsContact CE1-OD2 3.23Å; H236-D238 PolarHBondContact ND1-N 2.91Å; H236-D238 IonicContact ND1-OD2 3.63Å; H236-D238 PolarHBondContact O-N 3.06Å; H236-D238 VanDerWaalsContact O-N 3.09Å; H236-G239 PolarHBondContact O-N 2.95Å; H236-V240 HydrophobicContact CB-CB 4.38Å; H236-C241 PolarHBondContact N-O 2.84Å; H236-Y243 HydrophobicContact CB-CE2 3.94Å; H236-Y243 PolarHBondContact CD2-OH 3.28Å
237	P	88.2	Confident	91	Very high	53 Å²	53	31.9 Å²	31.9	34%	0.344	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.9	-178.4	-31.7	39.1	0	0	0	115	P193 G239 V279 P281	P193-P237 WeakPolarHBondContact CB-O 3.37Å; P193-P237 WeakPolarHBondContact CG-O 3.43Å; P237-G239 VanDerWaalsContact C-N 3.34Å; P237-V279 HydrophobicContact CG-CB 4.17Å; P237-V279 HydrophobicContact CG-CG1 3.99Å; P237-P281 HydrophobicContact CB-CB 4.43Å; P237-P281 HydrophobicContact CB-CG 4.39Å; P237-P281 HydrophobicContact CG-CB 4.08Å; P237-P281 HydrophobicContact CG-CG 3.99Å
238	D	85.4	Confident	91.7	Very high	118 Å²	118	29.1 Å²	29.1	63%	0.631	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	2.6	176.6	-56.2	-35.8	0	0	0	113.8	H236 V240	H236-D238 IonicContact CE1-OD2 3.01Å; H236-D238 PolarHBondContact CE1-OD2 2.91Å; H236-D238 VanDerWaalsContact CE1-OD2 3.23Å; H236-D238 PolarHBondContact ND1-N 2.91Å; H236-D238 IonicContact ND1-OD2 3.63Å; H236-D238 PolarHBondContact O-N 3.06Å; H236-D238 VanDerWaalsContact O-N 3.09Å; D238-V240 HydrophobicContact CB-CG2 3.91Å
239	G	88.9	Confident	92	Very high	8 Å²	8	32 Å²	32	8%	0.082	16%	0.162	C	C	.	.	S	Bend	trans	72.6	35.6	179.4	0	0	0	0	0	114.4	H192 H236 P237 Y255	H192-G239 WeakPolarHBondContact NE2-CA 3.09Å; H192-G239 PolarHBondContact NE2-O 3.28Å; H236-G239 PolarHBondContact O-N 2.95Å; P237-G239 VanDerWaalsContact C-N 3.34Å; G239-Y255 WeakPolarHBondContact O-CE1 3.23Å
240	V	88.1	Confident	92.2	Very high	45 Å²	45	28.1 Å²	28.1	27%	0.273	14%	0.141	S	C	.	.	S	Bend	trans	-100.3	-31.9	-169.5	173	0	0	0	0	113.5	H236 D238 P308	H236-V240 HydrophobicContact CB-CB 4.38Å; D238-V240 HydrophobicContact CB-CG2 3.91Å; V240-P308 HydrophobicContact CG1-CG 4.02Å
241	C	91.4	Very high	92.2	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.02	15%	0.145	C	C	.	.			trans	-159	164.7	-178.1	62.2	0	0	0	0	110.4	H236 Y243 I252 Y253	H236-C241 PolarHBondContact N-O 2.84Å; C241-Y243 PolarHBondContact SG-OH 3.44Å; C241-I252 HydrophobicContact CB-CG2 4.04Å; C241-Y253 CarbonylContact C-O 3.58Å; C241-Y253 WeakPolarHBondContact CA-O 3.34Å; C241-Y253 WeakPolarHBondContact CB-O 3.28Å
242	L	94.4	Very high	92.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.2	177.3	179.3	63.3	0	0	0	110.6	T190 A199 V207 L209 I233 F235 V244 Y253	T190-L242 HydrophobicContact CG2-CD1 4.24Å; A199-L242 HydrophobicContact CB-CD1 4.14Å; A199-L242 HydrophobicContact CB-CD2 4.06Å; V207-L242 HydrophobicContact CG1-CD2 3.99Å; L209-L242 HydrophobicContact CD2-CD2 4.29Å; I233-L242 HydrophobicContact CB-CD1 4.37Å; F235-L242 HydrophobicContact CD1-CB 4.1Å; F235-L242 HydrophobicContact CD1-CD1 3.91Å; F235-L242 HydrophobicContact CD2-CD1 4.24Å; F235-L242 HydrophobicContact CE1-CB 4.03Å; F235-L242 HydrophobicContact CE1-CD1 3.94Å; F235-L242 HydrophobicContact CE1-CG 4.39Å; F235-L242 HydrophobicContact CE2-CD1 4.28Å; F235-L242 HydrophobicContact CG-CD1 4.08Å; F235-L242 HydrophobicContact CZ-CD1 4.14Å; L242-V244 HydrophobicContact CD2-CG2 4.26Å; L242-V244 HydrophobicContact CG-CG2 4.09Å; L242-Y253 PolarHBondContact N-O 3.05Å; L242-Y253 PolarHBondContact O-N 3.01Å
243	Y	94.5	Very high	92	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.8	170.5	-61.5	-62.8	0	0	0	109.7	I233 A234 H236 C241 L250 I252 V279 L286 V303 C306	I233-Y243 CarbonylContact C-O 3.59Å; I233-Y243 WeakPolarHBondContact CA-O 3.47Å; A234-Y243 PolarHBondContact N-O 3.11Å; A234-Y243 VanDerWaalsContact O-CB 3.32Å; A234-Y243 WeakPolarHBondContact O-CB 3.43Å; A234-Y243 WeakPolarHBondContact O-CD2 3.31Å; A234-Y243 PolarHBondContact O-N 2.95Å; H236-Y243 HydrophobicContact CB-CE2 3.94Å; H236-Y243 PolarHBondContact CD2-OH 3.28Å; C241-Y243 PolarHBondContact SG-OH 3.44Å; Y243-L250 HydrophobicContact CD1-CD1 4.19Å; Y243-L250 HydrophobicContact CD1-CD2 4.45Å; Y243-L250 HydrophobicContact CG-CD1 4.46Å; Y243-I252 HydrophobicContact CD1-CD1 4.42Å; Y243-I252 HydrophobicContact CD1-CG1 4.06Å; Y243-I252 HydrophobicContact CD1-CG2 4.42Å; Y243-I252 HydrophobicContact CE1-CD1 4.03Å; Y243-I252 HydrophobicContact CE1-CG1 4.11Å; Y243-I252 HydrophobicContact CE1-CG2 4.11Å; Y243-V279 HydrophobicContact CD2-CG2 4.01Å; Y243-V279 HydrophobicContact CE2-CG2 4.06Å; Y243-L286 HydrophobicContact CD1-CD1 4.14Å; Y243-L286 HydrophobicContact CD2-CD1 4.19Å; Y243-L286 HydrophobicContact CG-CD1 3.89Å; Y243-V303 HydrophobicContact CE1-CG1 3.78Å; Y243-V303 WeakPolarHBondContact OH-CG1 3.29Å; Y243-C306 PolarHBondContact OH-SG 2.83Å
244	V	95.2	Very high	91.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	107.8	176.1	179.4	0	0	0	0	108.9	V207 L225 V230 I233 L242 R251 Y253	V207-V244 HydrophobicContact CG2-CG1 3.89Å; V207-V244 HydrophobicContact CG2-CG2 4.14Å; L225-V244 HydrophobicContact CD1-CG1 4.22Å; L225-V244 HydrophobicContact CD2-CG1 4.26Å; V230-V244 HydrophobicContact CG1-CG1 3.87Å; V230-V244 HydrophobicContact CG2-CG1 4.25Å; I233-V244 HydrophobicContact CG2-CB 4.43Å; I233-V244 HydrophobicContact CG2-CG1 4.29Å; I233-V244 HydrophobicContact CG2-CG2 4.11Å; L242-V244 HydrophobicContact CD2-CG2 4.26Å; L242-V244 HydrophobicContact CG-CG2 4.09Å; V244-R251 HydrophobicContact CB-CB 4.4Å; V244-R251 PolarHBondContact N-O 3.25Å; V244-R251 PolarHBondContact O-N 3.09Å; V244-Y253 HydrophobicContact CB-CD2 3.96Å; V244-Y253 HydrophobicContact CB-CE2 4Å; V244-Y253 HydrophobicContact CG2-CD2 3.51Å; V244-Y253 HydrophobicContact CG2-CE2 3.91Å; V244-Y253 HydrophobicContact CG2-CG 4.47Å
245	A	94.5	Very high	91.6	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	-94.3	125.6	-179	0	0	0	0	0	111.5	R231 R232 W268 L274 M277	R231-A245 PolarHBondContact N-O 3.2Å; R232-A245 HydrophobicContact CB-CB 4.44Å; R232-A245 WeakPolarHBondContact O-CB 3.35Å; R232-A245 PolarHBondContact O-N 3.13Å; A245-W268 HydrophobicContact CB-CE3 4.41Å; A245-W268 HydrophobicContact CB-CH2 3.68Å; A245-W268 HydrophobicContact CB-CZ3 3.46Å; A245-W268 VanDerWaalsContact CB-CZ3 3.46Å; A245-L274 HydrophobicContact CB-CD2 3.31Å; A245-M277 HydrophobicContact CB-CE 4.29Å; A245-M277 HydrophobicContact CB-SD 3.78Å
246	T	93.4	Very high	91.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-175.8	173.1	66.9	0	0	0	0	110.7	N229 D248 Y249 W268	N229-T246 VanDerWaalsContact O-CA 3.26Å; N229-T246 WeakPolarHBondContact O-CA 3.5Å; T246-D248 VanDerWaalsContact C-N 3.28Å; T246-D248 PolarHBondContact O-N 3Å; T246-Y249 PolarHBondContact N-O 2.72Å; T246-Y249 PolarHBondContact OG1-N 3.15Å; T246-Y249 VanDerWaalsContact OG1-N 3.16Å; T246-Y249 PolarHBondContact OG1-O 3.45Å; T246-W268 VanDerWaalsContact O-CE3 3.31Å
247	N	90	Very high	91.2	Very high	34 Å²	34	35.4 Å²	35.4	18%	0.182	18%	0.181	C	C	.	.	S	Bend	trans	-59.2	-33.6	177.5	-70.7	-9.7	0	0	0	114.2	N229 R231 W268 R269	N229-N247 PolarHBondContact O-N 2.91Å; R231-N247 WeakPolarHBondContact CG-OD1 3.26Å; N247-W268 CarbonylContact O-C 3.57Å; N247-W268 WeakPolarHBondContact O-CB 3.28Å; N247-R269 PolarHBondContact O-N 3.1Å
248	D	89.2	Confident	91.2	Very high	33 Å²	33	33.6 Å²	33.6	18%	0.176	17%	0.168	C	C	.	.	S	Bend	trans	-119.7	-30.3	-171.4	-60.4	-69.9	0	0	0	113	T246 V266 G267 R269	T246-D248 VanDerWaalsContact C-N 3.28Å; T246-D248 PolarHBondContact O-N 3Å; D248-V266 PolarHBondContact O-N 3.19Å; D248-G267 PolarHBondContact O-N 3.44Å; D248-R269 VanDerWaalsContact CG-NE 3.31Å; D248-R269 WeakPolarHBondContact OD1-CB 3.2Å; D248-R269 WeakPolarHBondContact OD1-CD 3.33Å; D248-R269 IonicContact OD1-CZ 3.79Å; D248-R269 IonicContact OD1-NE 3.92Å; D248-R269 PolarHBondContact OD1-NE 2.88Å; D248-R269 IonicContact OD2-CZ 3.23Å; D248-R269 VanDerWaalsContact OD2-CZ 3.29Å; D248-R269 IonicContact OD2-NE 2.79Å; D248-R269 PolarHBondContact OD2-NE 2.95Å; D248-R269 IonicContact OD2-NH2 3.76Å; D248-R269 PolarHBondContact OD2-NH2 2.85Å
249	Y	91.9	Very high	91.4	Very high	90 Å²	90	30.2 Å²	30.2	35%	0.353	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.6	-171.1	-56	-87.6	0	0	0	112.8	T246 T263 V264 H265	T246-Y249 PolarHBondContact N-O 2.72Å; T246-Y249 PolarHBondContact OG1-N 3.15Å; T246-Y249 VanDerWaalsContact OG1-N 3.16Å; T246-Y249 PolarHBondContact OG1-O 3.45Å; Y249-T263 HydrophobicContact CD1-CG2 3.58Å; Y249-T263 HydrophobicContact CE1-CG2 4.35Å; Y249-T263 HydrophobicContact CG-CG2 3.94Å; Y249-V264 CarbonylContact C-O 3.58Å; Y249-V264 VanDerWaalsContact CA-O 3.31Å; Y249-V264 WeakPolarHBondContact CA-O 3.34Å; Y249-H265 HydrophobicContact CD1-CB 3.92Å; Y249-H265 HydrophobicContact CE1-CB 3.83Å; Y249-H265 AromaticContact CE1-CD2 3.6Å; Y249-H265 AromaticContact CZ-CD2 3.86Å
250	L	93.4	Very high	91.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.6	157.1	174.5	61.2	0	0	0	108.1	Y243 V264 V266 W268 M277 L286 V301	Y243-L250 HydrophobicContact CD1-CD1 4.19Å; Y243-L250 HydrophobicContact CD1-CD2 4.45Å; Y243-L250 HydrophobicContact CG-CD1 4.46Å; L250-V264 HydrophobicContact CB-CB 4.42Å; L250-V264 PolarHBondContact N-O 2.89Å; L250-V264 PolarHBondContact O-N 3Å; L250-V266 HydrophobicContact CB-CG2 3.79Å; L250-W268 HydrophobicContact CB-CH2 3.76Å; L250-W268 HydrophobicContact CB-CZ3 3.98Å; L250-W268 HydrophobicContact CD1-CH2 4.18Å; L250-W268 HydrophobicContact CG-CH2 4.41Å; L250-M277 HydrophobicContact CD1-SD 4.4Å; L250-L286 HydrophobicContact CD1-CD1 4.29Å; L250-L286 HydrophobicContact CD2-CD1 3.9Å; L250-L286 HydrophobicContact CD2-CD2 4.24Å; L250-V301 HydrophobicContact CD2-CB 4.39Å; L250-V301 HydrophobicContact CD2-CG1 4.15Å; L250-V301 HydrophobicContact CD2-CG2 4.23Å
251	R	92.4	Very high	91.5	Very high	31 Å²	31	34.2 Å²	34.2	12%	0.117	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145.6	170.2	-64.2	-170.1	173.5	111.5	-13.2	109.8	E224 T228 V244 Y253 E262 T263	E224-R251 PolarHBondContact O-NH2 3.16Å; T228-R251 PolarHBondContact OG1-NH1 3.23Å; T228-R251 VanDerWaalsContact OG1-NH1 3.08Å; V244-R251 HydrophobicContact CB-CB 4.4Å; V244-R251 PolarHBondContact N-O 3.25Å; V244-R251 PolarHBondContact O-N 3.09Å; R251-Y253 HydrophobicContact CB-CD2 4.19Å; R251-Y253 HydrophobicContact CB-CE2 3.63Å; R251-E262 WeakPolarHBondContact CA-O 3.48Å; R251-T263 HydrophobicContact CG-CG2 4.17Å
252	I	92.6	Very high	91.4	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.8	-179.9	-49.7	-174.7	0	0	0	106.9	M1 C241 Y243 C260 L261 E262	M1-I252 HydrophobicContact CE-CD1 3.21Å; M1-I252 HydrophobicContact SD-CD1 3.64Å; C241-I252 HydrophobicContact CB-CG2 4.04Å; Y243-I252 HydrophobicContact CD1-CD1 4.42Å; Y243-I252 HydrophobicContact CD1-CG1 4.06Å; Y243-I252 HydrophobicContact CD1-CG2 4.42Å; Y243-I252 HydrophobicContact CE1-CD1 4.03Å; Y243-I252 HydrophobicContact CE1-CG1 4.11Å; Y243-I252 HydrophobicContact CE1-CG2 4.11Å; I252-C260 CarbonylContact O-C 3.54Å; I252-L261 PolarHBondContact O-N 3.47Å; I252-E262 HydrophobicContact CB-CB 4.4Å; I252-E262 HydrophobicContact CD1-CB 4.18Å; I252-E262 HydrophobicContact CG1-CB 4.41Å; I252-E262 PolarHBondContact N-O 2.85Å; I252-E262 PolarHBondContact O-N 2.82Å
253	Y	92.5	Very high	91.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.4	-178.3	-78.5	-91.1	0	0	0	110.8	T221 E224 L225 C241 L242 V244 R251 Y255 S259 C260	T221-Y253 HydrophobicContact CG2-CE1 4.29Å; E224-Y253 WeakPolarHBondContact OE2-CE1 3.5Å; E224-Y253 PolarHBondContact OE2-OH 3.19Å; L225-Y253 HydrophobicContact CD2-CE2 4.43Å; C241-Y253 CarbonylContact C-O 3.58Å; C241-Y253 WeakPolarHBondContact CA-O 3.34Å; C241-Y253 WeakPolarHBondContact CB-O 3.28Å; L242-Y253 PolarHBondContact N-O 3.05Å; L242-Y253 PolarHBondContact O-N 3.01Å; V244-Y253 HydrophobicContact CB-CD2 3.96Å; V244-Y253 HydrophobicContact CB-CE2 4Å; V244-Y253 HydrophobicContact CG2-CD2 3.51Å; V244-Y253 HydrophobicContact CG2-CE2 3.91Å; V244-Y253 HydrophobicContact CG2-CG 4.47Å; R251-Y253 HydrophobicContact CB-CD2 4.19Å; R251-Y253 HydrophobicContact CB-CE2 3.63Å; Y253-Y255 PolarHBondContact O-N 3.08Å; Y253-S259 VanDerWaalsContact CA-O 3.31Å; Y253-S259 WeakPolarHBondContact CA-O 3.37Å; Y253-S259 VanDerWaalsContact CD1-C 3.44Å; Y253-S259 WeakPolarHBondContact CD1-O 3.39Å; Y253-C260 HydrophobicContact CD1-CB 4.24Å; Y253-C260 HydrophobicContact CE1-CB 3.69Å; Y253-C260 HydrophobicContact CE2-CB 4.41Å
254	D	91.8	Very high	91	Very high	32 Å²	32	40.9 Å²	40.9	17%	0.171	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	118.4	149	169.3	13.5	0	0	0	106.7	E256 N257 M258 S259 L261	D254-E256 PolarHBondContact OD1-N 2.8Å; D254-N257 WeakPolarHBondContact OD2-CB 3.34Å; D254-N257 PolarHBondContact OD2-ND2 3Å; D254-M258 CarbonylContact O-C 3.59Å; D254-M258 WeakPolarHBondContact O-CA 3.49Å; D254-M258 PolarHBondContact O-N 2.88Å; D254-S259 PolarHBondContact N-O 2.91Å; D254-S259 PolarHBondContact O-N 3.45Å; D254-L261 HydrophobicContact CB-CD1 4.02Å; D254-L261 HydrophobicContact CB-CD2 4.02Å; D254-L261 HydrophobicContact CB-CG 4.04Å
255	Y	90.3	Very high	90.8	Very high	32 Å²	32	46.3 Å²	46.3	13%	0.125	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-19.7	-175.4	71.2	-94.3	0	0	0	112.3	H192 L197 L209 F235 G239 Y253	H192-Y255 AromaticContact NE2-CE1 3.82Å; H192-Y255 AromaticContact NE2-CZ 3.81Å; L197-Y255 HydrophobicContact CD2-CD2 3.79Å; L197-Y255 HydrophobicContact CD2-CE2 4.16Å; L209-Y255 WeakPolarHBondContact CD1-O 3.3Å; F235-Y255 HydrophobicContact CE1-CD1 4.23Å; F235-Y255 AromaticContact CE1-CG 3.96Å; F235-Y255 HydrophobicContact CE1-CG 3.96Å; G239-Y255 WeakPolarHBondContact O-CE1 3.23Å; Y253-Y255 PolarHBondContact O-N 3.08Å
256	E	89.1	Confident	90.5	Very high	137 Å²	137	46.8 Å²	46.8	64%	0.64	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-44.1	-179.3	-60.7	-170.5	161.5	0	0	110.4	D254	D254-E256 PolarHBondContact OD1-N 2.8Å
257	N	87.4	Confident	90.2	Very high	122 Å²	122	47.5 Å²	47.5	65%	0.652	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.7	178.1	-61.5	-72	0	0	0	113.8	D254 S259	D254-N257 WeakPolarHBondContact OD2-CB 3.34Å; D254-N257 PolarHBondContact OD2-ND2 3Å; N257-S259 PolarHBondContact O-N 2.99Å
258	M	89.6	Confident	90.2	Very high	15 Å²	15	45.9 Å²	45.9	7%	0.074	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	36.9	-171.4	-70.4	-59.6	-70.2	0	0	114.1	V207 L209 A219 T221 D254	V207-M258 HydrophobicContact CG1-CE 4.5Å; L209-M258 HydrophobicContact CD1-CG 4.08Å; L209-M258 HydrophobicContact CD1-SD 3.41Å; L209-M258 WeakPolarHBondContact CD1-SD 3.26Å; L209-M258 HydrophobicContact CD2-SD 4.45Å; L209-M258 HydrophobicContact CG-CE 4.44Å; L209-M258 HydrophobicContact CG-SD 3.74Å; A219-M258 HydrophobicContact CB-CB 4.48Å; A219-M258 HydrophobicContact CB-CG 3.42Å; A219-M258 VanDerWaalsContact CB-CG 3.42Å; T221-M258 HydrophobicContact CG2-CE 3.36Å; D254-M258 CarbonylContact O-C 3.59Å; D254-M258 WeakPolarHBondContact O-CA 3.49Å; D254-M258 PolarHBondContact O-N 2.88Å
259	S	89.8	Confident	90.2	Very high	48 Å²	48	51.4 Å²	51.4	34%	0.336	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.7	179.9	71.6	0	0	0	0	111.8	Y253 D254 N257 L261	Y253-S259 VanDerWaalsContact CA-O 3.31Å; Y253-S259 WeakPolarHBondContact CA-O 3.37Å; Y253-S259 VanDerWaalsContact CD1-C 3.44Å; Y253-S259 WeakPolarHBondContact CD1-O 3.39Å; D254-S259 PolarHBondContact N-O 2.91Å; D254-S259 PolarHBondContact O-N 3.45Å; N257-S259 PolarHBondContact O-N 2.99Å; S259-L261 PolarHBondContact O-N 3.46Å
260	C	90.4	Very high	89.8	Confident	36 Å²	36	51.3 Å²	51.3	24%	0.243	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.5	176.7	-174.3	0	0	0	0	111	E224 I252 Y253 T263	E224-C260 WeakPolarHBondContact OE2-CB 3.41Å; I252-C260 CarbonylContact O-C 3.54Å; Y253-C260 HydrophobicContact CD1-CB 4.24Å; Y253-C260 HydrophobicContact CE1-CB 3.69Å; Y253-C260 HydrophobicContact CE2-CB 4.41Å; C260-T263 PolarHBondContact SG-OG1 2.88Å; C260-T263 VanDerWaalsContact SG-OG1 3.41Å
261	L	88.6	Confident	89.1	Confident	101 Å²	101	51.4 Å²	51.4	53%	0.529	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-44.6	179.1	-59.2	176.6	0	0	0	112.5	I252 D254 S259	I252-L261 PolarHBondContact O-N 3.47Å; D254-L261 HydrophobicContact CB-CD1 4.02Å; D254-L261 HydrophobicContact CB-CD2 4.02Å; D254-L261 HydrophobicContact CB-CG 4.04Å; S259-L261 PolarHBondContact O-N 3.46Å
262	E	88.8	Confident	88.6	Confident	63 Å²	63	52.5 Å²	52.5	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	142	-179.5	-170	177.4	168.5	0	0	110.3	M1 R251 I252 V264	M1-E262 PolarHBondContact N-OE1 2.92Å; R251-E262 WeakPolarHBondContact CA-O 3.48Å; I252-E262 HydrophobicContact CB-CB 4.4Å; I252-E262 HydrophobicContact CD1-CB 4.18Å; I252-E262 HydrophobicContact CG1-CB 4.41Å; I252-E262 PolarHBondContact N-O 2.85Å; I252-E262 PolarHBondContact O-N 2.82Å; E262-V264 HydrophobicContact CG-CG2 3.98Å
263	T	90.8	Very high	88.4	Confident	68 Å²	68	52.6 Å²	52.6	42%	0.417	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.9	169.7	-68.4	0	0	0	0	109.1	Y249 R251 C260	Y249-T263 HydrophobicContact CD1-CG2 3.58Å; Y249-T263 HydrophobicContact CE1-CG2 4.35Å; Y249-T263 HydrophobicContact CG-CG2 3.94Å; R251-T263 HydrophobicContact CG-CG2 4.17Å; C260-T263 PolarHBondContact SG-OG1 2.88Å; C260-T263 VanDerWaalsContact SG-OG1 3.41Å
264	V	90	Very high	88.5	Confident	11 Å²	11	52.6 Å²	52.6	7%	0.067	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.3	-176.7	-174	0	0	0	0	108.9	M1 A3 Y249 L250 E262 V266 V301	M1-V264 HydrophobicContact CB-CG1 4.25Å; M1-V264 HydrophobicContact CB-CG2 3.92Å; M1-V264 HydrophobicContact CG-CG2 4.25Å; M1-V264 HydrophobicContact SD-CG2 4.18Å; A3-V264 HydrophobicContact CB-CG1 4.22Å; Y249-V264 CarbonylContact C-O 3.58Å; Y249-V264 VanDerWaalsContact CA-O 3.31Å; Y249-V264 WeakPolarHBondContact CA-O 3.34Å; L250-V264 HydrophobicContact CB-CB 4.42Å; L250-V264 PolarHBondContact N-O 2.89Å; L250-V264 PolarHBondContact O-N 3Å; E262-V264 HydrophobicContact CG-CG2 3.98Å; V264-V266 HydrophobicContact CG1-CG2 4.35Å; V264-V266 PolarHBondContact O-N 3.4Å; V264-V301 HydrophobicContact CG1-CG1 4.29Å
265	H	90.8	Very high	88.6	Confident	115 Å²	115	52.6 Å²	52.6	53%	0.532	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	118.4	171.8	-174.6	-70.3	0	0	0	109.7	Y249	Y249-H265 HydrophobicContact CD1-CB 3.92Å; Y249-H265 HydrophobicContact CE1-CB 3.83Å; Y249-H265 AromaticContact CE1-CD2 3.6Å; Y249-H265 AromaticContact CZ-CD2 3.86Å
266	V	88.7	Confident	88.8	Confident	10 Å²	10	51.5 Å²	51.5	6%	0.061	29%	0.293	C	S	.	.			trans	-107	-26.8	-177.9	-172.4	0	0	0	0	111.9	A3 D248 L250 V264 W268 Y299 V301	A3-V266 HydrophobicContact CB-CB 4.36Å; A3-V266 HydrophobicContact CB-CG1 4.17Å; A3-V266 HydrophobicContact CB-CG2 4.14Å; D248-V266 PolarHBondContact O-N 3.19Å; L250-V266 HydrophobicContact CB-CG2 3.79Å; V264-V266 HydrophobicContact CG1-CG2 4.35Å; V264-V266 PolarHBondContact O-N 3.4Å; V266-W268 HydrophobicContact CB-CD2 3.87Å; V266-W268 HydrophobicContact CB-CE3 4.18Å; V266-W268 HydrophobicContact CB-CG 4.3Å; V266-W268 HydrophobicContact CB-CZ2 4.25Å; V266-W268 HydrophobicContact CG1-CD2 3.87Å; V266-W268 VanDerWaalsContact CG1-CE2 3.43Å; V266-W268 HydrophobicContact CG1-CG 4.09Å; V266-W268 HydrophobicContact CG1-CZ2 3.93Å; V266-W268 VanDerWaalsContact CG1-NE1 3.3Å; V266-W268 HydrophobicContact CG2-CH2 4.21Å; V266-W268 HydrophobicContact CG2-CZ2 4.16Å; V266-W268 HydrophobicContact CG2-CZ3 4.35Å; V266-Y299 HydrophobicContact CG1-CD1 4.19Å; V266-Y299 HydrophobicContact CG1-CG 4.32Å; V266-V301 HydrophobicContact CG1-CG2 4.01Å; V266-V301 HydrophobicContact CG2-CG2 3.76Å
267	G	86	Confident	89.1	Confident	15 Å²	15	45.5 Å²	45.5	16%	0.155	27%	0.265	C	S	.	.			trans	82.2	19	178.1	0	0	0	0	0	114.8	D248 R269 A270	D248-G267 PolarHBondContact O-N 3.44Å; G267-R269 PolarHBondContact O-N 2.96Å; G267-R269 VanDerWaalsContact O-N 3.14Å; G267-A270 WeakPolarHBondContact O-CB 3.34Å; G267-A270 PolarHBondContact O-N 3.07Å
268	W	91	Very high	89.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-53.6	-33.4	-177.3	-70.6	-44.9	0	0	0	114.6	A245 T246 N247 L250 V266 A270 G271 G273 L274 M277 L286 Y299	A245-W268 HydrophobicContact CB-CE3 4.41Å; A245-W268 HydrophobicContact CB-CH2 3.68Å; A245-W268 HydrophobicContact CB-CZ3 3.46Å; A245-W268 VanDerWaalsContact CB-CZ3 3.46Å; T246-W268 VanDerWaalsContact O-CE3 3.31Å; N247-W268 CarbonylContact O-C 3.57Å; N247-W268 WeakPolarHBondContact O-CB 3.28Å; L250-W268 HydrophobicContact CB-CH2 3.76Å; L250-W268 HydrophobicContact CB-CZ3 3.98Å; L250-W268 HydrophobicContact CD1-CH2 4.18Å; L250-W268 HydrophobicContact CG-CH2 4.41Å; V266-W268 HydrophobicContact CB-CD2 3.87Å; V266-W268 HydrophobicContact CB-CE3 4.18Å; V266-W268 HydrophobicContact CB-CG 4.3Å; V266-W268 HydrophobicContact CB-CZ2 4.25Å; V266-W268 HydrophobicContact CG1-CD2 3.87Å; V266-W268 VanDerWaalsContact CG1-CE2 3.43Å; V266-W268 HydrophobicContact CG1-CG 4.09Å; V266-W268 HydrophobicContact CG1-CZ2 3.93Å; V266-W268 VanDerWaalsContact CG1-NE1 3.3Å; V266-W268 HydrophobicContact CG2-CH2 4.21Å; V266-W268 HydrophobicContact CG2-CZ2 4.16Å; V266-W268 HydrophobicContact CG2-CZ3 4.35Å; W268-A270 PolarHBondContact O-N 3.26Å; W268-G271 PolarHBondContact O-N 2.92Å; W268-G273 WeakPolarHBondContact O-CA 3.41Å; W268-G273 PolarHBondContact O-N 2.85Å; W268-L274 HydrophobicContact CB-CB 4.34Å; W268-L274 HydrophobicContact CD2-CB 4.15Å; W268-L274 HydrophobicContact CD2-CD1 4.06Å; W268-L274 HydrophobicContact CD2-CD2 4.26Å; W268-L274 HydrophobicContact CD2-CG 4.42Å; W268-L274 HydrophobicContact CE3-CB 4.33Å; W268-L274 HydrophobicContact CE3-CD2 4.16Å; W268-L274 HydrophobicContact CG-CB 4.21Å; W268-L274 HydrophobicContact CG-CD1 4.22Å; W268-L274 HydrophobicContact CH2-CD2 3.89Å; W268-L274 HydrophobicContact CZ2-CD1 4.08Å; W268-L274 HydrophobicContact CZ2-CD2 4.03Å; W268-L274 HydrophobicContact CZ3-CD2 4Å; W268-M277 HydrophobicContact CH2-SD 4.18Å; W268-L286 HydrophobicContact CZ2-CD2 4.19Å; W268-Y299 AromaticContact CD1-CD2 3.47Å; W268-Y299 VanDerWaalsContact CD1-CD2 3.47Å; W268-Y299 AromaticContact CD1-CG 3.66Å; W268-Y299 AromaticContact NE1-CD2 4Å; W268-Y299 AromaticContact NE1-CG 3.87Å
269	R	88.3	Confident	89.5	Confident	149 Å²	149	39.9 Å²	39.9	56%	0.562	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-52	-36.6	173.6	-178.7	-172.5	-65.5	-104.9	4.3	113	N247 D248 G267 G271 G272	N247-R269 PolarHBondContact O-N 3.1Å; D248-R269 VanDerWaalsContact CG-NE 3.31Å; D248-R269 WeakPolarHBondContact OD1-CB 3.2Å; D248-R269 WeakPolarHBondContact OD1-CD 3.33Å; D248-R269 IonicContact OD1-CZ 3.79Å; D248-R269 IonicContact OD1-NE 3.92Å; D248-R269 PolarHBondContact OD1-NE 2.88Å; D248-R269 IonicContact OD2-CZ 3.23Å; D248-R269 VanDerWaalsContact OD2-CZ 3.29Å; D248-R269 IonicContact OD2-NE 2.79Å; D248-R269 PolarHBondContact OD2-NE 2.95Å; D248-R269 IonicContact OD2-NH2 3.76Å; D248-R269 PolarHBondContact OD2-NH2 2.85Å; G267-R269 PolarHBondContact O-N 2.96Å; G267-R269 VanDerWaalsContact O-N 3.14Å; R269-G271 PolarHBondContact O-N 2.86Å; R269-G272 PolarHBondContact O-N 2.86Å
270	A	82.7	Confident	89.4	Confident	88 Å²	88	37.6 Å²	37.6	73%	0.727	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-66.2	-18.5	178.6	0	0	0	0	0	113.2	G267 W268	G267-A270 WeakPolarHBondContact O-CB 3.34Å; G267-A270 PolarHBondContact O-N 3.07Å; W268-A270 PolarHBondContact O-N 3.26Å
271	G	78.8	Confident	88.9	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.021	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-100.3	14.5	172.1	0	0	0	0	0	114.6	W268 R269 C290 I291	W268-G271 PolarHBondContact O-N 2.92Å; R269-G271 PolarHBondContact O-N 2.86Å; G271-C290 VanDerWaalsContact O-CB 3.25Å; G271-C290 WeakPolarHBondContact O-CB 3.45Å; G271-I291 CarbonylContact O-C 3.53Å
272	G	82.8	Confident	88.5	Confident	55 Å²	55	37.8 Å²	37.8	57%	0.567	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.1	-5.5	-175	0	0	0	0	0	115.1	R269	R269-G272 PolarHBondContact O-N 2.86Å
273	G	89	Confident	88.2	Confident	5 Å²	5	39.8 Å²	39.8	5%	0.052	24%	0.237	C	C	.	.	S	Bend	trans	98.7	158.8	-173.1	0	0	0	0	0	112.4	W268 C290	W268-G273 WeakPolarHBondContact O-CA 3.41Å; W268-G273 PolarHBondContact O-N 2.85Å; G273-C290 VanDerWaalsContact O-CA 3.28Å; G273-C290 WeakPolarHBondContact O-CA 3.35Å; G273-C290 WeakPolarHBondContact O-CB 3.48Å; G273-C290 PolarHBondContact O-SG 2.88Å; G273-C290 VanDerWaalsContact O-SG 3.35Å
274	L	93.7	Very high	88	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.9	-176.9	-171.4	71.7	0	0	0	111.3	R231 R232 A245 W268 D276 M277 V289	R231-L274 HydrophobicContact CB-CB 4.2Å; R231-L274 PolarHBondContact NE-O 3.41Å; R231-L274 PolarHBondContact NH2-O 3.42Å; R232-L274 HydrophobicContact CB-CD2 4.22Å; R232-L274 HydrophobicContact CG-CD2 4.39Å; A245-L274 HydrophobicContact CB-CD2 3.31Å; W268-L274 HydrophobicContact CB-CB 4.34Å; W268-L274 HydrophobicContact CD2-CB 4.15Å; W268-L274 HydrophobicContact CD2-CD1 4.06Å; W268-L274 HydrophobicContact CD2-CD2 4.26Å; W268-L274 HydrophobicContact CD2-CG 4.42Å; W268-L274 HydrophobicContact CE3-CB 4.33Å; W268-L274 HydrophobicContact CE3-CD2 4.16Å; W268-L274 HydrophobicContact CG-CB 4.21Å; W268-L274 HydrophobicContact CG-CD1 4.22Å; W268-L274 HydrophobicContact CH2-CD2 3.89Å; W268-L274 HydrophobicContact CZ2-CD1 4.08Å; W268-L274 HydrophobicContact CZ2-CD2 4.03Å; W268-L274 HydrophobicContact CZ3-CD2 4Å; L274-D276 WeakPolarHBondContact CD1-O 3.08Å; L274-M277 HydrophobicContact CD2-CB 4.21Å; L274-M277 HydrophobicContact CD2-SD 4.14Å; L274-V289 WeakPolarHBondContact CD1-O 3.38Å
275	D	94	Very high	88	Confident	32 Å²	32	41.5 Å²	41.5	17%	0.171	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-38.6	173.1	-164.9	56.1	0	0	0	113	A20 R231 R232 V289 I291	A20-D275 PolarHBondContact N-OD2 2.81Å; R231-D275 IonicContact NH2-OD1 2.74Å; R232-D275 PolarHBondContact NE-O 2.89Å; R232-D275 PolarHBondContact NH2-O 2.82Å; R232-D275 IonicContact NH2-OD1 2.67Å; D275-V289 PolarHBondContact N-O 2.73Å; D275-I291 HydrophobicContact CB-CD1 3.95Å; D275-I291 HydrophobicContact CB-CG1 4.16Å; D275-I291 WeakPolarHBondContact OD2-CD1 3.35Å
276	D	94.9	Very high	88.1	Confident	10 Å²	10	36 Å²	36	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	158.3	173.3	-165	33.4	0	0	0	113.7	T21 L22 R24 L274 G288 V289	T21-D276 WeakPolarHBondContact CA-OD2 3.42Å; L22-D276 PolarHBondContact N-OD2 2.74Å; R24-D276 IonicContact CZ-OD1 2.69Å; R24-D276 IonicContact CZ-OD2 3.87Å; R24-D276 IonicContact NH1-OD1 2.74Å; R24-D276 PolarHBondContact NH1-OD1 2.88Å; R24-D276 IonicContact NH1-OD2 3.05Å; R24-D276 PolarHBondContact NH1-OD2 2.77Å; R24-D276 IonicContact NH2-OD1 3.89Å; R24-D276 PolarHBondContact NH2-OD1 3.28Å; R24-D276 IonicContact NH2-OD2 3.33Å; R24-D276 PolarHBondContact NH2-OD2 2.94Å; L274-D276 WeakPolarHBondContact CD1-O 3.08Å; D276-G288 WeakPolarHBondContact O-CA 3.32Å; D276-V289 PolarHBondContact N-O 3.17Å; D276-V289 PolarHBondContact O-N 2.65Å
277	M	94.5	Very high	88.3	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.049	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	129.2	-171.6	-166.8	171.9	73.2	0	0	111.7	R232 A234 A245 L250 W268 L274 L286 V287	R232-M277 HydrophobicContact CB-CB 4.2Å; R232-M277 HydrophobicContact CB-CE 4.43Å; A234-M277 HydrophobicContact CB-CE 3.77Å; A245-M277 HydrophobicContact CB-CE 4.29Å; A245-M277 HydrophobicContact CB-SD 3.78Å; L250-M277 HydrophobicContact CD1-SD 4.4Å; W268-M277 HydrophobicContact CH2-SD 4.18Å; L274-M277 HydrophobicContact CD2-CB 4.21Å; L274-M277 HydrophobicContact CD2-SD 4.14Å; M277-L286 HydrophobicContact CE-CD1 4.3Å; M277-L286 HydrophobicContact CG-CD1 4.11Å; M277-L286 HydrophobicContact CG-CD2 3.73Å; M277-L286 HydrophobicContact CG-CG 3.88Å; M277-L286 HydrophobicContact SD-CD1 3.78Å; M277-L286 HydrophobicContact SD-CD2 3.83Å; M277-L286 HydrophobicContact SD-CG 4.12Å; M277-V287 WeakPolarHBondContact CA-O 3.26Å
278	A	94.1	Very high	88.7	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.033	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.1	173.3	0	0	0	0	0	111.3	L22 V287	L22-A278 HydrophobicContact CB-CB 3.57Å; L22-A278 HydrophobicContact CD1-CB 3.86Å; L22-A278 HydrophobicContact CG-CB 4.37Å; A278-V287 PolarHBondContact N-O 2.83Å; A278-V287 PolarHBondContact O-N 3.38Å
279	V	91.9	Very high	88.9	Confident	15 Å²	15	34.8 Å²	34.8	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.5	169.2	-171.9	0	0	0	0	108.1	P237 Y243 P281 L286	P237-V279 HydrophobicContact CG-CB 4.17Å; P237-V279 HydrophobicContact CG-CG1 3.99Å; Y243-V279 HydrophobicContact CD2-CG2 4.01Å; Y243-V279 HydrophobicContact CE2-CG2 4.06Å; V279-P281 VanDerWaalsContact C-CD 3.44Å; V279-P281 WeakPolarHBondContact O-CD 3.2Å; V279-L286 HydrophobicContact CG2-CD1 4.42Å
280	A	88.5	Confident	89.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	79.5	173.7	0	0	0	0	0	109	S282 F283 N284 Q285	A280-S282 PolarHBondContact O-N 2.62Å; A280-F283 HydrophobicContact CB-CD2 4.31Å; A280-F283 PolarHBondContact O-N 3.22Å; A280-N284 PolarHBondContact O-N 3.27Å; A280-Q285 WeakPolarHBondContact CA-O 3.25Å; A280-Q285 HydrophobicContact CB-CB 4.49Å; A280-Q285 PolarHBondContact N-O 3.45Å; A280-Q285 PolarHBondContact O-N 3.28Å
281	P	79.1	Confident	89.8	Confident	55 Å²	55	25 Å²	25	36%	0.357	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-60.4	-31.2	-172.7	21.8	-32.9	0	0	0	113	P237 V279 F283 N284	P237-P281 HydrophobicContact CB-CB 4.43Å; P237-P281 HydrophobicContact CB-CG 4.39Å; P237-P281 HydrophobicContact CG-CB 4.08Å; P237-P281 HydrophobicContact CG-CG 3.99Å; V279-P281 VanDerWaalsContact C-CD 3.44Å; V279-P281 WeakPolarHBondContact O-CD 3.2Å; P281-F283 PolarHBondContact O-N 2.81Å; P281-N284 PolarHBondContact O-N 2.87Å; P281-N284 PolarHBondContact O-OD1 3.14Å
282	S	80.3	Confident	90.4	Very high	87 Å²	87	27.4 Å²	27.4	61%	0.608	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-60.3	-14.6	175	51.6	0	0	0	0	114.8	A280	A280-S282 PolarHBondContact O-N 2.62Å
283	F	82.4	Confident	90.8	Very high	105 Å²	105	30.9 Å²	30.9	46%	0.461	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-123.9	1.4	179	-60.8	-84.2	0	0	0	113.6	R28 A280 P281 Q285	R28-F283 HydrophobicContact CG-CE2 4.01Å; R28-F283 VanDerWaalsContact NE-CE2 3.27Å; A280-F283 HydrophobicContact CB-CD2 4.31Å; A280-F283 PolarHBondContact O-N 3.22Å; P281-F283 PolarHBondContact O-N 2.81Å; F283-Q285 HydrophobicContact CB-CB 4.21Å; F283-Q285 HydrophobicContact CB-CG 4.28Å; F283-Q285 PolarHBondContact O-N 2.99Å
284	N	85.6	Confident	90.9	Very high	86 Å²	86	32.6 Å²	32.6	46%	0.46	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	46.9	-167.1	-64.2	-11	0	0	0	112.1	A280 P281 V303 K304	A280-N284 PolarHBondContact O-N 3.27Å; P281-N284 PolarHBondContact O-N 2.87Å; P281-N284 PolarHBondContact O-OD1 3.14Å; N284-V303 PolarHBondContact O-N 3.07Å; N284-K304 HydrophobicContact CB-CG 4.01Å
285	Q	90.6	Very high	90.9	Very high	28 Å²	28	35.2 Å²	35.2	13%	0.131	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.3	-177.5	-80.2	176.2	-11.2	0	0	111.2	A280 F283 V300 V301 D302	A280-Q285 WeakPolarHBondContact CA-O 3.25Å; A280-Q285 HydrophobicContact CB-CB 4.49Å; A280-Q285 PolarHBondContact N-O 3.45Å; A280-Q285 PolarHBondContact O-N 3.28Å; F283-Q285 HydrophobicContact CB-CB 4.21Å; F283-Q285 HydrophobicContact CB-CG 4.28Å; F283-Q285 PolarHBondContact O-N 2.99Å; Q285-V300 HydrophobicContact CB-CG1 4.14Å; Q285-V300 HydrophobicContact CG-CG1 3.87Å; Q285-V301 CarbonylContact C-O 3.56Å; Q285-V301 VanDerWaalsContact CA-O 3.31Å; Q285-V301 WeakPolarHBondContact CA-O 3.44Å; Q285-D302 WeakPolarHBondContact CG-OD1 3.44Å; Q285-D302 PolarHBondContact NE2-OD1 3.39Å
286	L	93.2	Very high	90.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.4	168.6	173.8	158.2	0	0	0	107.4	Y243 L250 W268 M277 V279 V300 V301 V303	Y243-L286 HydrophobicContact CD1-CD1 4.14Å; Y243-L286 HydrophobicContact CD2-CD1 4.19Å; Y243-L286 HydrophobicContact CG-CD1 3.89Å; L250-L286 HydrophobicContact CD1-CD1 4.29Å; L250-L286 HydrophobicContact CD2-CD1 3.9Å; L250-L286 HydrophobicContact CD2-CD2 4.24Å; W268-L286 HydrophobicContact CZ2-CD2 4.19Å; M277-L286 HydrophobicContact CE-CD1 4.3Å; M277-L286 HydrophobicContact CG-CD1 4.11Å; M277-L286 HydrophobicContact CG-CD2 3.73Å; M277-L286 HydrophobicContact CG-CG 3.88Å; M277-L286 HydrophobicContact SD-CD1 3.78Å; M277-L286 HydrophobicContact SD-CD2 3.83Å; M277-L286 HydrophobicContact SD-CG 4.12Å; V279-L286 HydrophobicContact CG2-CD1 4.42Å; L286-V300 WeakPolarHBondContact O-CA 3.34Å; L286-V301 HydrophobicContact CB-CB 4.46Å; L286-V301 HydrophobicContact CD2-CB 4.46Å; L286-V301 HydrophobicContact CD2-CG2 4.2Å; L286-V301 PolarHBondContact N-O 3.42Å; L286-V301 PolarHBondContact O-N 2.9Å; L286-V303 HydrophobicContact CB-CG2 3.59Å
287	V	93.8	Very high	90.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.8	178.7	-175.2	0	0	0	0	107.8	L22 G27 V44 M277 A278 Y299 V300	L22-V287 HydrophobicContact CD1-CB 4.01Å; L22-V287 HydrophobicContact CD1-CG1 3.93Å; L22-V287 WeakPolarHBondContact CD1-O 3.44Å; L22-V287 HydrophobicContact CD2-CG1 3.96Å; G27-V287 WeakPolarHBondContact O-CG2 3.35Å; V44-V287 HydrophobicContact CG1-CG1 3.8Å; V44-V287 HydrophobicContact CG1-CG2 4.37Å; V44-V287 HydrophobicContact CG2-CG1 4.39Å; M277-V287 WeakPolarHBondContact CA-O 3.26Å; A278-V287 PolarHBondContact N-O 2.83Å; A278-V287 PolarHBondContact O-N 3.38Å; V287-Y299 WeakPolarHBondContact CA-O 3.34Å; V287-V300 HydrophobicContact CG2-CG2 4.42Å
288	G	94.4	Very high	90.7	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141	173.1	0	0	0	0	0	111.2	D276 T298 Y299	D276-G288 WeakPolarHBondContact O-CA 3.32Å; G288-T298 WeakPolarHBondContact O-CA 3.49Å; G288-Y299 PolarHBondContact N-O 2.93Å; G288-Y299 PolarHBondContact O-N 3.44Å
289	V	94.8	Very high	90.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129	177.9	177.6	0	0	0	0	109.6	A20 L22 M30 L274 D275 D276 I296 T298	A20-V289 HydrophobicContact CB-CG1 3.77Å; L22-V289 HydrophobicContact CD1-CG2 3.82Å; L22-V289 HydrophobicContact CD2-CG2 3.63Å; L22-V289 HydrophobicContact CG-CG2 3.6Å; M30-V289 HydrophobicContact CG-CG2 4.3Å; M30-V289 HydrophobicContact SD-CB 4.32Å; M30-V289 HydrophobicContact SD-CG1 3.77Å; M30-V289 HydrophobicContact SD-CG2 3.49Å; M30-V289 WeakPolarHBondContact SD-CG2 3.3Å; L274-V289 WeakPolarHBondContact CD1-O 3.38Å; D275-V289 PolarHBondContact N-O 2.73Å; D276-V289 PolarHBondContact N-O 3.17Å; D276-V289 PolarHBondContact O-N 2.65Å; V289-I296 HydrophobicContact CG1-CG2 3.59Å; V289-T298 HydrophobicContact CG2-CG2 4.35Å
290	C	94.9	Very high	90.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.2	174.5	-58.8	0	0	0	0	110	G271 G273 I296 T297 Y299	G271-C290 VanDerWaalsContact O-CB 3.25Å; G271-C290 WeakPolarHBondContact O-CB 3.45Å; G273-C290 VanDerWaalsContact O-CA 3.28Å; G273-C290 WeakPolarHBondContact O-CA 3.35Å; G273-C290 WeakPolarHBondContact O-CB 3.48Å; G273-C290 PolarHBondContact O-SG 2.88Å; G273-C290 VanDerWaalsContact O-SG 3.35Å; C290-I296 WeakPolarHBondContact O-CA 3.43Å; C290-T297 PolarHBondContact N-O 3.46Å; C290-T297 PolarHBondContact O-N 3.21Å; C290-Y299 HydrophobicContact CB-CE2 4.24Å
291	I	93.7	Very high	90.9	Very high	32 Å²	32	32.7 Å²	32.7	16%	0.164	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.9	179.4	-63.8	173.2	0	0	0	109.2	V17 A20 G271 D275	V17-I291 HydrophobicContact CB-CD1 4.49Å; V17-I291 HydrophobicContact CB-CG2 3.87Å; V17-I291 HydrophobicContact CG1-CD1 3.98Å; V17-I291 HydrophobicContact CG1-CG1 4.31Å; V17-I291 HydrophobicContact CG1-CG2 4.47Å; V17-I291 WeakPolarHBondContact O-CG2 3.33Å; A20-I291 HydrophobicContact CB-CD1 3.86Å; A20-I291 HydrophobicContact CB-CG1 4.29Å; G271-I291 CarbonylContact O-C 3.53Å; D275-I291 HydrophobicContact CB-CD1 3.95Å; D275-I291 HydrophobicContact CB-CG1 4.16Å; D275-I291 WeakPolarHBondContact OD2-CD1 3.35Å
292	S	92	Very high	91.3	Very high	52 Å²	52	31.1 Å²	31.1	36%	0.364	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	95.5	171.8	-173.6	0	0	0	0	109.4	S294 L295	S292-S294 PolarHBondContact O-N 3.28Å; S292-S294 VanDerWaalsContact O-N 3.15Å; S292-L295 PolarHBondContact N-O 2.9Å; S292-L295 WeakPolarHBondContact O-CB 3.37Å; S292-L295 PolarHBondContact O-N 3.45Å
293	N	91	Very high	91.5	Very high	127 Å²	127	27.5 Å²	27.5	68%	0.679	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	-114.7	-171.4	-59.4	-7.6	0	0	0	111.3	V17	V17-N293 WeakPolarHBondContact CG2-O 3.24Å; V17-N293 PolarHBondContact N-O 3.1Å
294	S	92	Very high	90.8	Very high	41 Å²	41	28.6 Å²	28.6	29%	0.287	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.7	177.9	52.3	0	0	0	0	114.5	A11 H12 S292	A11-S294 PolarHBondContact N-O 3.48Å; H12-S294 WeakPolarHBondContact O-CB 3.46Å; S292-S294 PolarHBondContact O-N 3.28Å; S292-S294 VanDerWaalsContact O-N 3.15Å
295	L	92.3	Very high	89.3	Confident	56 Å²	56	27.7 Å²	27.7	29%	0.293	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	142.2	-178.9	-66.8	169.9	0	0	0	111.8	E8 I10 S292	E8-L295 HydrophobicContact CG-CD2 4.3Å; I10-L295 HydrophobicContact CB-CD2 4.43Å; I10-L295 HydrophobicContact CG1-CD2 3.54Å; S292-L295 PolarHBondContact N-O 2.9Å; S292-L295 WeakPolarHBondContact O-CB 3.37Å; S292-L295 PolarHBondContact O-N 3.45Å
296	I	93.5	Very high	87.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.5	166.7	-60.1	-176.7	0	0	0	108.7	E8 C9 A11 V17 M30 T32 V289 C290	E8-I296 VanDerWaalsContact CA-O 3.32Å; E8-I296 WeakPolarHBondContact CA-O 3.29Å; C9-I296 PolarHBondContact N-O 3.27Å; C9-I296 PolarHBondContact O-N 2.97Å; A11-I296 HydrophobicContact CB-CB 4.47Å; A11-I296 HydrophobicContact CB-CD1 3.36Å; A11-I296 HydrophobicContact CB-CG1 3.71Å; V17-I296 HydrophobicContact CB-CG1 4.49Å; V17-I296 HydrophobicContact CG1-CD1 3.88Å; V17-I296 HydrophobicContact CG1-CG1 4.28Å; V17-I296 HydrophobicContact CG2-CD1 4.11Å; V17-I296 HydrophobicContact CG2-CG1 3.91Å; M30-I296 HydrophobicContact CE-CD1 4.26Å; M30-I296 HydrophobicContact CE-CG2 3.97Å; M30-I296 HydrophobicContact SD-CG2 4.01Å; T32-I296 HydrophobicContact CG2-CD1 3.21Å; V289-I296 HydrophobicContact CG1-CG2 3.59Å; C290-I296 WeakPolarHBondContact O-CA 3.43Å
297	T	93.9	Very high	85.5	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130	169.5	-64.6	0	0	0	0	110.1	K5 Q7 E8 C290 Y299	K5-T297 HydrophobicContact CD-CG2 3.61Å; K5-T297 HydrophobicContact CG-CG2 3.66Å; Q7-T297 CarbonylContact O-C 3.6Å; Q7-T297 WeakPolarHBondContact O-CA 3.47Å; E8-T297 PolarHBondContact OE1-OG1 2.97Å; E8-T297 VanDerWaalsContact OE1-OG1 3.09Å; C290-T297 PolarHBondContact N-O 3.46Å; C290-T297 PolarHBondContact O-N 3.21Å; T297-Y299 HydrophobicContact CG2-CD2 3.8Å; T297-Y299 HydrophobicContact CG2-CE1 4.5Å; T297-Y299 HydrophobicContact CG2-CE2 3.22Å
298	T	93.4	Very high	82.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.5	171.9	61.2	0	0	0	0	110.5	L6 Q7 M30 G288 V289	L6-T298 PolarHBondContact N-O 3.34Å; Q7-T298 PolarHBondContact N-O 3.39Å; Q7-T298 PolarHBondContact N-OG1 3.43Å; Q7-T298 PolarHBondContact O-N 2.85Å; Q7-T298 PolarHBondContact O-OG1 3.35Å; M30-T298 HydrophobicContact SD-CG2 4.26Å; G288-T298 WeakPolarHBondContact O-CA 3.49Å; V289-T298 HydrophobicContact CG2-CG2 4.35Å
299	Y	93.2	Very high	79.9	Confident	11 Å²	11	47.4 Å²	47.4	4%	0.043	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146	176.5	-68.9	-96.4	0	0	0	109.7	W4 K5 V266 W268 V287 G288 C290 T297	W4-Y299 WeakPolarHBondContact O-CA 3.33Å; K5-Y299 HydrophobicContact CB-CD1 4.02Å; K5-Y299 HydrophobicContact CB-CE1 3.71Å; K5-Y299 HydrophobicContact CG-CE1 4.35Å; V266-Y299 HydrophobicContact CG1-CD1 4.19Å; V266-Y299 HydrophobicContact CG1-CG 4.32Å; W268-Y299 AromaticContact CD1-CD2 3.47Å; W268-Y299 VanDerWaalsContact CD1-CD2 3.47Å; W268-Y299 AromaticContact CD1-CG 3.66Å; W268-Y299 AromaticContact NE1-CD2 4Å; W268-Y299 AromaticContact NE1-CG 3.87Å; V287-Y299 WeakPolarHBondContact CA-O 3.34Å; G288-Y299 PolarHBondContact N-O 2.93Å; G288-Y299 PolarHBondContact O-N 3.44Å; C290-Y299 HydrophobicContact CB-CE2 4.24Å; T297-Y299 HydrophobicContact CG2-CD2 3.8Å; T297-Y299 HydrophobicContact CG2-CE1 4.5Å; T297-Y299 HydrophobicContact CG2-CE2 3.22Å
300	V	92.3	Very high	76.7	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.7	174.6	177.8	0	0	0	0	109.5	A3 W4 L6 Q285 L286 V287	A3-V300 WeakPolarHBondContact CA-O 3.41Å; W4-V300 HydrophobicContact CD2-CB 4.46Å; W4-V300 HydrophobicContact CH2-CB 4.3Å; W4-V300 HydrophobicContact CH2-CG1 3.74Å; W4-V300 HydrophobicContact CZ2-CB 3.83Å; W4-V300 HydrophobicContact CZ2-CG1 3.62Å; W4-V300 HydrophobicContact CZ3-CG1 4.44Å; W4-V300 PolarHBondContact N-O 3.37Å; W4-V300 PolarHBondContact O-N 3.4Å; L6-V300 HydrophobicContact CB-CG2 4.02Å; L6-V300 HydrophobicContact CD2-CG2 3.79Å; L6-V300 HydrophobicContact CG-CG2 4.33Å; Q285-V300 HydrophobicContact CB-CG1 4.14Å; Q285-V300 HydrophobicContact CG-CG1 3.87Å; L286-V300 WeakPolarHBondContact O-CA 3.34Å; V287-V300 HydrophobicContact CG2-CG2 4.42Å
301	V	91.6	Very high	73.5	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.9	169.9	-170.4	0	0	0	0	108.7	M1 K2 A3 L250 V264 V266 Q285 L286 V303	M1-V301 HydrophobicContact CB-CG1 4.16Å; M1-V301 HydrophobicContact SD-CG1 4.16Å; K2-V301 CarbonylContact O-C 3.56Å; K2-V301 WeakPolarHBondContact O-CA 3.43Å; A3-V301 HydrophobicContact CB-CG1 4.42Å; A3-V301 HydrophobicContact CB-CG2 3.99Å; L250-V301 HydrophobicContact CD2-CB 4.39Å; L250-V301 HydrophobicContact CD2-CG1 4.15Å; L250-V301 HydrophobicContact CD2-CG2 4.23Å; V264-V301 HydrophobicContact CG1-CG1 4.29Å; V266-V301 HydrophobicContact CG1-CG2 4.01Å; V266-V301 HydrophobicContact CG2-CG2 3.76Å; Q285-V301 CarbonylContact C-O 3.56Å; Q285-V301 VanDerWaalsContact CA-O 3.31Å; Q285-V301 WeakPolarHBondContact CA-O 3.44Å; L286-V301 HydrophobicContact CB-CB 4.46Å; L286-V301 HydrophobicContact CD2-CB 4.46Å; L286-V301 HydrophobicContact CD2-CG2 4.2Å; L286-V301 PolarHBondContact N-O 3.42Å; L286-V301 PolarHBondContact O-N 2.9Å; V301-V303 WeakPolarHBondContact O-CG2 3.25Å; V301-V303 PolarHBondContact O-N 3.12Å
302	D	88.1	Confident	70.3	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.118	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	109.8	171.6	-96.8	-9.6	0	0	0	109.6	M1 K2 W4 Q285 K304	M1-D302 VanDerWaalsContact CB-O 3.3Å; M1-D302 WeakPolarHBondContact CB-O 3.47Å; M1-D302 VanDerWaalsContact CG-O 3.26Å; M1-D302 WeakPolarHBondContact CG-O 3.31Å; K2-D302 HydrophobicContact CB-CB 4.44Å; K2-D302 PolarHBondContact O-N 3.13Å; W4-D302 HydrophobicContact CZ3-CB 4.26Å; Q285-D302 WeakPolarHBondContact CG-OD1 3.44Å; Q285-D302 PolarHBondContact NE2-OD1 3.39Å; D302-K304 VanDerWaalsContact C-N 3.31Å; D302-K304 HydrophobicContact CB-CD 4.16Å; D302-K304 HydrophobicContact CB-CG 4.38Å; D302-K304 VanDerWaalsContact CG-CE 3.44Å; D302-K304 PolarHBondContact O-N 3.45Å; D302-K304 WeakPolarHBondContact OD1-CE 3.12Å; D302-K304 IonicContact OD1-NZ 2.62Å; D302-K304 PolarHBondContact OD1-NZ 2.84Å; D302-K304 VanDerWaalsContact OD1-NZ 3.11Å; D302-K304 WeakPolarHBondContact OD2-CE 3.48Å; D302-K304 IonicContact OD2-NZ 2.69Å; D302-K304 PolarHBondContact OD2-NZ 3.4Å
303	V	84.5	Confident	67.1	Low	11 Å²	11	71.5 Å²	71.5	7%	0.067	37%	0.37	C	S	.	.			trans	-98.4	36.1	-172.5	-161.2	0	0	0	0	111.5	M1 Y243 N284 L286 V301 S305 C306	M1-V303 HydrophobicContact CE-CB 4.47Å; M1-V303 HydrophobicContact CE-CG1 3.82Å; M1-V303 HydrophobicContact SD-CB 4.36Å; M1-V303 HydrophobicContact SD-CG1 4.14Å; Y243-V303 HydrophobicContact CE1-CG1 3.78Å; Y243-V303 WeakPolarHBondContact OH-CG1 3.29Å; N284-V303 PolarHBondContact O-N 3.07Å; L286-V303 HydrophobicContact CB-CG2 3.59Å; V301-V303 WeakPolarHBondContact O-CG2 3.25Å; V301-V303 PolarHBondContact O-N 3.12Å; V303-S305 PolarHBondContact O-N 2.86Å; V303-C306 HydrophobicContact CG1-CB 4.48Å; V303-C306 VanDerWaalsContact CG1-SG 3.55Å
304	K	68.9	Low	64.2	Low	128 Å²	128	70.2 Å²	70.2	56%	0.557	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	10.4	-164.6	-68.3	170.7	178.2	162.1	0	115.5	N284 D302	N284-K304 HydrophobicContact CB-CG 4.01Å; D302-K304 VanDerWaalsContact C-N 3.31Å; D302-K304 HydrophobicContact CB-CD 4.16Å; D302-K304 HydrophobicContact CB-CG 4.38Å; D302-K304 VanDerWaalsContact CG-CE 3.44Å; D302-K304 PolarHBondContact O-N 3.45Å; D302-K304 WeakPolarHBondContact OD1-CE 3.12Å; D302-K304 IonicContact OD1-NZ 2.62Å; D302-K304 PolarHBondContact OD1-NZ 2.84Å; D302-K304 VanDerWaalsContact OD1-NZ 3.11Å; D302-K304 WeakPolarHBondContact OD2-CE 3.48Å; D302-K304 IonicContact OD2-NZ 2.69Å; D302-K304 PolarHBondContact OD2-NZ 3.4Å
305	S	54.1	Low	61.1	Low	68 Å²	68	75.4 Å²	75.4	48%	0.476	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.9	17.6	-168.4	56	0	0	0	0	115.4	V303 I307	V303-S305 PolarHBondContact O-N 2.86Å; S305-I307 PolarHBondContact O-N 2.86Å
306	C	52.9	Low	58	Low	26 Å²	26	80.7 Å²	80.7	18%	0.176	42%	0.423	C	S	.	.			trans	-75.7	66.2	170.8	-69.8	0	0	0	0	111.6	M1 Y243 V303	M1-C306 WeakPolarHBondContact CE-SG 3.42Å; Y243-C306 PolarHBondContact OH-SG 2.83Å; V303-C306 HydrophobicContact CG1-CB 4.48Å; V303-C306 VanDerWaalsContact CG1-SG 3.55Å
307	I	49.5	Very low	55.1	Low	138 Å²	138	88.6 Å²	88.6	71%	0.708	46%	0.464	S	S	*	.			trans	-109.2	119.5	167.4	-51.5	174.7	0	0	0	105.9	S305	S305-I307 PolarHBondContact O-N 2.86Å
308	P	39.4	Very low	52.3	Low	64 Å²	64	94.8 Å²	94.8	42%	0.416	50%	0.502	S	S	.	.			trans	-67.5	136.3	173.4	28.8	-32	0	0	0	108.2	V240 T310	V240-P308 HydrophobicContact CG1-CG 4.02Å; P308-T310 VanDerWaalsContact C-N 3.28Å; P308-T310 PolarHBondContact O-N 3.17Å
309	F	31.5	Very low	49.2	Very low	214 Å²	214	103.1 Å²	103.1	94%	0.939	54%	0.541	S	S	*	.			trans	-70.2	85.9	174.7	-65.1	-86.4	0	0	0	109.8
310	T	28.9	Very low	46.1	Very low	107 Å²	107	107.5 Å²	107.5	66%	0.656	57%	0.573	S	S	*	*			trans	-98.7	154.1	161.2	76.6	0	0	0	0	108.5	P308	P308-T310 VanDerWaalsContact C-N 3.28Å; P308-T310 PolarHBondContact O-N 3.17Å
311	T	28	Very low	43.3	Very low	99 Å²	99	115.3 Å²	115.3	61%	0.607	61%	0.614	S	S	*	*			trans	79.1	128.4	-161.8	74.7	0	0	0	0	114.2
312	N	25.6	Very low	40.4	Very low	141 Å²	141	124.1 Å²	124.1	75%	0.754	65%	0.652	S	S	*	*			cis	-148.5	138.8	-7.2	-84.1	-31.6	0	0	0	109.5
313	Y	25.2	Very low	37.7	Very low	243 Å²	243	129.9 Å²	129.9	95%	0.953	68%	0.683	S	S	*	*			trans	-142.9	77.8	162.4	-108.7	-76.1	0	0	0	110.1
314	S	29.5	Very low	35.2	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	72%	0.718	S	S	*	*	S	Bend	trans	-165.3	130	153.6	43.9	0	0	0	0	111.4
315	D	27.8	Very low	33.3	Very low	150 Å²	150	135 Å²	135	80%	0.802	73%	0.729	S	S	*	*			trans	50	88.7	145.1	-51	-25.8	0	0	0	119.5
316	N	27.3	Very low	32.2	Very low	167 Å²	167	136.1 Å²	136.1	89%	0.893	74%	0.742	S	S	*	*			trans	-141.8	67.4	141.3	-90.2	-58.5	0	0	0	110.2
317	I	32.2	Very low	31.3	Very low	167 Å²	167	143.5 Å²	143.5	86%	0.856	77%	0.774	S	S	*	*			trans	-126.9	86.1	160.4	-56.2	-178.2	0	0	0	108
318	V	34	Very low	30.3	Very low	132 Å²	132	142.2 Å²	142.2	80%	0.8	78%	0.777	S	S	*	*			trans	-114.3	113.3	157.4	178.9	0	0	0	0	107.6
319	E	29.5	Very low	30	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	80%	0.796	S	S	*	*			trans	21.1	97.5	154.9	-56.7	-173	143.9	0	0	118.3
320	S	28.6	Very low	30	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	79%	0.788	S	S	*	*				177.2	109.9	123	38	0	0	0	0	111.5
321	N	32.1	Very low	30.1	Very low	164 Å²	164	146.6 Å²	146.6	88%	0.877	80%	0.801	S	S	*	*				178.2	141.6	119.7	-88.4	-41.3	0	0	0	110.2
322	K	30.8	Very low	30.2	Very low	186 Å²	186	148.1 Å²	148.1	81%	0.809	80%	0.804	S	S	*	*			trans	-83.9	167.7	172.4	-64.3	177.2	176.4	176.7	0	109.8
323	D	31.3	Very low	30.4	Very low	143 Å²	143	148.2 Å²	148.2	77%	0.765	81%	0.811	S	S	*	*			trans	85.2	108	152	-55.9	-35.5	0	0	0	120.1
324	V	32.2	Very low	30.7	Very low	130 Å²	130	142.5 Å²	142.5	79%	0.788	80%	0.801	S	S	*	*			trans	93.9	134.5	131.4	175.8	0	0	0	0	120.6
325	C	29	Very low	30.7	Very low	118 Å²	118	141.4 Å²	141.4	80%	0.797	81%	0.806	S	S	*	*			trans	62.4	115.2	169.8	-83.3	0	0	0	0	117.7
326	A	31.3	Very low	31.1	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	80%	0.803	S	S	*	*			cis	89.2	130.5	33.2	0	0	0	0	0	116.5
327	Q	33.4	Very low	31.2	Very low	182 Å²	182	140.1 Å²	140.1	85%	0.85	80%	0.803	S	S	*	*			trans	99.5	112.4	160.8	-59	-168.4	-8.1	0	0	121
328	S	29.5	Very low	31.4	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	80%	0.801	S	S	*	*			trans	66.3	139.1	144.7	68.1	0	0	0	0	119
329	T	33.5	Very low	31.2	Very low	131 Å²	131	138.1 Å²	138.1	80%	0.804	80%	0.804	S	S	*	*			cis	-149.5	143.1	33.2	-53.6	0	0	0	0	112.1
330	Q	30.7	Very low	31.6	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	80%	0.804	S	S	*	*			trans	-90	150.2	170.6	-70.7	176.9	-22.9	0	0	111.6
331	L	30.3	Very low	31.7	Very low	180 Å²	180	136.5 Å²	136.5	94%	0.942	81%	0.807	S	S	*	*			trans	-128.1	146.8	151.9	-88.7	170.2	0	0	0	109.4
332	I	31.6	Very low	31.8	Very low	131 Å²	131	139.5 Å²	139.5	67%	0.672	81%	0.808	S	S	*	*			trans	-111.7	139.9	-150.5	-64	166.2	0	0	0	111.3	T334	I332-T334 HydrophobicContact CG2-CG2 3.8Å
333	T	29.8	Very low	31.9	Very low	144 Å²	144	137 Å²	137	88%	0.883	80%	0.803	S	S	*	*			trans	-98.2	124.4	159.3	40.8	0	0	0	0	110.2
334	T	31	Very low	32.1	Very low	123 Å²	123	138.7 Å²	138.7	76%	0.755	81%	0.806	S	S	*	*			trans	-115.4	112.9	171.4	50.3	0	0	0	0	110.5	I332	I332-T334 HydrophobicContact CG2-CG2 3.8Å
335	G	29.8	Very low	32.2	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	80%	0.802	S	S	*	*			trans	-81.9	150.3	161.3	0	0	0	0	0	110.9
336	V	35.3	Very low	32.6	Very low	124 Å²	124	140.6 Å²	140.6	75%	0.752	80%	0.804	S	S	*	*			trans	-119.9	112.7	172.7	178.6	0	0	0	0	108.4	T338	V336-T338 HydrophobicContact CG1-CG2 4.36Å
337	N	29	Very low	32.8	Very low	165 Å²	165	143.1 Å²	143.1	88%	0.882	81%	0.805	S	S	*	*			trans	-98.9	131.3	166.9	-74.7	-20	0	0	0	108.7
338	T	36.3	Very low	32.9	Very low	135 Å²	135	139.5 Å²	139.5	83%	0.828	80%	0.8	S	S	*	*			trans	-129.4	117.2	165.2	48.4	0	0	0	0	109.3	V336	V336-T338 HydrophobicContact CG1-CG2 4.36Å
339	S	31.1	Very low	33.2	Very low	123 Å²	123	141.1 Å²	141.1	86%	0.86	80%	0.8	S	S	*	*			trans	-100	141.4	-178.1	39.2	0	0	0	0	111.7
340	A	36.8	Very low	33.2	Very low	101 Å²	101	140 Å²	140	84%	0.835	80%	0.797	S	S	*	*			trans	-149.6	128.6	162.2	0	0	0	0	0	109.5
341	N	30.7	Very low	33.3	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	80%	0.798	S	S	*	*			trans	-73.8	154.7	177.5	-62.7	-39.2	0	0	0	111.2
342	Y	35.3	Very low	33.3	Very low	226 Å²	226	136.8 Å²	136.8	89%	0.886	79%	0.791	S	S	*	*				-172.7	151.3	111.3	-101.9	-71	0	0	0	111.8
343	N	31.8	Very low	33.5	Very low	135 Å²	135	137.2 Å²	137.2	72%	0.722	80%	0.801	S	S	*	*			trans	-81.3	148.4	-171.6	-49.8	-41.9	0	0	0	112.8
344	H	36.6	Very low	33.7	Very low	177 Å²	177	138.4 Å²	138.4	82%	0.819	80%	0.8	S	S	*	*				-170.6	153.2	102.6	-116.6	-81.4	0	0	0	113.8
345	N	33.1	Very low	33.6	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	80%	0.802	S	S	*	*			trans	-65.6	151.5	176.1	-55.6	-26.1	0	0	0	112.4
346	D	37.7	Very low	33.5	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	80%	0.801	S	S	*	*				-161.6	160.8	106.6	-111.4	-29.8	0	0	0	114.4
347	N	35	Very low	33.3	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	80%	0.804	S	S	*	*			trans	-85.4	144.1	-168.4	-61.9	-75.4	0	0	0	114
348	S	37	Very low	33.2	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	80%	0.8	S	S	*	*				169.2	141.9	109.5	49.5	0	0	0	0	115.8
349	N	35.1	Very low	32.7	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	80%	0.801	S	S	*	*			trans	66.7	90.8	146.3	-60.9	-8.1	0	0	0	122.2
350	S	32.5	Very low	32.5	Very low	108 Å²	108	147 Å²	147	76%	0.755	80%	0.798	S	S	*	*				61.6	117.5	118.6	66.4	0	0	0	0	121.9
351	I	33.6	Very low	32	Very low	154 Å²	154	147.2 Å²	147.2	79%	0.79	79%	0.792	S	S	*	*				-161	137.3	120.4	-92.1	145.5	0	0	0	106.8
352	P	30.8	Very low	31.9	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	79%	0.79	S	S	*	*			trans	-84.5	132.5	-179.2	32.6	-33	0	0	0	112
353	T	34.7	Very low	31.4	Very low	141 Å²	141	140.5 Å²	140.5	87%	0.865	79%	0.789	S	S	*	*			trans	-104.2	147.9	167.2	12.5	0	0	0	0	111.6
354	I	33.7	Very low	31.3	Very low	168 Å²	168	139.4 Å²	139.4	86%	0.862	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.7	148.5	-154.2	-70.3	160.2	0	0	0	113.8
355	H	29.5	Very low	31	Very low	172 Å²	172	138.2 Å²	138.2	80%	0.796	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-54.2	140.8	175.4	-86	-96.1	0	0	0	113.9	V357	H355-V357 PolarHBondContact O-N 3.37Å
356	S	28.7	Very low	30.8	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-59.4	121.3	159.5	52.8	0	0	0	0	111.1
357	V	29.3	Very low	30.4	Very low	134 Å²	134	138.1 Å²	138.1	81%	0.812	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-84.5	117.2	168.2	177	0	0	0	0	108.5	H355 Q359	H355-V357 PolarHBondContact O-N 3.37Å; V357-Q359 PolarHBondContact O-N 3.04Å
358	Q	27.6	Very low	30	Very low	171 Å²	171	137.7 Å²	137.7	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.6	121.4	166.3	-79.3	171.4	-75.6	0	0	108.9	I360	Q358-I360 PolarHBondContact O-N 3.11Å
359	Q	26.9	Very low	29.7	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	80%	0.798	S	S	*	*			trans	-72.3	98	176	-169.8	168.6	-3.1	0	0	109	V357 C361	V357-Q359 PolarHBondContact O-N 3.04Å; Q359-C361 PolarHBondContact O-N 3.31Å
360	I	26.8	Very low	29.4	Very low	157 Å²	157	144.9 Å²	144.9	81%	0.805	80%	0.803	S	S	*	*			trans	-76.8	108.9	172.8	-63.2	175.4	0	0	0	107.5	Q358 G362	Q358-I360 PolarHBondContact O-N 3.11Å; I360-G362 PolarHBondContact O-N 3.28Å
361	C	26.4	Very low	29.2	Very low	105 Å²	105	147.7 Å²	147.7	71%	0.709	81%	0.805	S	S	*	*			trans	-64.1	115.5	174.3	-61	0	0	0	0	110.3	Q359 N363	Q359-C361 PolarHBondContact O-N 3.31Å; C361-N363 PolarHBondContact O-N 2.67Å
362	G	27.9	Very low	29.1	Very low	70 Å²	70	145.8 Å²	145.8	72%	0.722	81%	0.805	S	S	*	*			trans	-83.1	107.7	168	0	0	0	0	0	110.4	I360 S364	I360-G362 PolarHBondContact O-N 3.28Å; G362-S364 PolarHBondContact O-N 3.06Å
363	N	25.2	Very low	28.9	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	81%	0.805	S	S	*	*			trans	-67.3	109.8	173.3	-82.3	-10.5	0	0	0	111	C361	C361-N363 PolarHBondContact O-N 2.67Å
364	S	30.1	Very low	28.7	Very low	112 Å²	112	147.8 Å²	147.8	78%	0.783	80%	0.798	S	S	*	*			trans	-105	86.9	167	45.1	0	0	0	0	111.4	G362	G362-S364 PolarHBondContact O-N 3.06Å
365	N	28.9	Very low	28.4	Very low	151 Å²	151	148.8 Å²	148.8	81%	0.807	79%	0.792	S	S	*	*			trans	30	89	155.4	-63.6	-31.4	0	0	0	118.6	V367	N365-V367 PolarHBondContact O-N 3.01Å
366	L	28.3	Very low	28.2	Very low	158 Å²	158	146.5 Å²	146.5	83%	0.827	79%	0.792	S	S	*	*			trans	-52.3	114.2	160.2	-81.3	155.2	0	0	0	112.1	N368	L366-N368 PolarHBondContact O-N 3.17Å
367	V	30.2	Very low	28.3	Very low	128 Å²	128	150.8 Å²	150.8	78%	0.776	80%	0.797	S	S	*	*			trans	-88	93.4	164.1	-179	0	0	0	0	108.6	N365 Y369	N365-V367 PolarHBondContact O-N 3.01Å; V367-Y369 PolarHBondContact O-N 3.06Å; V367-Y369 VanDerWaalsContact O-N 3.12Å
368	N	26.8	Very low	28.3	Very low	136 Å²	136	150.4 Å²	150.4	73%	0.727	80%	0.795	S	S	*	*			trans	-60.8	111.9	178.1	-79.5	-32.2	0	0	0	111.9	L366 M370	L366-N368 PolarHBondContact O-N 3.17Å; N368-M370 PolarHBondContact O-N 3.38Å
369	Y	30.5	Very low	27.9	Very low	222 Å²	222	153.9 Å²	153.9	87%	0.871	80%	0.801	S	S	*	*			trans	-71.7	112.3	162.1	-106.8	-90.3	0	0	0	109.5	V367 Q371	V367-Y369 PolarHBondContact O-N 3.06Å; V367-Y369 VanDerWaalsContact O-N 3.12Å; Y369-Q371 PolarHBondContact O-N 3.44Å
370	M	29.7	Very low	28	Very low	178 Å²	178	151.5 Å²	151.5	88%	0.877	80%	0.803	S	S	*	*			trans	-65.7	115.6	173	-79.4	-167.9	163.4	0	0	110.7	N368 S372	N368-M370 PolarHBondContact O-N 3.38Å; M370-S372 PolarHBondContact O-N 2.99Å
371	Q	28	Very low	28.1	Very low	168 Å²	168	147.3 Å²	147.3	79%	0.785	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.9	117.5	161.1	-72.2	177.7	-12.2	0	0	108.9	Y369	Y369-Q371 PolarHBondContact O-N 3.44Å
372	S	31.3	Very low	28	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-98.4	127.3	158.7	32.5	0	0	0	0	107.9	M370	M370-S372 PolarHBondContact O-N 2.99Å
373	N	26.2	Very low	28.1	Very low	151 Å²	151	150.7 Å²	150.7	81%	0.807	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.6	171	176.7	-78.5	-44.7	0	0	0	111.9
374	E	29.8	Very low	28.1	Very low	154 Å²	154	148.1 Å²	148.1	72%	0.72	81%	0.813	S	S	*	*			trans	92.8	120.2	-179.6	-61.9	-161.4	-132.3	0	0	114.9
375	R	28.1	Very low	28.2	Very low	190 Å²	190	147.8 Å²	147.8	72%	0.717	81%	0.811	S	S	*	*			cis	-148.2	156.8	-0.7	-88.8	162.7	-161	-162.1	2.6	109.6
376	P	26.1	Very low	28.1	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77	131.3	172	32	-32.8	0	0	0	111.2
377	F	29.1	Very low	28	Very low	200 Å²	200	148 Å²	148	88%	0.877	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-99.8	146.9	167.4	-87.5	-78.4	0	0	0	112.3
378	T	29.4	Very low	27.9	Very low	127 Å²	127	149.4 Å²	149.4	78%	0.779	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-93	147.3	-150.4	37.4	0	0	0	0	115.5	C380	T378-C380 PolarHBondContact O-N 3.34Å
379	R	20.9	Very low	27.9	Very low	244 Å²	244	147.6 Å²	147.6	92%	0.921	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-63	117.3	169	-167.3	-174.5	-153.2	175.1	7.1	110.6
380	C	27.9	Very low	28	Very low	132 Å²	132	141.9 Å²	141.9	89%	0.892	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.8	134.7	162.2	-101.1	0	0	0	0	110	T378	T378-C380 PolarHBondContact O-N 3.34Å
381	G	28.8	Very low	28.1	Very low	70 Å²	70	141.7 Å²	141.7	72%	0.722	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-81.7	158.2	-164.2	0	0	0	0	0	115.1
382	S	24.7	Very low	28.2	Very low	122 Å²	122	137.1 Å²	137.1	85%	0.853	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.1	137.8	160	39.7	0	0	0	0	111.2
383	S	30.6	Very low	28.1	Very low	124 Å²	124	143.1 Å²	143.1	87%	0.867	81%	0.806	S	S	*	*			trans	-151.3	119.7	161.4	-76.4	0	0	0	0	108.1
384	A	25.2	Very low	28.3	Very low	106 Å²	106	144.8 Å²	144.8	88%	0.876	81%	0.806	S	S	*	*			trans	-91.8	140	-174.7	0	0	0	0	0	111.6
385	S	30.5	Very low	28.2	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	81%	0.808	S	S	*	*			trans	-165.9	127.4	141.2	-154.7	0	0	0	0	112.8
386	K	28.4	Very low	28.1	Very low	187 Å²	187	142.1 Å²	142.1	81%	0.813	81%	0.811	S	S	*	*			trans	39.6	111.3	139.3	-66.4	176.7	-178	178.7	0	118.6
387	V	25.3	Very low	28.1	Very low	126 Å²	126	141.7 Å²	141.7	76%	0.764	81%	0.81	S	S	*	*				107.7	151	65	148.2	0	0	0	0	110.6
388	L	28.2	Very low	28.1	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	81%	0.808	S	S	*	*			trans	81.5	134.3	-175.1	-59.1	130.9	0	0	0	115.2
389	S	26.7	Very low	28.2	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	81%	0.806	S	S	*	*			cis	157.7	110	-34	51.7	0	0	0	0	108
390	S	32.6	Very low	28.4	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	80%	0.801	S	S	*	*			trans	-173.8	105.2	153.5	51.7	0	0	0	0	109.8
391	I	32.9	Very low	28.6	Very low	173 Å²	173	134.3 Å²	134.3	89%	0.887	80%	0.795	S	S	*	*				68.7	92.8	102.1	-61.3	155.3	0	0	0	112
392	G	30	Very low	28.6	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	80%	0.799	S	S	*	*				109.1	148	101.1	0	0	0	0	0	110
393	R	29.4	Very low	28.9	Very low	239 Å²	239	141.5 Å²	141.5	90%	0.902	80%	0.803	S	S	*	*			cis	-143.1	141	14.5	-85.5	171.8	159.9	144.4	-8.6	111.7
394	K	30.5	Very low	28.8	Very low	186 Å²	186	142.6 Å²	142.6	81%	0.809	80%	0.798	S	S	*	*			trans	41.6	120.4	130.4	-58.7	-169.2	172.5	-168.3	0	121.2
395	S	26.2	Very low	28.9	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	79%	0.793	S	S	*	*			trans	-59.8	153.1	150.7	52	0	0	0	0	113.1
396	F	27.4	Very low	28.8	Very low	179 Å²	179	148.2 Å²	148.2	79%	0.785	80%	0.8	S	S	*	*			trans	-125.5	120.2	154.8	-97.5	-90.4	0	0	0	109.3
397	C	25.4	Very low	28.8	Very low	115 Å²	115	145.7 Å²	145.7	78%	0.777	80%	0.799	S	S	*	*			trans	-79.3	137.7	152.1	-61.2	0	0	0	0	106.8
398	L	29.6	Very low	29.2	Very low	161 Å²	161	148.1 Å²	148.1	84%	0.843	80%	0.804	S	S	*	*			trans	-111.5	126.1	158	-72.1	177.5	0	0	0	107.6
399	V	30.9	Very low	29.5	Very low	121 Å²	121	145.6 Å²	145.6	73%	0.733	80%	0.8	S	S	*	*			trans	-74.4	140.2	176	173.6	0	0	0	0	107.9
400	A	25.6	Very low	30	Very low	98 Å²	98	149.7 Å²	149.7	81%	0.81	81%	0.808	S	S	*	*			trans	-83	118.5	168.5	0	0	0	0	0	108.9
401	E	30.9	Very low	30.2	Very low	167 Å²	167	151.6 Å²	151.6	78%	0.78	81%	0.811	S	S	*	*			trans	-143.1	120.9	166.1	-109.5	164.6	-154.5	0	0	109
402	E	30.4	Very low	30.7	Very low	172 Å²	172	149 Å²	149	80%	0.804	81%	0.805	S	S	*	*			trans	41.7	109.6	149.7	-54.5	-172.5	161.8	0	0	120
403	N	30.3	Very low	31.4	Very low	172 Å²	172	152.5 Å²	152.5	92%	0.92	81%	0.806	S	S	*	*			trans	-147.9	109.1	132.4	-103.9	-39.8	0	0	0	110.6
404	L	27.9	Very low	32.2	Very low	146 Å²	146	146 Å²	146	76%	0.764	79%	0.789	S	S	*	*			trans	-77.2	162.8	164.4	-94.1	122.7	0	0	0	110.2
405	Q	27.6	Very low	32.9	Very low	165 Å²	165	142.5 Å²	142.5	77%	0.771	79%	0.786	S	S	*	*			trans	63.9	92.2	161.8	-68.8	158.8	-32.7	0	0	116.6
406	N	29.8	Very low	33.7	Very low	166 Å²	166	142.6 Å²	142.6	89%	0.888	78%	0.778	S	S	*	*				-138.3	110.4	123.2	-99.5	-31.9	0	0	0	109.5	M408	N406-M408 PolarHBondContact O-N 3.36Å
407	V	28.2	Very low	34.4	Very low	133 Å²	133	137.4 Å²	137.4	81%	0.806	77%	0.768	S	S	*	*			trans	-76.4	115.6	167.5	173.5	0	0	0	0	106.5
408	M	32.5	Very low	35.1	Very low	177 Å²	177	140.5 Å²	140.5	87%	0.872	77%	0.77	S	S	*	*			trans	-93.7	115.1	159.2	-71.5	-169.5	67.4	0	0	107.3	N406	N406-M408 PolarHBondContact O-N 3.36Å
409	S	34.7	Very low	35.5	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-66.5	125.6	171.8	45.3	0	0	0	0	109.9
410	E	36.7	Very low	35.6	Very low	185 Å²	185	138.5 Å²	138.5	86%	0.864	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70.2	128	162.4	-63.4	178.3	145.6	0	0	108.2	P412	E410-P412 WeakPolarHBondContact O-CD 3.12Å
411	D	37.2	Very low	36.3	Very low	143 Å²	143	141.3 Å²	141.3	77%	0.765	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.9	173.9	-102	-41.3	0	0	0	109.2	D413	D411-D413 PolarHBondContact O-N 3.26Å
412	P	43.4	Very low	36.4	Very low	118 Å²	118	141.5 Å²	141.5	77%	0.766	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	0.7	-174.6	-18.8	33.7	0	0	0	115.9	E410	E410-P412 WeakPolarHBondContact O-CD 3.12Å
413	D	45.2	Very low	36.5	Very low	147 Å²	147	137.3 Å²	137.3	79%	0.786	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	28.8	-165.2	-75.4	-55.1	0	0	0	113.8	D411 P415	D411-D413 PolarHBondContact O-N 3.26Å; D413-P415 VanDerWaalsContact O-CD 3.26Å; D413-P415 WeakPolarHBondContact O-CD 3.29Å
414	D	45.7	Very low	36.7	Very low	101 Å²	101	133 Å²	133	54%	0.54	72%	0.721	S	S	.	*			trans	-83.9	109.6	170.2	-174	-4.5	0	0	0	111.6	D416	D414-D416 VanDerWaalsContact C-N 3.28Å; D414-D416 PolarHBondContact O-N 3.46Å; D414-D416 PolarHBondContact OD1-N 3.03Å
415	P	45	Very low	37.1	Very low	113 Å²	113	132 Å²	132	73%	0.734	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-12.1	-177.9	32	-36.9	0	0	0	114.6	D413	D413-P415 VanDerWaalsContact O-CD 3.26Å; D413-P415 WeakPolarHBondContact O-CD 3.29Å
416	D	44.5	Very low	37.4	Very low	112 Å²	112	132 Å²	132	60%	0.599	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-6.6	-174.9	-76.9	-32.4	0	0	0	113.9	D414 H418 L419	D414-D416 VanDerWaalsContact C-N 3.28Å; D414-D416 PolarHBondContact O-N 3.46Å; D414-D416 PolarHBondContact OD1-N 3.03Å; D416-H418 PolarHBondContact O-N 3.45Å; D416-L419 PolarHBondContact O-N 3.47Å; D416-L419 WeakPolarHBondContact OD1-CD1 3.44Å
417	A	40.7	Very low	37.6	Very low	69 Å²	69	125.9 Å²	125.9	57%	0.57	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-1.7	-179	0	0	0	0	0	115.7
418	H	39.6	Very low	38.1	Very low	180 Å²	180	123 Å²	123	83%	0.833	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	11.3	-173.6	-69.6	-24.6	0	0	0	115.2	D416	D416-H418 PolarHBondContact O-N 3.45Å
419	L	38.4	Very low	38.3	Very low	128 Å²	128	122.8 Å²	122.8	67%	0.67	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-90.2	131.3	179.5	-70.1	175.6	0	0	0	113.3	D416 Y421	D416-L419 PolarHBondContact O-N 3.47Å; D416-L419 WeakPolarHBondContact OD1-CD1 3.44Å; L419-Y421 PolarHBondContact O-N 3.17Å
420	P	33.8	Very low	38.7	Very low	113 Å²	113	120.7 Å²	120.7	73%	0.734	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-73.5	124.6	177.1	29.4	-33.4	0	0	0	111.4	Q422	P420-Q422 PolarHBondContact O-N 2.99Å
421	Y	40.4	Very low	39.5	Very low	156 Å²	156	114.6 Å²	114.6	61%	0.612	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-53.6	123.5	178.9	-179.9	-102.4	0	0	0	113.2	L419 P423 D427	L419-Y421 PolarHBondContact O-N 3.17Å; Y421-P423 HydrophobicContact CE1-CB 3.98Å; Y421-D427 VanDerWaalsContact OH-CG 3.23Å; Y421-D427 PolarHBondContact OH-OD1 3.01Å; Y421-D427 PolarHBondContact OH-OD2 2.99Å
422	Q	31.4	Very low	40.5	Very low	171 Å²	171	112.7 Å²	112.7	80%	0.799	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-100.3	119.3	167.9	-70.6	-170.1	-11.3	0	0	109.8	P420	P420-Q422 PolarHBondContact O-N 2.99Å
423	P	33	Very low	41.7	Very low	84 Å²	84	108.9 Å²	108.9	55%	0.545	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-71.7	137.2	176.9	28.9	-33.2	0	0	0	111.2	Y421 D427	Y421-P423 HydrophobicContact CE1-CB 3.98Å; P423-D427 HydrophobicContact CB-CB 3.86Å
424	T	35.3	Very low	43.3	Very low	81 Å²	81	103.5 Å²	103.5	50%	0.497	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-80.5	172.5	172.9	67.8	0	0	0	0	111.6	E426 D427 S428	T424-E426 PolarHBondContact O-N 3.25Å; T424-D427 WeakPolarHBondContact CB-OD2 3.44Å; T424-D427 PolarHBondContact N-OD2 2.66Å; T424-D427 WeakPolarHBondContact O-CB 3.44Å; T424-D427 PolarHBondContact O-N 3Å; T424-D427 PolarHBondContact OG1-OD2 2.73Å; T424-S428 PolarHBondContact O-OG 2.71Å
425	T	37	Very low	45.1	Very low	126 Å²	126	101.7 Å²	101.7	77%	0.773	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-23.7	177	40.3	0	0	0	0	113.6	S428	T425-S428 VanDerWaalsContact O-CB 3.32Å; T425-S428 WeakPolarHBondContact O-CB 3.2Å; T425-S428 PolarHBondContact O-N 3.06Å; T425-S428 PolarHBondContact O-OG 3.34Å
426	E	32	Very low	46.9	Very low	165 Å²	165	99.6 Å²	99.6	77%	0.771	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-31.8	175.6	-61	-171.9	166.9	0	0	111.9	T424 S428 E429	T424-E426 PolarHBondContact O-N 3.25Å; E426-S428 PolarHBondContact O-N 2.82Å; E426-E429 PolarHBondContact O-N 3.43Å
427	D	35.8	Very low	48.8	Very low	38 Å²	38	98.7 Å²	98.7	20%	0.203	54%	0.541	C	S	.	.	H	α-helix	trans	-61.3	-27.1	172.5	-64.5	-71.7	0	0	0	112.2	Y421 P423 T424 E429 S430 L431	Y421-D427 VanDerWaalsContact OH-CG 3.23Å; Y421-D427 PolarHBondContact OH-OD1 3.01Å; Y421-D427 PolarHBondContact OH-OD2 2.99Å; P423-D427 HydrophobicContact CB-CB 3.86Å; T424-D427 WeakPolarHBondContact CB-OD2 3.44Å; T424-D427 PolarHBondContact N-OD2 2.66Å; T424-D427 WeakPolarHBondContact O-CB 3.44Å; T424-D427 PolarHBondContact O-N 3Å; T424-D427 PolarHBondContact OG1-OD2 2.73Å; D427-E429 VanDerWaalsContact C-N 3.34Å; D427-E429 PolarHBondContact O-N 3.01Å; D427-S430 PolarHBondContact O-N 2.81Å; D427-S430 PolarHBondContact O-OG 3.4Å; D427-L431 VanDerWaalsContact O-CG 3.28Å; D427-L431 WeakPolarHBondContact O-CG 3.36Å; D427-L431 PolarHBondContact O-N 3.14Å
428	S	37.3	Very low	50.8	Low	71 Å²	71	97 Å²	97	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-34.2	-176.1	-58.5	0	0	0	0	113.4	T424 T425 E426	T424-S428 PolarHBondContact O-OG 2.71Å; T425-S428 VanDerWaalsContact O-CB 3.32Å; T425-S428 WeakPolarHBondContact O-CB 3.2Å; T425-S428 PolarHBondContact O-N 3.06Å; T425-S428 PolarHBondContact O-OG 3.34Å; E426-S428 PolarHBondContact O-N 2.82Å
429	E	36.6	Very low	52.8	Low	173 Å²	173	91.9 Å²	91.9	81%	0.808	51%	0.505	S	S	*	.	H	α-helix	trans	-85.8	-30.8	178.2	-62.5	-167.7	152.4	0	0	112	E426 D427 L431	E426-E429 PolarHBondContact O-N 3.43Å; D427-E429 VanDerWaalsContact C-N 3.34Å; D427-E429 PolarHBondContact O-N 3.01Å; E429-L431 VanDerWaalsContact C-N 3.32Å; E429-L431 PolarHBondContact O-N 2.98Å
430	S	42.8	Very low	54.9	Low	61 Å²	61	91.1 Å²	91.1	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-71	-21.7	179.5	76.9	0	0	0	0	114.7	T54 D427 N432 A433	T54-S430 PolarHBondContact OG1-O 3.49Å; T54-S430 VanDerWaalsContact OG1-O 3.06Å; D427-S430 PolarHBondContact O-N 2.81Å; D427-S430 PolarHBondContact O-OG 3.4Å; S430-N432 PolarHBondContact O-N 3.19Å; S430-N432 VanDerWaalsContact O-N 3.1Å; S430-A433 WeakPolarHBondContact O-CB 3.28Å; S430-A433 PolarHBondContact O-N 3.14Å
431	L	53.5	Low	57.2	Low	56 Å²	56	86.4 Å²	86.4	29%	0.293	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-3.3	-176.4	-83.2	166.4	0	0	0	115.5	G55 T57 D427 E429	G55-L431 WeakPolarHBondContact CA-O 3.32Å; T57-L431 HydrophobicContact CG2-CD2 4.31Å; D427-L431 VanDerWaalsContact O-CG 3.28Å; D427-L431 WeakPolarHBondContact O-CG 3.36Å; D427-L431 PolarHBondContact O-N 3.14Å; E429-L431 VanDerWaalsContact C-N 3.32Å; E429-L431 PolarHBondContact O-N 2.98Å
432	N	58.8	Low	59.2	Low	104 Å²	104	79.1 Å²	79.1	56%	0.556	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	23.1	175	-56.7	-61.5	0	0	0	112.7	I91 S430	I91-N432 WeakPolarHBondContact CD1-OD1 3.15Å; S430-N432 PolarHBondContact O-N 3.19Å; S430-N432 VanDerWaalsContact O-N 3.1Å
433	A	68.7	Low	61.7	Low	37 Å²	37	74.6 Å²	74.6	31%	0.306	43%	0.427	S	S	.	.			trans	-72.2	150.6	178.3	0	0	0	0	0	112.5	T54 S430	T54-A433 HydrophobicContact CG2-CB 4.22Å; T54-A433 PolarHBondContact N-O 3.39Å; T54-A433 PolarHBondContact OG1-N 2.85Å; T54-A433 VanDerWaalsContact OG1-N 3.13Å; T54-A433 PolarHBondContact OG1-O 3.32Å; T54-A433 VanDerWaalsContact OG1-O 3.1Å; S430-A433 WeakPolarHBondContact O-CB 3.28Å; S430-A433 PolarHBondContact O-N 3.14Å
434	A	79.3	Confident	64	Low	34 Å²	34	78.6 Å²	78.6	28%	0.281	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	117	173.3	0	0	0	0	0	110.3	L51 S52 L53 V89	L51-A434 HydrophobicContact CD1-CB 4.46Å; S52-A434 WeakPolarHBondContact O-CA 3.45Å; L53-A434 HydrophobicContact CD2-CB 3.69Å; V89-A434 HydrophobicContact CG1-CB 3.39Å
435	D	83.5	Confident	65.9	Low	63 Å²	63	77.3 Å²	77.3	34%	0.337	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	106.1	-175.9	-50.8	-42.9	0	0	0	108.8	R38 L51 S52 N437	R38-D435 IonicContact CZ-OD2 3.84Å; R38-D435 IonicContact NH1-OD2 3.68Å; R38-D435 PolarHBondContact NH1-OD2 3.31Å; R38-D435 IonicContact NH2-OD2 3.44Å; L51-D435 CarbonylContact C-O 3.51Å; L51-D435 WeakPolarHBondContact CA-O 3.34Å; S52-D435 PolarHBondContact N-O 2.82Å; S52-D435 PolarHBondContact O-N 3.15Å; D435-N437 PolarHBondContact O-N 2.89Å
436	I	83.1	Confident	68	Low	70 Å²	70	72.3 Å²	72.3	36%	0.359	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	107.6	171.7	-56.2	171.8	0	0	0	108	L51 V89 P439 Y442	L51-I436 HydrophobicContact CD1-CB 4.48Å; L51-I436 HydrophobicContact CD1-CG1 3.74Å; V89-I436 HydrophobicContact CG2-CD1 4.31Å; I436-P439 HydrophobicContact CG2-CB 4.22Å; I436-P439 HydrophobicContact CG2-CG 4.03Å; I436-Y442 HydrophobicContact CD1-CD1 4.22Å; I436-Y442 HydrophobicContact CD1-CE1 4.21Å; I436-Y442 HydrophobicContact CG2-CD1 4.28Å; I436-Y442 HydrophobicContact CG2-CG 3.94Å
437	N	83.6	Confident	70.1	Confident	93 Å²	93	67.1 Å²	67.1	50%	0.497	36%	0.363	S	S	.	.	S	Bend	trans	-91.1	-28.9	-173.5	-69.5	-36.2	0	0	0	112.9	C49 I50 D435	C49-N437 WeakPolarHBondContact O-CB 3.45Å; C49-N437 PolarHBondContact SG-ND2 3.12Å; C49-N437 VanDerWaalsContact SG-ND2 3.41Å; I50-N437 PolarHBondContact O-N 2.72Å; D435-N437 PolarHBondContact O-N 2.89Å
438	D	82.5	Confident	71.1	Confident	33 Å²	33	68.9 Å²	68.9	18%	0.176	38%	0.377	C	S	.	.			trans	-129.5	86.5	172.2	-173.2	-19.7	0	0	0	109.4	I50 V440 E441 Y442	I50-D438 PolarHBondContact O-N 3.33Å; D438-V440 VanDerWaalsContact C-N 3.25Å; D438-V440 PolarHBondContact O-N 2.77Å; D438-V440 PolarHBondContact OD1-N 2.92Å; D438-E441 HydrophobicContact CB-CB 4.32Å; D438-E441 PolarHBondContact O-N 2.92Å; D438-E441 PolarHBondContact OD1-N 2.74Å; D438-Y442 WeakPolarHBondContact O-CB 3.38Å; D438-Y442 PolarHBondContact O-N 3Å
439	P	82.8	Confident	71.9	Confident	72 Å²	72	74 Å²	74	47%	0.468	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-32.9	-177.5	-25.6	35	0	0	0	113.7	I436 D443	I436-P439 HydrophobicContact CG2-CB 4.22Å; I436-P439 HydrophobicContact CG2-CG 4.03Å; P439-D443 WeakPolarHBondContact O-CB 3.47Å; P439-D443 PolarHBondContact O-N 3.34Å
440	V	82.3	Confident	72.3	Confident	113 Å²	113	72.6 Å²	72.6	69%	0.685	39%	0.385	S	S	*	.	H	α-helix	trans	-71.7	-44.2	-177.3	179.5	0	0	0	0	110.6	D438 R444	D438-V440 VanDerWaalsContact C-N 3.25Å; D438-V440 PolarHBondContact O-N 2.77Å; D438-V440 PolarHBondContact OD1-N 2.92Å; V440-R444 VanDerWaalsContact O-CB 3.25Å; V440-R444 WeakPolarHBondContact O-CB 3.29Å; V440-R444 PolarHBondContact O-N 3.09Å; V440-R444 VanDerWaalsContact O-N 3.14Å
441	E	81.4	Confident	72.1	Confident	13 Å²	13	76 Å²	76	6%	0.061	40%	0.403	C	S	.	.	H	α-helix	trans	-73.9	-34.2	175.4	-164.6	73.3	152.4	0	0	111.8	A43 K46 I50 D438 R444 I445	A43-E441 HydrophobicContact CB-CG 4.38Å; K46-E441 HydrophobicContact CD-CG 4.2Å; K46-E441 VanDerWaalsContact CE-OE1 3.25Å; K46-E441 WeakPolarHBondContact CE-OE1 3.37Å; K46-E441 IonicContact NZ-OE1 3.7Å; K46-E441 PolarHBondContact NZ-OE1 2.85Å; K46-E441 IonicContact NZ-OE2 3.22Å; K46-E441 PolarHBondContact NZ-OE2 3.35Å; I50-E441 HydrophobicContact CD1-CG 4.38Å; I50-E441 HydrophobicContact CG1-CG 4.41Å; D438-E441 HydrophobicContact CB-CB 4.32Å; D438-E441 PolarHBondContact O-N 2.92Å; D438-E441 PolarHBondContact OD1-N 2.74Å; E441-R444 PolarHBondContact O-N 3.13Å; E441-R444 IonicContact OE1-NH1 2.72Å; E441-R444 PolarHBondContact OE1-NH1 3.3Å; E441-R444 VanDerWaalsContact OE2-CD 3.3Å; E441-R444 WeakPolarHBondContact OE2-CD 3.45Å; E441-R444 IonicContact OE2-CZ 3.66Å; E441-R444 IonicContact OE2-NH1 3.95Å; E441-R444 PolarHBondContact OE2-NH1 3.48Å; E441-I445 HydrophobicContact CG-CD1 3.68Å; E441-I445 HydrophobicContact CG-CG1 4.27Å; E441-I445 WeakPolarHBondContact O-CB 3.28Å; E441-I445 WeakPolarHBondContact O-CG1 3.39Å; E441-I445 PolarHBondContact O-N 3.2Å
442	Y	83.5	Confident	71.3	Confident	3 Å²	3	78.7 Å²	78.7	1%	0.012	42%	0.422	C	S	.	.	H	α-helix	trans	-56.7	-54	172.1	171	-93	0	0	0	111.5	I50 L86 E87 V89 I436 D438 R444 I445 F446 K447	I50-Y442 HydrophobicContact CG2-CD2 4.3Å; I50-Y442 HydrophobicContact CG2-CG 4.48Å; L86-Y442 VanDerWaalsContact O-CE2 3.28Å; L86-Y442 WeakPolarHBondContact O-CE2 3.11Å; L86-Y442 PolarHBondContact O-OH 3.41Å; E87-Y442 PolarHBondContact O-OH 2.82Å; V89-Y442 HydrophobicContact CG2-CE1 4.41Å; V89-Y442 HydrophobicContact CG2-CE2 3.79Å; V89-Y442 WeakPolarHBondContact CG2-OH 3.22Å; I436-Y442 HydrophobicContact CD1-CD1 4.22Å; I436-Y442 HydrophobicContact CD1-CE1 4.21Å; I436-Y442 HydrophobicContact CG2-CD1 4.28Å; I436-Y442 HydrophobicContact CG2-CG 3.94Å; D438-Y442 WeakPolarHBondContact O-CB 3.38Å; D438-Y442 PolarHBondContact O-N 3Å; Y442-R444 VanDerWaalsContact C-N 3.31Å; Y442-R444 PolarHBondContact O-N 3.25Å; Y442-I445 PolarHBondContact O-N 2.89Å; Y442-F446 AromaticContact CD2-CD2 3.61Å; Y442-F446 HydrophobicContact CD2-CD2 3.61Å; Y442-F446 HydrophobicContact CD2-CE2 4.31Å; Y442-F446 HydrophobicContact CD2-CG 4.46Å; Y442-F446 HydrophobicContact CE2-CB 4.09Å; Y442-F446 AromaticContact CE2-CD2 3.79Å; Y442-F446 HydrophobicContact CE2-CD2 3.79Å; Y442-F446 HydrophobicContact CE2-CG 4.23Å; Y442-F446 HydrophobicContact CG-CD2 4.41Å; Y442-F446 PolarHBondContact O-N 3.4Å; Y442-K447 HydrophobicContact CE1-CD 3.94Å; Y442-K447 HydrophobicContact CE1-CG 4.44Å; Y442-K447 VanDerWaalsContact OH-CE 3.23Å; Y442-K447 WeakPolarHBondContact OH-CE 3.2Å; Y442-K447 PolarHBondContact OH-NZ 2.92Å
443	D	82.3	Confident	70.1	Confident	77 Å²	77	78.9 Å²	78.9	41%	0.412	43%	0.429	S	S	.	.	H	α-helix	trans	-64.2	-37.4	179.9	-76.8	-23.7	0	0	0	111.6	P439 I445 K447	P439-D443 WeakPolarHBondContact O-CB 3.47Å; P439-D443 PolarHBondContact O-N 3.34Å; D443-I445 PolarHBondContact O-N 3.06Å; D443-K447 CarbonylContact O-C 3.58Å; D443-K447 WeakPolarHBondContact O-CA 3.49Å; D443-K447 PolarHBondContact O-N 2.6Å
444	R	82	Confident	68.5	Low	168 Å²	168	88.5 Å²	88.5	63%	0.634	46%	0.457	S	S	*	.	H	α-helix	trans	-64.4	-36.5	177.7	-176.7	-173.8	177.3	-148.3	-1.4	113.4	V440 E441 Y442	V440-R444 VanDerWaalsContact O-CB 3.25Å; V440-R444 WeakPolarHBondContact O-CB 3.29Å; V440-R444 PolarHBondContact O-N 3.09Å; V440-R444 VanDerWaalsContact O-N 3.14Å; E441-R444 PolarHBondContact O-N 3.13Å; E441-R444 IonicContact OE1-NH1 2.72Å; E441-R444 PolarHBondContact OE1-NH1 3.3Å; E441-R444 VanDerWaalsContact OE2-CD 3.3Å; E441-R444 WeakPolarHBondContact OE2-CD 3.45Å; E441-R444 IonicContact OE2-CZ 3.66Å; E441-R444 IonicContact OE2-NH1 3.95Å; E441-R444 PolarHBondContact OE2-NH1 3.48Å; Y442-R444 VanDerWaalsContact C-N 3.31Å; Y442-R444 PolarHBondContact O-N 3.25Å
445	I	76.2	Confident	66.4	Low	53 Å²	53	91 Å²	91	27%	0.272	47%	0.473	S	S	.	.	H	α-helix	trans	-87.2	-48.4	-177.4	-67.2	175.6	0	0	0	110.8	V29 A43 I50 E441 Y442 D443	V29-I445 HydrophobicContact CG1-CD1 4.3Å; V29-I445 HydrophobicContact CG1-CG2 3.84Å; A43-I445 HydrophobicContact CB-CD1 4.22Å; I50-I445 HydrophobicContact CD1-CD1 3.77Å; E441-I445 HydrophobicContact CG-CD1 3.68Å; E441-I445 HydrophobicContact CG-CG1 4.27Å; E441-I445 WeakPolarHBondContact O-CB 3.28Å; E441-I445 WeakPolarHBondContact O-CG1 3.39Å; E441-I445 PolarHBondContact O-N 3.2Å; Y442-I445 PolarHBondContact O-N 2.89Å; D443-I445 PolarHBondContact O-N 3.06Å
446	F	80.1	Confident	64.2	Low	22 Å²	22	94.2 Å²	94.2	10%	0.096	50%	0.497	C	S	.	.	H	α-helix	trans	-104.2	-14.4	-169	-56.7	-70.8	0	0	0	114.3	L41 I50 L86 Y442 P448	L41-F446 HydrophobicContact CD1-CE2 4.23Å; L41-F446 HydrophobicContact CD1-CZ 3.9Å; I50-F446 HydrophobicContact CG2-CE2 4.44Å; L86-F446 HydrophobicContact CB-CD1 3.82Å; L86-F446 HydrophobicContact CB-CE1 4.04Å; L86-F446 HydrophobicContact CB-CG 4.35Å; L86-F446 HydrophobicContact CD1-CD1 4.21Å; L86-F446 HydrophobicContact CD1-CE1 3.58Å; L86-F446 HydrophobicContact CD1-CZ 4.1Å; L86-F446 HydrophobicContact CG-CE1 4.44Å; Y442-F446 AromaticContact CD2-CD2 3.61Å; Y442-F446 HydrophobicContact CD2-CD2 3.61Å; Y442-F446 HydrophobicContact CD2-CE2 4.31Å; Y442-F446 HydrophobicContact CD2-CG 4.46Å; Y442-F446 HydrophobicContact CE2-CB 4.09Å; Y442-F446 AromaticContact CE2-CD2 3.79Å; Y442-F446 HydrophobicContact CE2-CD2 3.79Å; Y442-F446 HydrophobicContact CE2-CG 4.23Å; Y442-F446 HydrophobicContact CG-CD2 4.41Å; Y442-F446 PolarHBondContact O-N 3.4Å; F446-P448 VanDerWaalsContact C-CD 3.42Å
447	K	76.6	Confident	62.1	Low	56 Å²	56	96 Å²	96	24%	0.243	52%	0.516	C	S	.	.			trans	-130.3	43.9	177.9	-63.9	-178.4	173.4	155.6	0	114.6	E87 Y442 D443 H449 H450	E87-K447 HydrophobicContact CG-CG 4.28Å; E87-K447 WeakPolarHBondContact O-CE 3.44Å; E87-K447 PolarHBondContact O-NZ 2.85Å; Y442-K447 HydrophobicContact CE1-CD 3.94Å; Y442-K447 HydrophobicContact CE1-CG 4.44Å; Y442-K447 VanDerWaalsContact OH-CE 3.23Å; Y442-K447 WeakPolarHBondContact OH-CE 3.2Å; Y442-K447 PolarHBondContact OH-NZ 2.92Å; D443-K447 CarbonylContact O-C 3.58Å; D443-K447 WeakPolarHBondContact O-CA 3.49Å; D443-K447 PolarHBondContact O-N 2.6Å; K447-H449 PolarHBondContact O-N 3.49Å; K447-H450 PolarHBondContact O-N 2.85Å
448	P	57	Low	59.8	Low	75 Å²	75	99.5 Å²	99.5	49%	0.487	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-9.8	-170.9	28.5	-38	0	0	0	115.4	F446	F446-P448 VanDerWaalsContact C-CD 3.42Å
449	H	53.5	Low	57.7	Low	179 Å²	179	104.7 Å²	104.7	83%	0.829	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-3.7	-177.7	-66.4	-56	0	0	0	114.8	K447	K447-H449 PolarHBondContact O-N 3.49Å
450	H	45.6	Very low	55.3	Low	142 Å²	142	111.3 Å²	111.3	66%	0.657	58%	0.578	S	S	*	*	S	Bend	trans	-100.5	127.9	169.8	-76.7	-82.7	0	0	0	111.2	K447	K447-H450 PolarHBondContact O-N 2.85Å
451	T	38.1	Very low	53	Low	132 Å²	132	109.7 Å²	109.7	81%	0.81	58%	0.576	S	S	*	*			trans	59.8	76.4	175.4	53.5	0	0	0	0	118
452	V	37.3	Very low	50.7	Low	114 Å²	114	116.4 Å²	116.4	69%	0.691	61%	0.611	S	S	*	*			trans	-89.8	114.5	142.1	178.1	0	0	0	0	108.1	R454	V452-R454 HydrophobicContact CG1-CG 4.37Å; V452-R454 PolarHBondContact O-N 3.33Å
453	P	33.8	Very low	48.3	Very low	108 Å²	108	121.5 Å²	121.5	70%	0.701	64%	0.642	S	S	*	*			trans	-68.7	100.1	170.4	27.7	-31.8	0	0	0	109.1	S455	P453-S455 PolarHBondContact O-N 2.81Å
454	R	33.4	Very low	46	Very low	238 Å²	238	123.1 Å²	123.1	90%	0.898	66%	0.66	S	S	*	*			trans	-76.2	62.6	175.2	-70	-169.3	178.9	-163	0.3	111.6	V452	V452-R454 HydrophobicContact CG1-CG 4.37Å; V452-R454 PolarHBondContact O-N 3.33Å
455	S	36.6	Very low	43.7	Very low	86 Å²	86	126 Å²	126	60%	0.601	67%	0.671	S	S	*	*	S	Bend	trans	-169.1	139.1	159.2	37.5	0	0	0	0	109.5	P453 S457	P453-S455 PolarHBondContact O-N 2.81Å; S455-S457 PolarHBondContact O-N 2.87Å; S455-S457 VanDerWaalsContact O-N 3.15Å
456	P	37.5	Very low	41.6	Very low	131 Å²	131	134.5 Å²	134.5	85%	0.851	70%	0.699	S	S	*	*			trans	-66.3	113.1	164.1	-8.7	24.2	0	0	0	107.5	Q458	P456-Q458 PolarHBondContact O-N 2.87Å
457	S	38.9	Very low	39.3	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	74%	0.737	S	S	*	*			trans	-65.7	99.8	170.9	36.9	0	0	0	0	108.8	S455 V459	S455-S457 PolarHBondContact O-N 2.87Å; S455-S457 VanDerWaalsContact O-N 3.15Å; S457-V459 PolarHBondContact O-N 2.9Å; S457-V459 VanDerWaalsContact O-N 3.09Å
458	Q	35.5	Very low	37.4	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	76%	0.764	S	S	*	*			trans	-55.5	117.5	172.9	-122.6	-173	19.4	0	0	108.7	P456 R460	P456-Q458 PolarHBondContact O-N 2.87Å; Q458-R460 PolarHBondContact O-N 2.9Å
459	V	37.6	Very low	36.4	Very low	141 Å²	141	146.8 Å²	146.8	86%	0.855	78%	0.778	S	S	*	*			trans	-68.1	88.7	169.8	-179.6	0	0	0	0	107.8	S457 A461	S457-V459 PolarHBondContact O-N 2.9Å; S457-V459 VanDerWaalsContact O-N 3.09Å; V459-A461 PolarHBondContact O-N 2.84Å; V459-A461 VanDerWaalsContact O-N 3.08Å
460	R	32.8	Very low	35.4	Very low	212 Å²	212	145.7 Å²	145.7	80%	0.8	78%	0.778	S	S	*	*			trans	-69.5	102.3	165.3	-92.9	-172.6	171.8	-175.5	-2.6	107.9	Q458 I462	Q458-R460 PolarHBondContact O-N 2.9Å; R460-I462 PolarHBondContact O-N 3.17Å
461	A	33.6	Very low	35	Very low	78 Å²	78	148 Å²	148	65%	0.645	79%	0.789	S	S	*	*			trans	-60.5	102.9	171.1	0	0	0	0	0	110.1	V459 T463	V459-A461 PolarHBondContact O-N 2.84Å; V459-A461 VanDerWaalsContact O-N 3.08Å; A461-T463 VanDerWaalsContact C-N 3.3Å; A461-T463 PolarHBondContact O-N 2.85Å
462	I	34.1	Very low	35	Very low	154 Å²	154	152.7 Å²	152.7	79%	0.79	79%	0.793	S	S	*	*			trans	-71.9	93.4	166.4	-60	178.6	0	0	0	107.1	R460	R460-I462 PolarHBondContact O-N 3.17Å
463	T	32.6	Very low	35	Very low	110 Å²	110	151.3 Å²	151.3	68%	0.675	79%	0.794	S	S	*	*			trans	-115.8	80.2	166.8	39.8	0	0	0	0	109	A461 R465	A461-T463 VanDerWaalsContact C-N 3.3Å; A461-T463 PolarHBondContact O-N 2.85Å; T463-R465 VanDerWaalsContact C-N 3.31Å; T463-R465 PolarHBondContact O-N 3.47Å
464	S	33.6	Very low	35.2	Very low	112 Å²	112	152.5 Å²	152.5	78%	0.783	80%	0.799	S	S	*	*			trans	-68.7	92.6	162.5	41.5	0	0	0	0	108.7	R466	S464-R466 PolarHBondContact O-N 3.31Å
465	R	34.2	Very low	35.5	Very low	229 Å²	229	148.4 Å²	148.4	86%	0.864	80%	0.795	S	S	*	*			trans	-67.4	129.7	174.7	-79.1	-177.1	171.8	-177.5	-1.8	110.5	T463	T463-R465 VanDerWaalsContact C-N 3.31Å; T463-R465 PolarHBondContact O-N 3.47Å
466	R	32	Very low	35.8	Very low	231 Å²	231	148.8 Å²	148.8	87%	0.872	80%	0.796	S	S	*	*			trans	8.3	122.1	148.5	-66.7	176.1	172.4	167.7	-3.8	117.2	S464	S464-R466 PolarHBondContact O-N 3.31Å
467	N	31.2	Very low	35.9	Very low	164 Å²	164	148.5 Å²	148.5	88%	0.877	79%	0.792	S	S	*	*			trans	-102.4	101.8	143.7	-84.5	-5.1	0	0	0	109.3
468	V	36.7	Very low	35.7	Very low	137 Å²	137	148.6 Å²	148.6	83%	0.83	79%	0.788	S	S	*	*			trans	-142.9	111.3	152.3	179.4	0	0	0	0	106
469	S	35.4	Very low	35.9	Very low	109 Å²	109	149.4 Å²	149.4	76%	0.762	79%	0.789	S	S	*	*			trans	-145	98.1	174	53.5	0	0	0	0	108.8
470	N	34	Very low	35.9	Very low	156 Å²	156	149 Å²	149	83%	0.834	78%	0.782	S	S	*	*			trans	-77.8	126.8	153.1	-81.2	-13.5	0	0	0	106.6
471	E	36.6	Very low	36	Very low	191 Å²	191	144.3 Å²	144.3	89%	0.893	77%	0.772	S	S	*	*				-171.3	142.7	125.2	-103.4	165.1	-166.3	0	0	112.4
472	Y	37.9	Very low	36.2	Very low	230 Å²	230	149.5 Å²	149.5	90%	0.902	78%	0.78	S	S	*	*			trans	-33	143.8	-177	-75.4	-95.5	0	0	0	121.8
473	A	37.4	Very low	36.3	Very low	85 Å²	85	147 Å²	147	70%	0.702	78%	0.777	S	S	*	*			trans	99.5	118.8	130	0	0	0	0	0	122.3
474	T	38.1	Very low	36.7	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	79%	0.785	S	S	*	*			trans	70.6	88.3	141.2	53.7	0	0	0	0	121.6
475	D	38.6	Very low	37.3	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	78%	0.784	S	S	*	*				36	155.6	106	-89.5	11.3	0	0	0	122.3
476	P	44	Very low	37.7	Very low	95 Å²	95	144 Å²	144	62%	0.617	78%	0.777	S	S	*	*			cis	-145	-161	-34.7	37.9	-16.9	0	0	0	114
477	T	38.2	Very low	37.9	Very low	125 Å²	125	138 Å²	138	77%	0.767	77%	0.77	S	S	*	*			trans	85.2	139	171.1	76.3	0	0	0	0	116.3
478	T	35.9	Very low	38.4	Very low	110 Å²	110	135.6 Å²	135.6	68%	0.675	77%	0.766	S	S	*	*			cis	-155.9	142.7	15.2	-19.3	0	0	0	0	112.3
479	K	39.4	Very low	38.6	Very low	183 Å²	183	134 Å²	134	80%	0.796	76%	0.759	S	S	*	*			trans	38.3	141.4	138.2	-71.2	177	-173.4	175.9	0	120.7
480	L	37.5	Very low	38.8	Very low	134 Å²	134	135.3 Å²	135.3	70%	0.702	76%	0.757	S	S	*	*			cis	-163.7	158.3	16.9	-112.3	159	0	0	0	112.3
481	N	35.2	Very low	39	Very low	113 Å²	113	134.8 Å²	134.8	60%	0.604	75%	0.753	S	S	*	*			trans	-28.2	165.5	167.7	-41.6	-14.5	0	0	0	118.4
482	F	38.4	Very low	39.1	Very low	186 Å²	186	131.9 Å²	131.9	82%	0.816	75%	0.748	S	S	*	*			cis	-156.7	172.5	34.6	-88.9	-68.5	0	0	0	109.5
483	S	35.8	Very low	38.7	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	74%	0.744	S	S	*	*			cis	-163	166.7	-3.2	37	0	0	0	0	111.2
484	L	41.2	Very low	38.8	Very low	162 Å²	162	129.2 Å²	129.2	85%	0.848	74%	0.743	S	S	*	*			trans	-118.5	164.7	162.6	-88.1	133.8	0	0	0	108.5
485	P	45.2	Very low	38.6	Very low	117 Å²	117	128.4 Å²	128.4	76%	0.76	74%	0.738	S	S	*	*				-157.8	-172	94.4	42	-20.7	0	0	0	114.9
486	P	42.2	Very low	38.1	Very low	108 Å²	108	127.4 Å²	127.4	70%	0.701	74%	0.737	S	S	*	*				-137	167.5	-57.5	41.2	-25.9	0	0	0	116
487	S	37.8	Very low	37.6	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	75%	0.751	S	S	*	*			trans	-13.9	152.3	152.9	60.8	0	0	0	0	119.8
488	S	39.8	Very low	37.1	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	76%	0.755	S	S	*	*				-166.9	162	70.1	49.7	0	0	0	0	117.2
489	P	42.6	Very low	37	Very low	105 Å²	105	136.6 Å²	136.6	68%	0.682	76%	0.764	S	S	*	*			trans	-117.2	175.8	-169.9	42.4	-30.9	0	0	0	115.2
490	N	39.8	Very low	36.3	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	77%	0.769	S	S	*	*				175.1	132.6	125.3	-89.9	-26	0	0	0	115.4
491	I	37.9	Very low	35.9	Very low	145 Å²	145	137.3 Å²	137.3	74%	0.744	78%	0.775	S	S	*	*			trans	44.4	121.3	130.4	-40.3	169.6	0	0	0	117.2
492	V	37.6	Very low	35.7	Very low	130 Å²	130	138 Å²	138	79%	0.788	78%	0.783	S	S	*	*				-167.8	139.6	83.2	163.6	0	0	0	0	111.2
493	N	30.8	Very low	35.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	78%	0.781	S	S	*	*			trans	-96	167.4	165	-88.9	-16.9	0	0	0	109.9
494	P	38.4	Very low	35.1	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	79%	0.786	S	S	*	*			cis	-149.4	-161.8	26.5	41.8	-18.6	0	0	0	117.1
495	T	34.1	Very low	34.5	Very low	116 Å²	116	136.7 Å²	136.7	71%	0.712	78%	0.781	S	S	*	*			trans	79.2	100.3	153.3	45.6	0	0	0	0	122.4
496	T	29.3	Very low	34.1	Very low	131 Å²	131	139.2 Å²	139.2	80%	0.804	79%	0.787	S	S	*	*			trans	35.9	109	130.5	52	0	0	0	0	120.9
497	R	32.6	Very low	33.7	Very low	240 Å²	240	141.6 Å²	141.6	91%	0.906	79%	0.793	S	S	*	*			trans	-159.9	167.8	132.9	-122.5	173.7	175.2	169.4	-0.3	112.9
498	E	28.3	Very low	33.5	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	79%	0.789	S	S	*	*			trans	-66.7	156.7	-170	-58.9	142.9	121.5	0	0	114
499	A	32.7	Very low	33.1	Very low	104 Å²	104	143.5 Å²	143.5	86%	0.86	79%	0.793	S	S	*	*			trans	-127.1	98.1	173	0	0	0	0	0	112
500	K	26.3	Very low	32.6	Very low	208 Å²	208	149 Å²	149	90%	0.904	80%	0.8	S	S	*	*			trans	-103.4	116.5	149.2	-86.3	-175.8	174.8	178.9	0	107.3
501	C	27.9	Very low	32.3	Very low	123 Å²	123	153 Å²	153	83%	0.831	81%	0.811	S	S	*	*			trans	-177.7	149.7	169.4	-108.2	0	0	0	0	108.6
502	V	32	Very low	31.9	Very low	127 Å²	127	152.1 Å²	152.1	77%	0.77	81%	0.813	S	S	*	*			cis	-160.1	161.7	-16.3	100.9	0	0	0	0	108.7
503	Q	27.7	Very low	31.9	Very low	166 Å²	166	151.8 Å²	151.8	78%	0.776	82%	0.817	S	S	*	*			trans	-71	146	175.7	-65.5	164.9	-52.3	0	0	112.4
504	S	32.9	Very low	31.9	Very low	117 Å²	117	152.1 Å²	152.1	82%	0.818	82%	0.818	S	S	*	*			trans	-107.4	101	162.7	58.6	0	0	0	0	110.5
505	N	29.7	Very low	31.8	Very low	142 Å²	142	156.9 Å²	156.9	76%	0.759	83%	0.828	S	S	*	*			trans	-84.1	139.3	167	-83	-18.8	0	0	0	110.3
506	I	36.3	Very low	31.8	Very low	170 Å²	170	157 Å²	157	87%	0.872	83%	0.831	S	S	*	*			trans	-123.5	121.6	161.1	-66.8	179.8	0	0	0	107.9
507	L	33	Very low	32	Very low	158 Å²	158	160.5 Å²	160.5	83%	0.827	84%	0.836	S	S	*	*			trans	-67.4	159.4	171.1	-71.2	158	0	0	0	109.8
508	S	33.2	Very low	32.4	Very low	94 Å²	94	154.6 Å²	154.6	66%	0.657	83%	0.826	S	S	*	*			cis	-174	150.9	0.5	38.4	0	0	0	0	108.1
509	D	32.7	Very low	32.7	Very low	164 Å²	164	151.4 Å²	151.4	88%	0.877	82%	0.821	S	S	*	*				-167	155	117.9	-111.9	-24.9	0	0	0	113.5
510	R	30.6	Very low	33.1	Very low	221 Å²	221	152.3 Å²	152.3	83%	0.834	82%	0.818	S	S	*	*			trans	-102.6	141.2	-173.8	-64.7	175	173.1	-174.9	-2.7	111.7
511	F	34.4	Very low	33.3	Very low	218 Å²	218	147.9 Å²	147.9	96%	0.956	81%	0.813	S	S	*	*			trans	-153.6	138.2	131.8	-103.6	-72.8	0	0	0	110.5
512	T	30.7	Very low	33.8	Very low	127 Å²	127	148.7 Å²	148.7	78%	0.779	82%	0.815	S	S	*	*			trans	-116	134.1	-169.3	48.2	0	0	0	0	112.2
513	S	36.6	Very low	34	Very low	124 Å²	124	149 Å²	149	87%	0.867	82%	0.817	S	S	*	*			trans	-163.6	120.3	141.3	49.4	0	0	0	0	112
514	D	31.4	Very low	34.1	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	82%	0.821	S	S	*	*			trans	-78.2	152.4	173.3	-66	-70.4	0	0	0	112.7
515	K	36.5	Very low	34.1	Very low	205 Å²	205	146.2 Å²	146.2	89%	0.891	82%	0.822	S	S	*	*			trans	-163.5	130.7	143.4	-112.3	164.7	-172.4	177.8	0	111.9
516	P	33.1	Very low	34	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	83%	0.826	S	S	*	*			trans	-82.5	152.9	177.5	33.8	-34.6	0	0	0	112.1
517	F	34.5	Very low	33.9	Very low	204 Å²	204	146 Å²	146	90%	0.895	83%	0.827	S	S	*	*			trans	-95.3	127.9	-180	-158.6	-88.2	0	0	0	111.2
518	T	39.2	Very low	33.7	Very low	116 Å²	116	143 Å²	143	71%	0.712	82%	0.82	S	S	*	*			trans	-108.5	141.1	175.9	46.3	0	0	0	0	111.3
519	P	35.1	Very low	33.8	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-80.8	148	175	33.3	-33.7	0	0	0	111.3
520	P	42.3	Very low	33.7	Very low	123 Å²	123	153.7 Å²	153.7	80%	0.799	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-76.8	127.9	179.6	30.5	-33.5	0	0	0	111.8
521	S	30.3	Very low	33.8	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.2	127.9	165.6	54.8	0	0	0	0	110.6
522	T	38.3	Very low	33.8	Very low	140 Å²	140	147.2 Å²	147.2	86%	0.859	83%	0.825	S	S	*	*			trans	-124.5	118.8	164.3	-2.8	0	0	0	0	110.2
523	T	34.7	Very low	33.8	Very low	135 Å²	135	149.4 Å²	149.4	83%	0.828	83%	0.826	S	S	*	*			trans	-73.8	152.7	-174.8	42.4	0	0	0	0	113.2
524	S	30.6	Very low	33.6	Very low	121 Å²	121	149.6 Å²	149.6	85%	0.846	82%	0.823	S	S	*	*			trans	-67.5	140	174.8	62	0	0	0	0	113
525	A	33.9	Very low	33.4	Very low	103 Å²	103	147.1 Å²	147.1	85%	0.851	81%	0.813	S	S	*	*			trans	-141.9	111.9	151.1	0	0	0	0	0	109
526	C	26.8	Very low	33.2	Very low	123 Å²	123	144.4 Å²	144.4	83%	0.831	81%	0.807	S	S	*	*			trans	-82.5	134.1	176.6	177.1	0	0	0	0	110
527	M	34	Very low	33.2	Very low	184 Å²	184	144 Å²	144	91%	0.906	81%	0.807	S	S	*	*			trans	-154.3	135.3	141.1	-79.3	-139.1	97.3	0	0	110.7
528	S	29.5	Very low	33.1	Very low	96 Å²	96	143.4 Å²	143.4	67%	0.671	81%	0.807	S	S	*	*			trans	-79.8	154	177.3	64.8	0	0	0	0	112.9
529	R	33.8	Very low	32.9	Very low	247 Å²	247	143 Å²	143	93%	0.932	82%	0.815	S	S	*	*				-165.6	163.6	120.9	-105.7	163.3	-169	-149.9	2.4	113.6
530	R	31	Very low	32.7	Very low	235 Å²	235	142.1 Å²	142.1	89%	0.887	82%	0.817	S	S	*	*			trans	-82.9	164.2	-162.4	-86.2	-179.9	179.4	174.1	-0.6	114.5
531	P	33.3	Very low	32.3	Very low	112 Å²	112	148.2 Å²	148.2	73%	0.727	82%	0.824	S	S	*	*			trans	-84.6	158.9	-175.5	35.7	-37.1	0	0	0	113.3
532	H	34.8	Very low	32.3	Very low	191 Å²	191	149.8 Å²	149.8	88%	0.884	82%	0.823	S	S	*	*			trans	-139.4	151.9	158.8	-87.1	-69.8	0	0	0	111.7
533	Q	29.7	Very low	32.1	Very low	173 Å²	173	151.3 Å²	151.3	81%	0.808	82%	0.824	S	S	*	*			trans	-89.2	-177.1	-173.8	-63.3	167.3	-47.2	0	0	112.2
534	T	31.9	Very low	31.8	Very low	128 Å²	128	149.2 Å²	149.2	79%	0.785	82%	0.815	S	S	*	*			trans	77.1	146	160.2	66	0	0	0	0	118
535	T	28.4	Very low	32	Very low	107 Å²	107	151.6 Å²	151.6	66%	0.656	82%	0.818	S	S	*	*			cis	-170.3	138.9	-16.8	-92	0	0	0	0	108.8
536	I	31.8	Very low	31.8	Very low	148 Å²	148	151.9 Å²	151.9	76%	0.759	81%	0.813	S	S	*	*			trans	45.6	120.7	157	-61.6	164.8	0	0	0	117.9
537	S	33	Very low	32.1	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	81%	0.81	S	S	*	*				-171.6	137.8	92.8	29.4	0	0	0	0	116.1
538	Q	33.1	Very low	31.9	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	81%	0.805	S	S	*	*			trans	-8.7	137.7	156.6	-61.5	166.5	-17.1	0	0	120.9
539	A	34.8	Very low	32	Very low	107 Å²	107	149.5 Å²	149.5	88%	0.884	81%	0.81	S	S	*	*				-152.3	127.2	123.6	0	0	0	0	0	110.1
540	A	30.9	Very low	32.2	Very low	94 Å²	94	143.3 Å²	143.3	78%	0.777	80%	0.801	S	S	*	*			trans	-96.6	151.2	-176.5	0	0	0	0	0	112.6
541	R	33.7	Very low	32.3	Very low	251 Å²	251	141.1 Å²	141.1	95%	0.947	80%	0.801	S	S	*	*			trans	-137.9	135.6	144.7	-76.5	-163.8	-179.9	168.2	2.9	110.8
542	I	29.5	Very low	32.1	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	80%	0.804	S	S	*	*			trans	-97.2	130.3	-177.1	-63.4	158	0	0	0	107.9
543	I	36.1	Very low	32.1	Very low	171 Å²	171	138.9 Å²	138.9	88%	0.877	80%	0.801	S	S	*	*			trans	-136.7	127.7	141.7	-60.5	-174.2	0	0	0	106.5
544	S	28	Very low	32	Very low	92 Å²	92	139.1 Å²	139.1	64%	0.643	80%	0.802	S	S	*	*			trans	-96.4	134.4	179.8	49.7	0	0	0	0	110.7
545	D	33.6	Very low	32	Very low	171 Å²	171	139.1 Å²	139.1	91%	0.914	80%	0.802	S	S	*	*			trans	-158.3	136	146.7	-101	-30.3	0	0	0	110.4
546	S	30.3	Very low	32	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	81%	0.805	S	S	*	*			trans	-150.9	140.9	175	61.9	0	0	0	0	107.9
547	P	33.5	Very low	32	Very low	118 Å²	118	140.4 Å²	140.4	77%	0.766	80%	0.802	S	S	*	*				-150.7	168.9	113.7	37.5	-20.9	0	0	0	116.9
548	C	28.3	Very low	32	Very low	118 Å²	118	144.5 Å²	144.5	80%	0.797	81%	0.805	S	S	*	*			trans	75.1	110.5	157.1	-64.2	0	0	0	0	120.8
549	P	32.9	Very low	32	Very low	118 Å²	118	143 Å²	143	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79	156	146.8	35.6	-31.3	0	0	0	110.8
550	P	36.8	Very low	31.9	Very low	116 Å²	116	144 Å²	144	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-76.1	159.3	178.5	32	-34.8	0	0	0	113.1
551	E	34.3	Very low	31.9	Very low	189 Å²	189	146.7 Å²	146.7	88%	0.883	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.5	144.5	-162.6	-66.8	149.5	139.8	0	0	115.9
552	A	28.2	Very low	32.1	Very low	96 Å²	96	140.4 Å²	140.4	79%	0.793	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-81	130.4	164.5	0	0	0	0	0	109.4
553	I	35.3	Very low	32.1	Very low	161 Å²	161	141.1 Å²	141.1	83%	0.826	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.2	122.2	173.3	-64.5	175.1	0	0	0	108.6
554	E	28.3	Very low	31.9	Very low	177 Å²	177	138.5 Å²	138.5	83%	0.827	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.9	177	-61.5	176.1	149.9	0	0	111.4
555	V	31.3	Very low	31.9	Very low	129 Å²	129	140.3 Å²	140.3	78%	0.782	80%	0.797	S	S	*	*			trans	-133.7	54.2	161.8	-165.2	0	0	0	0	108	D557	V555-D557 PolarHBondContact O-N 3.17Å
556	E	28.6	Very low	31.7	Very low	153 Å²	153	141 Å²	141	72%	0.715	80%	0.797	S	S	*	*			trans	-80.2	74.7	165.2	-83.3	-81.3	146.8	0	0	108.5	H561	E556-H561 IonicContact OE1-CE1 2.71Å
557	D	30.9	Very low	31.6	Very low	129 Å²	129	144.2 Å²	144.2	69%	0.69	80%	0.802	S	S	*	*	S	Bend	trans	-164.6	135.6	157.5	-109.3	-29.6	0	0	0	107.4	V555	V555-D557 PolarHBondContact O-N 3.17Å
558	F	32.8	Very low	31.3	Very low	197 Å²	197	146 Å²	146	86%	0.864	81%	0.805	S	S	*	*	S	Bend	trans	66	74.2	-169.7	-48.2	-84.3	0	0	0	116.4
559	L	32.9	Very low	31.4	Very low	161 Å²	161	148.1 Å²	148.1	84%	0.843	81%	0.808	S	S	*	*			trans	176.7	130.5	131.9	-95.9	162.9	0	0	0	111.5
560	P	33.8	Very low	31.2	Very low	126 Å²	126	146.5 Å²	146.5	82%	0.818	80%	0.804	S	S	*	*			trans	-73.5	136.6	176	-14.8	30	0	0	0	112.8
561	H	31.8	Very low	31	Very low	152 Å²	152	148.9 Å²	148.9	70%	0.704	81%	0.81	S	S	*	*			trans	-66.7	130.4	179.4	-49.2	-58.2	0	0	0	113.6	E556	E556-H561 IonicContact OE1-CE1 2.71Å
562	S	37.3	Very low	30.9	Very low	119 Å²	119	144.5 Å²	144.5	83%	0.832	79%	0.792	S	S	*	*				174.6	125.4	118.5	40.1	0	0	0	0	111.3
563	L	29.9	Very low	31.1	Very low	162 Å²	162	144.8 Å²	144.8	85%	0.848	79%	0.786	S	S	*	*			trans	-117.6	148.5	167.4	-99.9	155.8	0	0	0	107.4
564	P	31	Very low	31.3	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	78%	0.784	S	S	*	*				-131	138.6	118	8.6	12.2	0	0	0	113.4
565	T	28.9	Very low	31.8	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	78%	0.775	S	S	*	*			trans	-4.9	125.6	148.7	-26.7	0	0	0	0	116.9
566	M	29.6	Very low	32.2	Very low	186 Å²	186	141.4 Å²	141.4	92%	0.916	77%	0.77	S	S	*	*			trans	-156.8	141.8	137.7	-91.6	-109.7	-81	0	0	110.2
567	M	27.3	Very low	32.6	Very low	174 Å²	174	141.5 Å²	141.5	86%	0.857	78%	0.776	S	S	*	*			trans	-74.4	169	161.7	-75	169.3	158.8	0	0	109.6
568	D	27.6	Very low	33.2	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	78%	0.775	S	S	*	*			trans	71.4	151.9	171.8	-74.7	-30	0	0	0	118.7
569	L	29.3	Very low	33.4	Very low	163 Å²	163	141.4 Å²	141.4	85%	0.853	77%	0.774	S	S	*	*			trans	76.9	104.4	162.1	-66.2	152.5	0	0	0	118.8
570	A	29.8	Very low	33.3	Very low	85 Å²	85	141 Å²	141	70%	0.702	77%	0.772	S	S	*	*				70.7	136.5	121.9	0	0	0	0	0	120.2	N572	A570-N572 PolarHBondContact O-N 2.69Å
571	L	31.3	Very low	33.5	Very low	165 Å²	165	144.4 Å²	144.4	86%	0.864	78%	0.777	S	S	*	*	S	Bend	trans	-37.6	105.2	149.4	-70.2	133.5	0	0	0	111
572	N	32.7	Very low	33.6	Very low	97 Å²	97	143.1 Å²	143.1	52%	0.519	78%	0.78	S	S	.	*			trans	153.1	94	145	-79.5	-38	0	0	0	113.5	A570	A570-N572 PolarHBondContact O-N 2.69Å
573	P	31.8	Very low	33.3	Very low	103 Å²	103	145.8 Å²	145.8	67%	0.669	78%	0.779	S	S	*	*	S	Bend	trans	-111.1	-21.1	145.5	-7.4	27	0	0	0	113.4	L575	P573-L575 PolarHBondContact O-N 2.81Å
574	V	41	Very low	33.5	Very low	128 Å²	128	144.3 Å²	144.3	78%	0.776	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-25.8	-170.9	-177.2	0	0	0	0	113
575	L	38.5	Very low	33.8	Very low	120 Å²	120	147.2 Å²	147.2	63%	0.628	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-10.5	-179	-79.9	170.3	0	0	0	115.2	P573	P573-L575 PolarHBondContact O-N 2.81Å
576	Q	39.3	Very low	33.9	Very low	147 Å²	147	147 Å²	147	69%	0.687	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-88.9	-21.2	-175.2	-72.4	-170.7	-5.5	0	0	114.6	I578	Q576-I578 PolarHBondContact O-N 3.38Å; Q576-I578 VanDerWaalsContact O-N 3.15Å
577	N	37.2	Very low	34.1	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-75.8	4.4	-179.9	-84.1	-11.8	0	0	0	115.2
578	I	42.4	Very low	34.6	Very low	133 Å²	133	138.4 Å²	138.4	68%	0.682	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-93.8	-12.4	-177.9	-63.3	175.1	0	0	0	112.4	Q576	Q576-I578 PolarHBondContact O-N 3.38Å; Q576-I578 VanDerWaalsContact O-N 3.15Å
579	K	38.5	Very low	35.2	Very low	190 Å²	190	139.7 Å²	139.7	83%	0.826	77%	0.768	S	S	*	*	S	Bend	trans	-92.6	-6.5	-173.1	-82.2	-173.2	173.6	-179.9	0	117.1
580	N	31.1	Very low	36.6	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	77%	0.765	S	S	*	*			trans	-124.8	67.4	-173.5	-73.6	-14.6	0	0	0	113.4
581	Q	37.9	Very low	38.2	Very low	199 Å²	199	144.2 Å²	144.2	93%	0.93	77%	0.77	S	S	*	*			trans	-132.1	131.9	151	-73.7	-165.6	-4	0	0	110.4
582	T	33.3	Very low	40	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	74%	0.743	S	S	*	*			trans	-92.2	142.4	-166	44.6	0	0	0	0	112.8
583	H	31.6	Very low	42.3	Very low	175 Å²	175	137.2 Å²	137.2	81%	0.81	74%	0.742	S	S	*	*			trans	42.7	96.5	151.7	-69.7	-89	0	0	0	118.1
584	D	33.3	Very low	44.6	Very low	131 Å²	131	139.6 Å²	139.6	70%	0.701	74%	0.744	S	S	*	*				-177.8	146.5	106.6	-112.4	3	0	0	0	114.2
585	K	37.1	Very low	46.5	Very low	178 Å²	178	136.3 Å²	136.3	77%	0.774	73%	0.73	S	S	*	*			trans	62.7	120.9	156.2	-66.7	165.2	-172.2	160.3	0	120	G587	K585-G587 PolarHBondContact O-N 3.43Å
586	S	30.8	Very low	48.4	Very low	126 Å²	126	134.5 Å²	134.5	88%	0.881	72%	0.719	S	S	*	*			trans	-25.1	115.8	161.4	53.6	0	0	0	0	116.7
587	G	35	Very low	50.5	Low	66 Å²	66	131.3 Å²	131.3	68%	0.68	71%	0.706	S	S	*	*			trans	-165	145.3	167.4	0	0	0	0	0	109.3	K585 L589	K585-G587 PolarHBondContact O-N 3.43Å; G587-L589 PolarHBondContact O-N 2.87Å
588	S	37.2	Very low	52.6	Low	112 Å²	112	127.2 Å²	127.2	78%	0.783	68%	0.683	S	S	*	*			trans	-59.2	128.2	-176.7	50.7	0	0	0	0	112	H590	S588-H590 PolarHBondContact O-N 2.91Å
589	L	39.8	Very low	54.4	Low	182 Å²	182	126.5 Å²	126.5	95%	0.953	68%	0.68	S	S	*	*			trans	-63.5	97.4	168.5	-82.6	134.6	0	0	0	109.5	G587	G587-L589 PolarHBondContact O-N 2.87Å
590	H	60	Low	56.4	Low	172 Å²	172	124.3 Å²	124.3	80%	0.796	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-82.3	117.3	170.2	-147.3	-63.1	0	0	0	107.9	S588	S588-H590 PolarHBondContact O-N 2.91Å
591	E	62.8	Low	59	Low	171 Å²	171	122.2 Å²	122.2	80%	0.799	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.8	169.1	-164.4	166	-159.9	0	0	108.2	S593	E591-S593 PolarHBondContact O-N 2.86Å
592	P	69.2	Low	61.1	Low	47 Å²	47	120.3 Å²	120.3	31%	0.305	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-67.4	129.1	-176.8	26.6	-33.3	0	0	0	108.6	L597	P592-L597 HydrophobicContact CB-CD2 4.41Å; P592-L597 HydrophobicContact CB-CG 4.42Å; P592-L597 HydrophobicContact CG-CD2 3.98Å; P592-L597 HydrophobicContact CG-CG 4.23Å
593	S	80.4	Confident	63.3	Low	69 Å²	69	121.7 Å²	121.7	48%	0.483	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-56.3	149.8	176.9	68.2	0	0	0	0	111.1	E591 A595 E596 L597	E591-S593 PolarHBondContact O-N 2.86Å; S593-A595 PolarHBondContact O-N 2.9Å; S593-A595 VanDerWaalsContact O-N 3.13Å; S593-E596 WeakPolarHBondContact O-CA 3.45Å; S593-E596 WeakPolarHBondContact O-CB 3.27Å; S593-E596 PolarHBondContact O-N 2.86Å; S593-E596 PolarHBondContact OG-N 3.47Å; S593-L597 PolarHBondContact O-N 3.17Å; S593-L597 VanDerWaalsContact O-N 3.17Å
594	E	80.7	Confident	66	Low	152 Å²	152	117.8 Å²	117.8	71%	0.71	63%	0.625	S	S	*	*	H	α-helix	trans	-51.7	-38.5	176.9	-171.4	-174.3	159.9	0	0	111.9	E596 L597 L598	E594-E596 VanDerWaalsContact C-N 3.3Å; E594-E596 PolarHBondContact O-N 2.92Å; E594-L597 PolarHBondContact O-N 3.36Å; E594-L598 HydrophobicContact CG-CD1 4.18Å; E594-L598 HydrophobicContact CG-CG 4.5Å; E594-L598 WeakPolarHBondContact O-CB 3.37Å; E594-L598 WeakPolarHBondContact O-CG 3.3Å; E594-L598 PolarHBondContact O-N 2.92Å
595	A	80.5	Confident	68.8	Low	60 Å²	60	116.7 Å²	116.7	50%	0.496	62%	0.615	S	S	.	*	H	α-helix	trans	-59.5	-36.6	174.9	0	0	0	0	0	113.4	S593 L599	S593-A595 PolarHBondContact O-N 2.9Å; S593-A595 VanDerWaalsContact O-N 3.13Å; A595-L599 WeakPolarHBondContact O-CB 3.15Å; A595-L599 WeakPolarHBondContact O-CG 3.48Å; A595-L599 PolarHBondContact O-N 3.08Å
596	E	79.4	Confident	71.1	Confident	81 Å²	81	111.7 Å²	111.7	38%	0.379	60%	0.597	S	S	.	*	H	α-helix	trans	-74.2	-37.6	177.6	-156.6	-167.1	153.7	0	0	111.8	S593 E594 L599 R600	S593-E596 WeakPolarHBondContact O-CA 3.45Å; S593-E596 WeakPolarHBondContact O-CB 3.27Å; S593-E596 PolarHBondContact O-N 2.86Å; S593-E596 PolarHBondContact OG-N 3.47Å; E594-E596 VanDerWaalsContact C-N 3.3Å; E594-E596 PolarHBondContact O-N 2.92Å; E596-L599 PolarHBondContact O-N 3.36Å; E596-R600 WeakPolarHBondContact O-CG 3.28Å; E596-R600 PolarHBondContact O-N 2.91Å; E596-R600 IonicContact OE1-CZ 3.4Å; E596-R600 IonicContact OE1-NE 3.4Å; E596-R600 PolarHBondContact OE1-NE 3.42Å; E596-R600 IonicContact OE1-NH2 3.95Å; E596-R600 PolarHBondContact OE1-NH2 3.21Å
597	L	81.8	Confident	73.9	Confident	80 Å²	80	109.8 Å²	109.8	42%	0.419	58%	0.581	S	S	.	*	H	α-helix	trans	-63	-46.6	172.4	-67.1	173.6	0	0	0	111	P592 S593 E594 L599 R600 I601	P592-L597 HydrophobicContact CB-CD2 4.41Å; P592-L597 HydrophobicContact CB-CG 4.42Å; P592-L597 HydrophobicContact CG-CD2 3.98Å; P592-L597 HydrophobicContact CG-CG 4.23Å; S593-L597 PolarHBondContact O-N 3.17Å; S593-L597 VanDerWaalsContact O-N 3.17Å; E594-L597 PolarHBondContact O-N 3.36Å; L597-L599 VanDerWaalsContact C-N 3.32Å; L597-L599 PolarHBondContact O-N 2.91Å; L597-R600 PolarHBondContact O-N 2.89Å; L597-I601 WeakPolarHBondContact O-CG1 3.3Å; L597-I601 PolarHBondContact O-N 3.14Å
598	L	81.4	Confident	76.5	Confident	70 Å²	70	112.9 Å²	112.9	37%	0.366	58%	0.576	S	S	.	*	H	α-helix	trans	-61.1	-37.7	175	-71.4	171.7	0	0	0	112.3	E594 I601 R602	E594-L598 HydrophobicContact CG-CD1 4.18Å; E594-L598 HydrophobicContact CG-CG 4.5Å; E594-L598 WeakPolarHBondContact O-CB 3.37Å; E594-L598 WeakPolarHBondContact O-CG 3.3Å; E594-L598 PolarHBondContact O-N 2.92Å; L598-I601 PolarHBondContact O-N 2.91Å; L598-R602 WeakPolarHBondContact O-CB 3.49Å; L598-R602 VanDerWaalsContact O-CG 3.29Å; L598-R602 WeakPolarHBondContact O-CG 3.19Å; L598-R602 PolarHBondContact O-N 2.98Å
599	L	80.7	Confident	78.9	Confident	118 Å²	118	111.1 Å²	111.1	62%	0.618	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-43	173.2	-87.7	163.9	0	0	0	112.4	A595 E596 L597 I601 R602 K603	A595-L599 WeakPolarHBondContact O-CB 3.15Å; A595-L599 WeakPolarHBondContact O-CG 3.48Å; A595-L599 PolarHBondContact O-N 3.08Å; E596-L599 PolarHBondContact O-N 3.36Å; L597-L599 VanDerWaalsContact C-N 3.32Å; L597-L599 PolarHBondContact O-N 2.91Å; L599-I601 VanDerWaalsContact C-N 3.32Å; L599-I601 PolarHBondContact O-N 3.29Å; L599-R602 PolarHBondContact O-N 2.86Å; L599-K603 WeakPolarHBondContact O-CB 3.43Å; L599-K603 PolarHBondContact O-N 3.36Å
600	R	80.9	Confident	81.2	Confident	145 Å²	145	109.6 Å²	109.6	55%	0.547	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-37	176.2	-70.3	173.9	-170.9	-169.5	4.2	112	E596 L597 P604	E596-R600 WeakPolarHBondContact O-CG 3.28Å; E596-R600 PolarHBondContact O-N 2.91Å; E596-R600 IonicContact OE1-CZ 3.4Å; E596-R600 IonicContact OE1-NE 3.4Å; E596-R600 PolarHBondContact OE1-NE 3.42Å; E596-R600 IonicContact OE1-NH2 3.95Å; E596-R600 PolarHBondContact OE1-NH2 3.21Å; L597-R600 PolarHBondContact O-N 2.89Å; R600-P604 WeakPolarHBondContact O-CD 3.41Å
601	I	84.5	Confident	82.7	Confident	107 Å²	107	106 Å²	106	55%	0.549	54%	0.536	S	S	.	.	H	α-helix	trans	-70.7	-41.6	175.1	-65.5	164.5	0	0	0	111.3	L597 L598 L599 P604 H605	L597-I601 WeakPolarHBondContact O-CG1 3.3Å; L597-I601 PolarHBondContact O-N 3.14Å; L598-I601 PolarHBondContact O-N 2.91Å; L599-I601 VanDerWaalsContact C-N 3.32Å; L599-I601 PolarHBondContact O-N 3.29Å; I601-P604 WeakPolarHBondContact O-CD 3.39Å; I601-P604 WeakPolarHBondContact O-CG 3.37Å; I601-H605 PolarHBondContact O-CD2 2.87Å; I601-H605 VanDerWaalsContact O-CD2 3.25Å
602	R	82.1	Confident	84	Confident	160 Å²	160	101.5 Å²	101.5	60%	0.604	52%	0.516	S	S	*	.	H	α-helix	trans	-70.5	-39.8	-177.9	-76.6	176.9	-176.8	178.1	4.2	113.9	L598 L599 H605 D606	L598-R602 WeakPolarHBondContact O-CB 3.49Å; L598-R602 VanDerWaalsContact O-CG 3.29Å; L598-R602 WeakPolarHBondContact O-CG 3.19Å; L598-R602 PolarHBondContact O-N 2.98Å; L599-R602 PolarHBondContact O-N 2.86Å; R602-H605 WeakPolarHBondContact O-CA 3.33Å; R602-H605 WeakPolarHBondContact O-CB 3.37Å; R602-H605 PolarHBondContact O-N 3.49Å; R602-D606 PolarHBondContact O-N 3.22Å
603	K	81.1	Confident	85	Confident	154 Å²	154	102.6 Å²	102.6	67%	0.67	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-48.6	-46	-173.7	-166.5	176.2	-176.3	-179.5	0	115.6	L599 H605 D606	L599-K603 WeakPolarHBondContact O-CB 3.43Å; L599-K603 PolarHBondContact O-N 3.36Å; K603-H605 PolarHBondContact O-N 2.96Å; K603-D606 WeakPolarHBondContact O-CB 3.46Å; K603-D606 PolarHBondContact O-N 3.07Å
604	P	88.2	Confident	85.5	Confident	93 Å²	93	102.8 Å²	102.8	60%	0.604	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-64.8	-21.2	175.3	25.4	-35.9	0	0	0	114.1	R600 I601	R600-P604 WeakPolarHBondContact O-CD 3.41Å; I601-P604 WeakPolarHBondContact O-CD 3.39Å; I601-P604 WeakPolarHBondContact O-CG 3.37Å
605	H	90.6	Very high	86.1	Confident	107 Å²	107	98.7 Å²	98.7	50%	0.495	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-91.7	-4.5	178.1	-57.9	-65.1	0	0	0	113.8	I601 R602 K603 P607 F608 V609	I601-H605 PolarHBondContact O-CD2 2.87Å; I601-H605 VanDerWaalsContact O-CD2 3.25Å; R602-H605 WeakPolarHBondContact O-CA 3.33Å; R602-H605 WeakPolarHBondContact O-CB 3.37Å; R602-H605 PolarHBondContact O-N 3.49Å; K603-H605 PolarHBondContact O-N 2.96Å; H605-P607 VanDerWaalsContact C-CD 3.41Å; H605-P607 VanDerWaalsContact C-N 3.33Å; H605-F608 WeakPolarHBondContact O-CB 3.37Å; H605-F608 PolarHBondContact O-N 3.13Å; H605-V609 HydrophobicContact CB-CG2 4.4Å; H605-V609 WeakPolarHBondContact O-CG2 3.45Å; H605-V609 PolarHBondContact O-N 3.04Å
606	D	85.1	Confident	86.5	Confident	74 Å²	74	100.3 Å²	100.3	40%	0.396	51%	0.507	S	S	.	.	H	α-helix	trans	-49.9	-41	-179.2	-76.3	-13.6	0	0	0	114.4	R602 K603 K610	R602-D606 PolarHBondContact O-N 3.22Å; K603-D606 WeakPolarHBondContact O-CB 3.46Å; K603-D606 PolarHBondContact O-N 3.07Å; D606-K610 WeakPolarHBondContact O-CB 3.39Å; D606-K610 VanDerWaalsContact O-CG 3.3Å; D606-K610 WeakPolarHBondContact O-CG 3.43Å; D606-K610 PolarHBondContact O-N 3.43Å
607	P	89.6	Confident	87.1	Confident	85 Å²	85	103.6 Å²	103.6	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-64.1	-43.2	176.1	-21.6	34.3	0	0	0	112.6	H605 K610 V611	H605-P607 VanDerWaalsContact C-CD 3.41Å; H605-P607 VanDerWaalsContact C-N 3.33Å; P607-K610 PolarHBondContact O-N 2.99Å; P607-V611 WeakPolarHBondContact O-CG2 3.29Å; P607-V611 PolarHBondContact O-N 2.65Å
608	F	89.8	Confident	87.6	Confident	131 Å²	131	100.3 Å²	100.3	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-64.8	-44.9	177.5	175.3	-98	0	0	0	111.3	H605 K610 V611 M612	H605-F608 WeakPolarHBondContact O-CB 3.37Å; H605-F608 PolarHBondContact O-N 3.13Å; F608-K610 VanDerWaalsContact C-N 3.3Å; F608-K610 PolarHBondContact O-N 3.17Å; F608-V611 PolarHBondContact O-N 3.49Å; F608-M612 HydrophobicContact CD1-CG 4.2Å; F608-M612 HydrophobicContact CD2-CG 4.33Å; F608-M612 HydrophobicContact CE1-CG 3.76Å; F608-M612 HydrophobicContact CE2-CG 3.9Å; F608-M612 HydrophobicContact CE2-SD 4.25Å; F608-M612 HydrophobicContact CG-CG 4.47Å; F608-M612 HydrophobicContact CZ-CG 3.6Å; F608-M612 HydrophobicContact CZ-SD 4.13Å; F608-M612 WeakPolarHBondContact O-CG 3.19Å; F608-M612 PolarHBondContact O-N 2.56Å
609	V	88.1	Confident	88.1	Confident	75 Å²	75	99.2 Å²	99.2	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-39.5	176.5	174.6	0	0	0	0	111.1	H605 S613	H605-V609 HydrophobicContact CB-CG2 4.4Å; H605-V609 WeakPolarHBondContact O-CG2 3.45Å; H605-V609 PolarHBondContact O-N 3.04Å; V609-S613 VanDerWaalsContact O-CB 3.22Å; V609-S613 WeakPolarHBondContact O-CB 3.43Å; V609-S613 PolarHBondContact O-N 2.69Å; V609-S613 PolarHBondContact O-OG 3.31Å
610	K	88.9	Confident	88.6	Confident	151 Å²	151	96.3 Å²	96.3	66%	0.657	49%	0.49	S	S	*	.	H	α-helix	trans	-63.3	-46.2	174.5	-76.2	171.6	-178.1	175.9	0	112.6	D606 P607 F608 S613 S614	D606-K610 WeakPolarHBondContact O-CB 3.39Å; D606-K610 VanDerWaalsContact O-CG 3.3Å; D606-K610 WeakPolarHBondContact O-CG 3.43Å; D606-K610 PolarHBondContact O-N 3.43Å; P607-K610 PolarHBondContact O-N 2.99Å; F608-K610 VanDerWaalsContact C-N 3.3Å; F608-K610 PolarHBondContact O-N 3.17Å; K610-S613 PolarHBondContact O-N 3.31Å; K610-S614 WeakPolarHBondContact O-CB 3.33Å; K610-S614 PolarHBondContact O-N 3.23Å
611	V	90.5	Very high	89	Confident	96 Å²	96	92.4 Å²	92.4	58%	0.582	48%	0.482	S	S	*	.	H	α-helix	trans	-60.5	-49.6	176.8	171.4	0	0	0	0	110.8	P607 F608 S613 S614 R615	P607-V611 WeakPolarHBondContact O-CG2 3.29Å; P607-V611 PolarHBondContact O-N 2.65Å; F608-V611 PolarHBondContact O-N 3.49Å; V611-S613 PolarHBondContact O-N 2.99Å; V611-S614 WeakPolarHBondContact O-CB 3.46Å; V611-S614 PolarHBondContact O-N 3.06Å; V611-R615 PolarHBondContact O-N 3.35Å
612	M	91.3	Very high	89.3	Confident	77 Å²	77	87.5 Å²	87.5	38%	0.379	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-40.4	179	-68.3	-58.6	-68.8	0	0	112.3	F608 S614 R615 V616	F608-M612 HydrophobicContact CD1-CG 4.2Å; F608-M612 HydrophobicContact CD2-CG 4.33Å; F608-M612 HydrophobicContact CE1-CG 3.76Å; F608-M612 HydrophobicContact CE2-CG 3.9Å; F608-M612 HydrophobicContact CE2-SD 4.25Å; F608-M612 HydrophobicContact CG-CG 4.47Å; F608-M612 HydrophobicContact CZ-CG 3.6Å; F608-M612 HydrophobicContact CZ-SD 4.13Å; F608-M612 WeakPolarHBondContact O-CG 3.19Å; F608-M612 PolarHBondContact O-N 2.56Å; M612-S614 VanDerWaalsContact C-N 3.34Å; M612-S614 PolarHBondContact O-N 3.04Å; M612-R615 PolarHBondContact O-N 2.76Å; M612-V616 WeakPolarHBondContact O-CB 3.46Å; M612-V616 VanDerWaalsContact O-CG2 3.32Å; M612-V616 WeakPolarHBondContact O-CG2 3.41Å; M612-V616 PolarHBondContact O-N 2.98Å
613	S	89.4	Confident	89.6	Confident	69 Å²	69	89.8 Å²	89.8	48%	0.483	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-39.1	175.9	-59.3	0	0	0	0	112.1	V609 K610 V611 K617	V609-S613 VanDerWaalsContact O-CB 3.22Å; V609-S613 WeakPolarHBondContact O-CB 3.43Å; V609-S613 PolarHBondContact O-N 2.69Å; V609-S613 PolarHBondContact O-OG 3.31Å; K610-S613 PolarHBondContact O-N 3.31Å; V611-S613 PolarHBondContact O-N 2.99Å; S613-K617 WeakPolarHBondContact O-CB 3.44Å; S613-K617 PolarHBondContact O-N 3.18Å
614	S	90.6	Very high	89.9	Confident	74 Å²	74	88.6 Å²	88.6	52%	0.517	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-46.4	174.2	-167.5	0	0	0	0	111.5	K610 V611 M612 K617 G618	K610-S614 WeakPolarHBondContact O-CB 3.33Å; K610-S614 PolarHBondContact O-N 3.23Å; V611-S614 WeakPolarHBondContact O-CB 3.46Å; V611-S614 PolarHBondContact O-N 3.06Å; M612-S614 VanDerWaalsContact C-N 3.34Å; M612-S614 PolarHBondContact O-N 3.04Å; S614-K617 WeakPolarHBondContact O-CB 3.49Å; S614-K617 PolarHBondContact O-N 2.93Å; S614-G618 PolarHBondContact O-N 3.11Å
615	R	92.9	Very high	89.8	Confident	66 Å²	66	87.4 Å²	87.4	25%	0.249	46%	0.458	C	S	.	.	H	α-helix	trans	-61.5	-44.6	177.9	-167.6	175.4	-177.9	167	1.8	112	V611 M612 K617 G618 L619 A645 I646 D649	V611-R615 PolarHBondContact O-N 3.35Å; M612-R615 PolarHBondContact O-N 2.76Å; R615-K617 PolarHBondContact O-N 3.22Å; R615-G618 PolarHBondContact O-N 3.34Å; R615-L619 HydrophobicContact CG-CD1 4.21Å; R615-L619 WeakPolarHBondContact O-CB 3.46Å; R615-L619 WeakPolarHBondContact O-CG 3.28Å; R615-L619 PolarHBondContact O-N 3.09Å; R615-A645 PolarHBondContact NH2-O 3.18Å; R615-I646 HydrophobicContact CG-CG1 4.04Å; R615-D649 IonicContact CZ-OD1 3.21Å; R615-D649 IonicContact CZ-OD2 3.42Å; R615-D649 IonicContact NE-OD1 2.76Å; R615-D649 IonicContact NE-OD2 2.86Å; R615-D649 PolarHBondContact NE-OD2 2.83Å; R615-D649 IonicContact NH2-OD1 2.65Å; R615-D649 PolarHBondContact NH2-OD1 2.82Å; R615-D649 IonicContact NH2-OD2 3.08Å; R615-D649 PolarHBondContact NH2-OD2 2.97Å
616	V	90.9	Very high	89.6	Confident	93 Å²	93	85.5 Å²	85.5	56%	0.564	45%	0.447	S	S	*	.	H	α-helix	trans	-60.4	-42.6	173.9	169.3	0	0	0	0	111.4	M612 L619 S620	M612-V616 WeakPolarHBondContact O-CB 3.46Å; M612-V616 VanDerWaalsContact O-CG2 3.32Å; M612-V616 WeakPolarHBondContact O-CG2 3.41Å; M612-V616 PolarHBondContact O-N 2.98Å; V616-L619 PolarHBondContact O-N 2.97Å; V616-S620 WeakPolarHBondContact O-CB 3.35Å; V616-S620 PolarHBondContact O-N 2.88Å; V616-S620 PolarHBondContact O-OG 3.07Å
617	K	91	Very high	89.4	Confident	151 Å²	151	83.9 Å²	83.9	66%	0.657	44%	0.441	S	S	*	.	H	α-helix	trans	-62.5	-44.8	176.4	-174	-179.3	178.6	-176.8	0	111.9	S613 S614 R615 S620 T621	S613-K617 WeakPolarHBondContact O-CB 3.44Å; S613-K617 PolarHBondContact O-N 3.18Å; S614-K617 WeakPolarHBondContact O-CB 3.49Å; S614-K617 PolarHBondContact O-N 2.93Å; R615-K617 PolarHBondContact O-N 3.22Å; K617-S620 PolarHBondContact O-N 3.04Å; K617-S620 PolarHBondContact O-OG 3.13Å; K617-T621 PolarHBondContact O-N 3.36Å; K617-T621 VanDerWaalsContact O-N 3.12Å; K617-T621 PolarHBondContact O-OG1 3.26Å
618	G	91.2	Very high	88.7	Confident	10 Å²	10	84.6 Å²	84.6	10%	0.103	45%	0.446	C	S	.	.	H	α-helix	trans	-62	-50.1	175.5	0	0	0	0	0	112.5	S614 R615 S620 T621 V622	S614-G618 PolarHBondContact O-N 3.11Å; R615-G618 PolarHBondContact O-N 3.34Å; G618-S620 VanDerWaalsContact C-N 3.3Å; G618-S620 PolarHBondContact O-N 3.18Å; G618-T621 WeakPolarHBondContact O-CA 3.46Å; G618-T621 VanDerWaalsContact O-CB 3.31Å; G618-T621 WeakPolarHBondContact O-CB 3.3Å; G618-T621 PolarHBondContact O-N 3.3Å; G618-V622 PolarHBondContact O-N 3.3Å
619	L	92.7	Very high	88	Confident	48 Å²	48	86.1 Å²	86.1	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-59.4	-37.3	175	-70.8	169.7	0	0	0	113	R615 V616 T621 V622 R623 I646 D649 V650	R615-L619 HydrophobicContact CG-CD1 4.21Å; R615-L619 WeakPolarHBondContact O-CB 3.46Å; R615-L619 WeakPolarHBondContact O-CG 3.28Å; R615-L619 PolarHBondContact O-N 3.09Å; V616-L619 PolarHBondContact O-N 2.97Å; L619-T621 VanDerWaalsContact C-N 3.27Å; L619-T621 PolarHBondContact O-N 3.38Å; L619-V622 PolarHBondContact O-N 3.45Å; L619-R623 WeakPolarHBondContact O-CB 3.4Å; L619-R623 PolarHBondContact O-N 3.11Å; L619-I646 HydrophobicContact CD2-CG2 3.99Å; L619-I646 HydrophobicContact CG-CG2 4.44Å; L619-D649 HydrophobicContact CD1-CB 4.48Å; L619-D649 HydrophobicContact CD2-CB 3.89Å; L619-V650 HydrophobicContact CD2-CG2 4.07Å
620	S	91.1	Very high	87.5	Confident	57 Å²	57	84.2 Å²	84.2	40%	0.399	45%	0.45	S	S	.	.	H	α-helix	trans	-63.2	-35.5	174.6	77.1	0	0	0	0	112	V616 K617 G618 R623 V624	V616-S620 WeakPolarHBondContact O-CB 3.35Å; V616-S620 PolarHBondContact O-N 2.88Å; V616-S620 PolarHBondContact O-OG 3.07Å; K617-S620 PolarHBondContact O-N 3.04Å; K617-S620 PolarHBondContact O-OG 3.13Å; G618-S620 VanDerWaalsContact C-N 3.3Å; G618-S620 PolarHBondContact O-N 3.18Å; S620-R623 PolarHBondContact O-N 2.83Å; S620-V624 WeakPolarHBondContact O-CG2 3.46Å; S620-V624 PolarHBondContact O-N 2.91Å; S620-V624 VanDerWaalsContact O-N 3.09Å
621	T	89.8	Confident	87.4	Confident	63 Å²	63	77.4 Å²	77.4	39%	0.387	42%	0.421	S	S	.	.	H	α-helix	trans	-69.5	-43.1	176.4	-54.2	0	0	0	0	110.8	K617 G618 L619 R623 V624 M625 M641	K617-T621 PolarHBondContact O-N 3.36Å; K617-T621 VanDerWaalsContact O-N 3.12Å; K617-T621 PolarHBondContact O-OG1 3.26Å; G618-T621 WeakPolarHBondContact O-CA 3.46Å; G618-T621 VanDerWaalsContact O-CB 3.31Å; G618-T621 WeakPolarHBondContact O-CB 3.3Å; G618-T621 PolarHBondContact O-N 3.3Å; L619-T621 VanDerWaalsContact C-N 3.27Å; L619-T621 PolarHBondContact O-N 3.38Å; T621-R623 VanDerWaalsContact C-N 3.35Å; T621-R623 PolarHBondContact O-N 3.35Å; T621-V624 PolarHBondContact O-N 3.04Å; T621-M625 HydrophobicContact CG2-CE 3.88Å; T621-M625 VanDerWaalsContact O-CE 3.3Å; T621-M625 WeakPolarHBondContact O-CE 3.28Å; T621-M641 HydrophobicContact CG2-CE 3.63Å
622	V	90.6	Very high	87.4	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.024	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-44	172.1	179.6	0	0	0	0	111.1	G618 L619 V624 M625 W626 A634 A638 M641 I646 V650	G618-V622 PolarHBondContact O-N 3.3Å; L619-V622 PolarHBondContact O-N 3.45Å; V622-V624 VanDerWaalsContact C-N 3.32Å; V622-V624 PolarHBondContact O-N 3.22Å; V622-M625 CarbonylContact O-C 3.54Å; V622-M625 PolarHBondContact O-N 3.32Å; V622-M625 VanDerWaalsContact O-N 3.07Å; V622-W626 HydrophobicContact CG1-CE3 4.45Å; V622-W626 PolarHBondContact O-N 3.25Å; V622-W626 VanDerWaalsContact O-N 3.12Å; V622-A634 HydrophobicContact CG1-CB 4.13Å; V622-A638 HydrophobicContact CG1-CB 4.45Å; V622-A638 HydrophobicContact CG2-CB 3.78Å; V622-M641 HydrophobicContact CG2-CE 3.65Å; V622-M641 HydrophobicContact CG2-SD 4.01Å; V622-I646 HydrophobicContact CG2-CG2 4.19Å; V622-V650 HydrophobicContact CG1-CG2 3.89Å
623	R	89.1	Confident	87.2	Confident	207 Å²	207	75.4 Å²	75.4	78%	0.781	41%	0.408	S	S	*	.	H	α-helix	trans	-60	-38.2	179.6	-177.6	-178	177	-171.2	0	112.7	L619 S620 T621 M625 W626	L619-R623 WeakPolarHBondContact O-CB 3.4Å; L619-R623 PolarHBondContact O-N 3.11Å; S620-R623 PolarHBondContact O-N 2.83Å; T621-R623 VanDerWaalsContact C-N 3.35Å; T621-R623 PolarHBondContact O-N 3.35Å; R623-M625 PolarHBondContact O-N 3.06Å; R623-W626 WeakPolarHBondContact O-CB 3.25Å; R623-W626 PolarHBondContact O-N 3.45Å; R623-W626 VanDerWaalsContact O-N 3.16Å
624	V	87.5	Confident	87.3	Confident	130 Å²	130	72.1 Å²	72.1	79%	0.788	39%	0.385	S	S	*	.	H	α-helix	trans	-64.1	-30.8	176.3	168.8	0	0	0	0	112	S620 T621 V622	S620-V624 WeakPolarHBondContact O-CG2 3.46Å; S620-V624 PolarHBondContact O-N 2.91Å; S620-V624 VanDerWaalsContact O-N 3.09Å; T621-V624 PolarHBondContact O-N 3.04Å; V622-V624 VanDerWaalsContact C-N 3.32Å; V622-V624 PolarHBondContact O-N 3.22Å
625	M	85.1	Confident	87.4	Confident	67 Å²	67	68.6 Å²	68.6	33%	0.33	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.9	176.4	-69.8	179	-76.7	0	0	113.7	T621 V622 R623 S627 S630 A634 S637	T621-M625 HydrophobicContact CG2-CE 3.88Å; T621-M625 VanDerWaalsContact O-CE 3.3Å; T621-M625 WeakPolarHBondContact O-CE 3.28Å; V622-M625 CarbonylContact O-C 3.54Å; V622-M625 PolarHBondContact O-N 3.32Å; V622-M625 VanDerWaalsContact O-N 3.07Å; R623-M625 PolarHBondContact O-N 3.06Å; M625-S627 PolarHBondContact O-N 3.3Å; M625-S627 VanDerWaalsContact O-N 3.11Å; M625-S630 PolarHBondContact O-OG 3.22Å; M625-A634 HydrophobicContact CB-CB 4.32Å; M625-S637 VanDerWaalsContact CE-OG 3.3Å; M625-S637 WeakPolarHBondContact CE-OG 3.33Å; M625-S637 PolarHBondContact SD-OG 3.21Å
626	W	86.9	Confident	87.3	Confident	67 Å²	67	68.2 Å²	68.2	25%	0.254	36%	0.361	S	S	.	.			trans	-79.4	93.7	-179.4	-164.8	-79.5	0	0	0	111.5	V622 R623 V631 A634 V635 V650 L654 Y660	V622-W626 HydrophobicContact CG1-CE3 4.45Å; V622-W626 PolarHBondContact O-N 3.25Å; V622-W626 VanDerWaalsContact O-N 3.12Å; R623-W626 WeakPolarHBondContact O-CB 3.25Å; R623-W626 PolarHBondContact O-N 3.45Å; R623-W626 VanDerWaalsContact O-N 3.16Å; W626-V631 HydrophobicContact CH2-CG1 3.66Å; W626-V631 HydrophobicContact CZ2-CG1 3.82Å; W626-V631 HydrophobicContact CZ2-CG2 4.39Å; W626-V631 HydrophobicContact CZ3-CG1 4.06Å; W626-A634 HydrophobicContact CB-CB 4.41Å; W626-A634 HydrophobicContact CD2-CB 4.41Å; W626-A634 HydrophobicContact CE3-CB 3.67Å; W626-A634 HydrophobicContact CZ3-CB 4.33Å; W626-V635 HydrophobicContact CZ3-CG2 4.45Å; W626-V650 HydrophobicContact CZ3-CG1 3.92Å; W626-L654 HydrophobicContact CH2-CD2 3.63Å; W626-L654 HydrophobicContact CH2-CG 3.9Å; W626-L654 HydrophobicContact CZ2-CD2 4.19Å; W626-Y660 AromaticContact CZ2-CD2 3.98Å; W626-Y660 HydrophobicContact CZ2-CD2 3.98Å; W626-Y660 AromaticContact CZ2-CE2 4Å; W626-Y660 HydrophobicContact CZ2-CE2 4Å
627	S	81	Confident	87.3	Confident	40 Å²	40	65.1 Å²	65.1	28%	0.28	34%	0.343	S	S	.	.			trans	-111.8	152.4	168.3	85.9	0	0	0	0	111.2	M625 D629 S630 V631	M625-S627 PolarHBondContact O-N 3.3Å; M625-S627 VanDerWaalsContact O-N 3.11Å; S627-D629 PolarHBondContact O-N 2.92Å; S627-S630 PolarHBondContact O-N 2.79Å; S627-S630 VanDerWaalsContact OG-CB 3.25Å; S627-S630 WeakPolarHBondContact OG-CB 3.23Å; S627-S630 PolarHBondContact OG-N 2.9Å; S627-S630 PolarHBondContact OG-OG 3.02Å; S627-V631 VanDerWaalsContact O-CG2 3.32Å; S627-V631 WeakPolarHBondContact O-CG2 3.06Å; S627-V631 PolarHBondContact O-N 3.05Å
628	P	74	Confident	87.3	Confident	101 Å²	101	57.9 Å²	57.9	66%	0.656	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.1	176.3	-24.7	34.8	0	0	0	113.2
629	D	75	Confident	87.3	Confident	163 Å²	163	59.1 Å²	59.1	87%	0.872	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-16.7	-177.3	-58.4	-47.4	0	0	0	113.2	S627	S627-D629 PolarHBondContact O-N 2.92Å
630	S	77.7	Confident	87.2	Confident	35 Å²	35	64.6 Å²	64.6	25%	0.245	34%	0.342	C	S	.	.			trans	-128.5	27.4	-173.1	84.4	0	0	0	0	114.7	M625 S627 K632 T633 A634	M625-S630 PolarHBondContact O-OG 3.22Å; S627-S630 PolarHBondContact O-N 2.79Å; S627-S630 VanDerWaalsContact OG-CB 3.25Å; S627-S630 WeakPolarHBondContact OG-CB 3.23Å; S627-S630 PolarHBondContact OG-N 2.9Å; S627-S630 PolarHBondContact OG-OG 3.02Å; S630-K632 PolarHBondContact O-N 3.22Å; S630-T633 WeakPolarHBondContact CB-OG1 2.89Å; S630-T633 PolarHBondContact O-N 3.01Å; S630-T633 PolarHBondContact O-OG1 2.89Å; S630-T633 PolarHBondContact OG-OG1 2.71Å; S630-A634 PolarHBondContact O-N 3.48Å
631	V	88.3	Confident	87.1	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.048	34%	0.337	C	S	.	.	H	α-helix	trans	-49.4	-37.1	179.4	-178.7	0	0	0	0	112.8	W626 S627 T633 A634 V635 L654 Y660 L665	W626-V631 HydrophobicContact CH2-CG1 3.66Å; W626-V631 HydrophobicContact CZ2-CG1 3.82Å; W626-V631 HydrophobicContact CZ2-CG2 4.39Å; W626-V631 HydrophobicContact CZ3-CG1 4.06Å; S627-V631 VanDerWaalsContact O-CG2 3.32Å; S627-V631 WeakPolarHBondContact O-CG2 3.06Å; S627-V631 PolarHBondContact O-N 3.05Å; V631-T633 VanDerWaalsContact C-N 3.32Å; V631-T633 PolarHBondContact O-N 3.02Å; V631-A634 PolarHBondContact O-N 3.42Å; V631-V635 HydrophobicContact CG1-CG2 4.35Å; V631-V635 WeakPolarHBondContact O-CG2 3.35Å; V631-V635 PolarHBondContact O-N 2.74Å; V631-V635 VanDerWaalsContact O-N 3.08Å; V631-L654 HydrophobicContact CG1-CD2 3.89Å; V631-Y660 HydrophobicContact CG2-CD1 3.68Å; V631-Y660 HydrophobicContact CG2-CE1 4.32Å; V631-Y660 HydrophobicContact CG2-CG 4.03Å; V631-L665 HydrophobicContact CG1-CD2 4.43Å
632	K	88.5	Confident	87.1	Confident	72 Å²	72	69.1 Å²	69.1	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-55	-42.1	174.1	-173	174.1	-176.5	-81.8	0	113	S630 V635 E636 D664 L665	S630-K632 PolarHBondContact O-N 3.22Å; K632-V635 PolarHBondContact O-N 2.74Å; K632-E636 HydrophobicContact CG-CG 4.46Å; K632-E636 IonicContact NZ-OE1 2.66Å; K632-E636 PolarHBondContact NZ-OE1 2.8Å; K632-E636 WeakPolarHBondContact O-CB 3.39Å; K632-E636 VanDerWaalsContact O-CG 3.28Å; K632-E636 WeakPolarHBondContact O-CG 3.34Å; K632-E636 PolarHBondContact O-N 3.29Å; K632-D664 HydrophobicContact CD-CB 4.27Å; K632-L665 HydrophobicContact CB-CD1 4.4Å
633	T	89.1	Confident	87.1	Confident	59 Å²	59	71.6 Å²	71.6	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-71.2	-31.7	-179.2	67.8	0	0	0	0	112.4	S630 V631 E636 S637	S630-T633 WeakPolarHBondContact CB-OG1 2.89Å; S630-T633 PolarHBondContact O-N 3.01Å; S630-T633 PolarHBondContact O-OG1 2.89Å; S630-T633 PolarHBondContact OG-OG1 2.71Å; V631-T633 VanDerWaalsContact C-N 3.32Å; V631-T633 PolarHBondContact O-N 3.02Å; T633-E636 WeakPolarHBondContact CA-OE2 3.24Å; T633-S637 WeakPolarHBondContact O-CB 3.47Å; T633-S637 PolarHBondContact O-N 2.91Å; T633-S637 PolarHBondContact O-OG 3.18Å
634	A	91	Very high	87.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.7	-41	173.3	0	0	0	0	0	111.4	V622 M625 W626 S630 V631 S637 A638	V622-A634 HydrophobicContact CG1-CB 4.13Å; M625-A634 HydrophobicContact CB-CB 4.32Å; W626-A634 HydrophobicContact CB-CB 4.41Å; W626-A634 HydrophobicContact CD2-CB 4.41Å; W626-A634 HydrophobicContact CE3-CB 3.67Å; W626-A634 HydrophobicContact CZ3-CB 4.33Å; S630-A634 PolarHBondContact O-N 3.48Å; V631-A634 PolarHBondContact O-N 3.42Å; A634-S637 WeakPolarHBondContact O-CB 3.21Å; A634-S637 PolarHBondContact O-N 3.29Å; A634-A638 PolarHBondContact O-N 2.81Å
635	V	91.9	Very high	87.3	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-69.6	-42.8	176.5	176.5	0	0	0	0	111.8	W626 V631 K632 S637 A638 L639 V650 L654 L665 F668 L669	W626-V635 HydrophobicContact CZ3-CG2 4.45Å; V631-V635 HydrophobicContact CG1-CG2 4.35Å; V631-V635 WeakPolarHBondContact O-CG2 3.35Å; V631-V635 PolarHBondContact O-N 2.74Å; V631-V635 VanDerWaalsContact O-N 3.08Å; K632-V635 PolarHBondContact O-N 2.74Å; V635-S637 PolarHBondContact O-N 2.81Å; V635-A638 WeakPolarHBondContact O-CB 3.49Å; V635-A638 PolarHBondContact O-N 3.36Å; V635-L639 HydrophobicContact CG1-CD1 4.39Å; V635-L639 PolarHBondContact O-N 2.99Å; V635-V650 HydrophobicContact CG2-CG1 4.13Å; V635-L654 HydrophobicContact CG2-CD1 3.75Å; V635-L665 HydrophobicContact CB-CD1 4.21Å; V635-L665 HydrophobicContact CG1-CD1 4.25Å; V635-L665 HydrophobicContact CG2-CD1 4.15Å; V635-F668 HydrophobicContact CG1-CD1 4.49Å; V635-F668 HydrophobicContact CG1-CE1 4.18Å; V635-L669 HydrophobicContact CG1-CD1 4.39Å; V635-L669 HydrophobicContact CG1-CD2 3.53Å; V635-L669 HydrophobicContact CG1-CG 4.13Å
636	E	90.5	Very high	87.7	Confident	58 Å²	58	57.1 Å²	57.1	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-54.1	-44.3	169.3	-77.9	166.4	170.1	0	0	110.8	K632 T633 L639 M640 F668	K632-E636 HydrophobicContact CG-CG 4.46Å; K632-E636 IonicContact NZ-OE1 2.66Å; K632-E636 PolarHBondContact NZ-OE1 2.8Å; K632-E636 WeakPolarHBondContact O-CB 3.39Å; K632-E636 VanDerWaalsContact O-CG 3.28Å; K632-E636 WeakPolarHBondContact O-CG 3.34Å; K632-E636 PolarHBondContact O-N 3.29Å; T633-E636 WeakPolarHBondContact CA-OE2 3.24Å; E636-L639 WeakPolarHBondContact O-CB 3.44Å; E636-L639 PolarHBondContact O-N 2.86Å; E636-M640 VanDerWaalsContact O-CG 3.29Å; E636-M640 WeakPolarHBondContact O-CG 3.49Å; E636-M640 PolarHBondContact O-N 3.42Å; E636-F668 HydrophobicContact CB-CE1 4.29Å; E636-F668 HydrophobicContact CB-CZ 4.18Å; E636-F668 HydrophobicContact CG-CD1 4.25Å; E636-F668 HydrophobicContact CG-CE1 3.44Å; E636-F668 VanDerWaalsContact CG-CE1 3.44Å; E636-F668 HydrophobicContact CG-CE2 4.04Å; E636-F668 HydrophobicContact CG-CZ 3.33Å
637	S	90.6	Very high	88	Confident	27 Å²	27	54.4 Å²	54.4	19%	0.189	30%	0.302	C	S	.	.	H	α-helix	trans	-67.5	-36.2	178.7	-59.8	0	0	0	0	113.2	M625 T633 A634 V635 L639 M640 M641	M625-S637 VanDerWaalsContact CE-OG 3.3Å; M625-S637 WeakPolarHBondContact CE-OG 3.33Å; M625-S637 PolarHBondContact SD-OG 3.21Å; T633-S637 WeakPolarHBondContact O-CB 3.47Å; T633-S637 PolarHBondContact O-N 2.91Å; T633-S637 PolarHBondContact O-OG 3.18Å; A634-S637 WeakPolarHBondContact O-CB 3.21Å; A634-S637 PolarHBondContact O-N 3.29Å; V635-S637 PolarHBondContact O-N 2.81Å; S637-L639 VanDerWaalsContact C-N 3.32Å; S637-M640 PolarHBondContact O-N 3.4Å; S637-M641 WeakPolarHBondContact O-CG 3.41Å; S637-M641 PolarHBondContact O-N 3.27Å
638	A	91.6	Very high	88.6	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-38.7	173.2	0	0	0	0	0	111.7	V622 A634 V635 M641 I646 V650	V622-A638 HydrophobicContact CG1-CB 4.45Å; V622-A638 HydrophobicContact CG2-CB 3.78Å; A634-A638 PolarHBondContact O-N 2.81Å; V635-A638 WeakPolarHBondContact O-CB 3.49Å; V635-A638 PolarHBondContact O-N 3.36Å; A638-M641 PolarHBondContact O-N 3.41Å; A638-I646 HydrophobicContact CB-CG2 4.38Å; A638-V650 HydrophobicContact CB-CG2 4.15Å
639	L	91.1	Very high	89.4	Confident	35 Å²	35	50.4 Å²	50.4	18%	0.183	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-42.9	173.6	-76.2	158.4	0	0	0	112.2	V635 E636 S637 M641 N642 L647 F668 Q672	V635-L639 HydrophobicContact CG1-CD1 4.39Å; V635-L639 PolarHBondContact O-N 2.99Å; E636-L639 WeakPolarHBondContact O-CB 3.44Å; E636-L639 PolarHBondContact O-N 2.86Å; S637-L639 VanDerWaalsContact C-N 3.32Å; L639-M641 PolarHBondContact O-N 2.81Å; L639-M641 VanDerWaalsContact O-N 3.16Å; L639-N642 PolarHBondContact O-N 2.87Å; L639-L647 HydrophobicContact CD2-CD1 3.94Å; L639-L647 HydrophobicContact CD2-CD2 3.55Å; L639-L647 HydrophobicContact CD2-CG 4.36Å; L639-L647 HydrophobicContact CG-CD1 3.92Å; L639-L647 HydrophobicContact CG-CD2 4.44Å; L639-F668 HydrophobicContact CD1-CD1 4.39Å; L639-F668 HydrophobicContact CD1-CE1 3.36Å; L639-F668 HydrophobicContact CD1-CE2 4.46Å; L639-F668 HydrophobicContact CD1-CZ 3.38Å; L639-Q672 HydrophobicContact CD1-CG 4.05Å; L639-Q672 HydrophobicContact CD2-CB 4.31Å; L639-Q672 HydrophobicContact CD2-CG 3.71Å
640	M	91	Very high	90.3	Very high	163 Å²	163	42.8 Å²	42.8	80%	0.803	23%	0.232	S	C	*	.	H	α-helix	trans	-63.8	-17.2	177.6	-71	-61.2	-60.8	0	0	114	E636 S637 N642	E636-M640 VanDerWaalsContact O-CG 3.29Å; E636-M640 WeakPolarHBondContact O-CG 3.49Å; E636-M640 PolarHBondContact O-N 3.42Å; S637-M640 PolarHBondContact O-N 3.4Å; M640-N642 PolarHBondContact O-N 2.88Å
641	M	89.1	Confident	91	Very high	60 Å²	60	41.2 Å²	41.2	30%	0.296	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-13.4	171.6	-68.8	172.7	-161.4	0	0	113.3	T621 V622 S637 A638 L639 D643 I646	T621-M641 HydrophobicContact CG2-CE 3.63Å; V622-M641 HydrophobicContact CG2-CE 3.65Å; V622-M641 HydrophobicContact CG2-SD 4.01Å; S637-M641 WeakPolarHBondContact O-CG 3.41Å; S637-M641 PolarHBondContact O-N 3.27Å; A638-M641 PolarHBondContact O-N 3.41Å; L639-M641 PolarHBondContact O-N 2.81Å; L639-M641 VanDerWaalsContact O-N 3.16Å; M641-D643 PolarHBondContact O-N 2.84Å; M641-I646 HydrophobicContact SD-CD1 4.2Å; M641-I646 HydrophobicContact SD-CG2 4.25Å
642	N	89.1	Confident	91.1	Very high	155 Å²	155	41.7 Å²	41.7	83%	0.829	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	30.6	-179	-160.5	32.6	0	0	0	114.2	L639 M640	L639-N642 PolarHBondContact O-N 2.87Å; M640-N642 PolarHBondContact O-N 2.88Å
643	D	90.2	Very high	91.2	Very high	56 Å²	56	43 Å²	43	30%	0.299	24%	0.237	S	C	.	.			trans	-116.9	106.7	176	-176.4	-13.2	0	0	0	109.7	M641 A645 I646 L647	M641-D643 PolarHBondContact O-N 2.84Å; D643-A645 PolarHBondContact O-N 3.44Å; D643-A645 VanDerWaalsContact OD1-CB 3.3Å; D643-A645 WeakPolarHBondContact OD1-CB 3.19Å; D643-A645 PolarHBondContact OD1-N 2.59Å; D643-I646 HydrophobicContact CB-CB 4.24Å; D643-I646 HydrophobicContact CB-CD1 3.88Å; D643-I646 HydrophobicContact CB-CG1 4.12Å; D643-I646 PolarHBondContact O-N 2.87Å; D643-I646 WeakPolarHBondContact OD2-CD1 3.26Å; D643-L647 PolarHBondContact O-N 2.92Å; D643-L647 VanDerWaalsContact O-N 3.14Å
644	T	91.2	Very high	91.2	Very high	75 Å²	75	40.1 Å²	40.1	46%	0.46	22%	0.22	S	C	.	.	H	α-helix	trans	-60.4	-26.8	179.7	62.7	0	0	0	0	113.4	V648	T644-V648 WeakPolarHBondContact O-CB 3.34Å; T644-V648 VanDerWaalsContact O-CG2 3.25Å; T644-V648 WeakPolarHBondContact O-CG2 3.16Å; T644-V648 PolarHBondContact O-N 2.69Å
645	A	90.8	Very high	91.1	Very high	20 Å²	20	41 Å²	41	17%	0.165	23%	0.227	C	C	.	.	H	α-helix	trans	-74.1	-39.6	-179.6	0	0	0	0	0	111.4	R615 D643 V648 D649	R615-A645 PolarHBondContact NH2-O 3.18Å; D643-A645 PolarHBondContact O-N 3.44Å; D643-A645 VanDerWaalsContact OD1-CB 3.3Å; D643-A645 WeakPolarHBondContact OD1-CB 3.19Å; D643-A645 PolarHBondContact OD1-N 2.59Å; A645-V648 PolarHBondContact O-N 2.74Å; A645-D649 PolarHBondContact O-N 2.84Å; A645-D649 VanDerWaalsContact O-N 3.13Å
646	I	93.2	Very high	90.8	Very high	5 Å²	5	50 Å²	50	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-45.2	171.9	-67.6	173.1	0	0	0	110.1	R615 L619 V622 A638 M641 D643 V648 D649 V650	R615-I646 HydrophobicContact CG-CG1 4.04Å; L619-I646 HydrophobicContact CD2-CG2 3.99Å; L619-I646 HydrophobicContact CG-CG2 4.44Å; V622-I646 HydrophobicContact CG2-CG2 4.19Å; A638-I646 HydrophobicContact CB-CG2 4.38Å; M641-I646 HydrophobicContact SD-CD1 4.2Å; M641-I646 HydrophobicContact SD-CG2 4.25Å; D643-I646 HydrophobicContact CB-CB 4.24Å; D643-I646 HydrophobicContact CB-CD1 3.88Å; D643-I646 HydrophobicContact CB-CG1 4.12Å; D643-I646 PolarHBondContact O-N 2.87Å; D643-I646 WeakPolarHBondContact OD2-CD1 3.26Å; I646-V648 VanDerWaalsContact C-N 3.35Å; I646-V648 PolarHBondContact O-N 2.9Å; I646-D649 PolarHBondContact O-N 3.36Å; I646-V650 WeakPolarHBondContact O-CG2 3.29Å; I646-V650 PolarHBondContact O-N 3.24Å; I646-V650 VanDerWaalsContact O-N 3.12Å
647	L	92.9	Very high	90.4	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-45.8	177.3	178.2	61.9	0	0	0	111.9	L639 D643 D649 V650 L651 L676	L639-L647 HydrophobicContact CD2-CD1 3.94Å; L639-L647 HydrophobicContact CD2-CD2 3.55Å; L639-L647 HydrophobicContact CD2-CG 4.36Å; L639-L647 HydrophobicContact CG-CD1 3.92Å; L639-L647 HydrophobicContact CG-CD2 4.44Å; D643-L647 PolarHBondContact O-N 2.92Å; D643-L647 VanDerWaalsContact O-N 3.14Å; L647-D649 PolarHBondContact O-N 2.9Å; L647-V650 PolarHBondContact O-N 3.17Å; L647-L651 HydrophobicContact CD1-CD1 4.24Å; L647-L651 HydrophobicContact CD1-CG 4.26Å; L647-L651 HydrophobicContact CG-CD1 3.98Å; L647-L651 HydrophobicContact CG-CG 4.42Å; L647-L651 WeakPolarHBondContact O-CB 3.37Å; L647-L651 VanDerWaalsContact O-CG 3.29Å; L647-L651 WeakPolarHBondContact O-CG 3.48Å; L647-L651 PolarHBondContact O-N 3.05Å; L647-L676 HydrophobicContact CD2-CD1 3.91Å; L647-L676 HydrophobicContact CG-CD1 4.44Å
648	V	93.2	Very high	89.8	Confident	10 Å²	10	51.4 Å²	51.4	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-65.4	-35.5	-179.7	167.8	0	0	0	0	112.2	T644 A645 I646 L651 G652 L676 H684 T687	T644-V648 WeakPolarHBondContact O-CB 3.34Å; T644-V648 VanDerWaalsContact O-CG2 3.25Å; T644-V648 WeakPolarHBondContact O-CG2 3.16Å; T644-V648 PolarHBondContact O-N 2.69Å; A645-V648 PolarHBondContact O-N 2.74Å; I646-V648 VanDerWaalsContact C-N 3.35Å; I646-V648 PolarHBondContact O-N 2.9Å; V648-L651 PolarHBondContact O-N 3.21Å; V648-G652 PolarHBondContact O-N 2.53Å; V648-L676 HydrophobicContact CG2-CD2 4.05Å; V648-H684 HydrophobicContact CG2-CB 4.25Å; V648-T687 HydrophobicContact CG1-CG2 4.23Å
649	D	92.3	Very high	89.4	Confident	47 Å²	47	59.8 Å²	59.8	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-45.6	172.4	-65.7	-32.2	0	0	0	112	R615 L619 A645 I646 L647 L651 G652 I653	R615-D649 IonicContact CZ-OD1 3.21Å; R615-D649 IonicContact CZ-OD2 3.42Å; R615-D649 IonicContact NE-OD1 2.76Å; R615-D649 IonicContact NE-OD2 2.86Å; R615-D649 PolarHBondContact NE-OD2 2.83Å; R615-D649 IonicContact NH2-OD1 2.65Å; R615-D649 PolarHBondContact NH2-OD1 2.82Å; R615-D649 IonicContact NH2-OD2 3.08Å; R615-D649 PolarHBondContact NH2-OD2 2.97Å; L619-D649 HydrophobicContact CD1-CB 4.48Å; L619-D649 HydrophobicContact CD2-CB 3.89Å; A645-D649 PolarHBondContact O-N 2.84Å; A645-D649 VanDerWaalsContact O-N 3.13Å; I646-D649 PolarHBondContact O-N 3.36Å; L647-D649 PolarHBondContact O-N 2.9Å; D649-L651 VanDerWaalsContact C-N 3.33Å; D649-L651 PolarHBondContact O-N 2.74Å; D649-G652 PolarHBondContact O-N 3.36Å; D649-G652 VanDerWaalsContact O-N 3.16Å; D649-I653 WeakPolarHBondContact O-CG1 3.32Å; D649-I653 PolarHBondContact O-N 2.96Å
650	V	92.3	Very high	89	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.024	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-40.9	179.4	173.8	0	0	0	0	110.7	L619 V622 W626 V635 A638 I646 L647 I653 L654	L619-V650 HydrophobicContact CD2-CG2 4.07Å; V622-V650 HydrophobicContact CG1-CG2 3.89Å; W626-V650 HydrophobicContact CZ3-CG1 3.92Å; V635-V650 HydrophobicContact CG2-CG1 4.13Å; A638-V650 HydrophobicContact CB-CG2 4.15Å; I646-V650 WeakPolarHBondContact O-CG2 3.29Å; I646-V650 PolarHBondContact O-N 3.24Å; I646-V650 VanDerWaalsContact O-N 3.12Å; L647-V650 PolarHBondContact O-N 3.17Å; V650-I653 PolarHBondContact O-N 3.36Å; V650-L654 HydrophobicContact CG1-CD1 4.43Å; V650-L654 WeakPolarHBondContact O-CG 3.31Å; V650-L654 PolarHBondContact O-N 3.03Å
651	L	92.5	Very high	88.8	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-45	171	-70	172.8	0	0	0	111.5	L647 V648 D649 I653 L654 A655 L669 L673 L676 T687 I691	L647-L651 HydrophobicContact CD1-CD1 4.24Å; L647-L651 HydrophobicContact CD1-CG 4.26Å; L647-L651 HydrophobicContact CG-CD1 3.98Å; L647-L651 HydrophobicContact CG-CG 4.42Å; L647-L651 WeakPolarHBondContact O-CB 3.37Å; L647-L651 VanDerWaalsContact O-CG 3.29Å; L647-L651 WeakPolarHBondContact O-CG 3.48Å; L647-L651 PolarHBondContact O-N 3.05Å; V648-L651 PolarHBondContact O-N 3.21Å; D649-L651 VanDerWaalsContact C-N 3.33Å; D649-L651 PolarHBondContact O-N 2.74Å; L651-I653 PolarHBondContact O-N 2.9Å; L651-I653 VanDerWaalsContact O-N 3.16Å; L651-L654 HydrophobicContact CD2-CD1 4.32Å; L651-L654 PolarHBondContact O-N 2.78Å; L651-A655 PolarHBondContact O-N 3.09Å; L651-L669 HydrophobicContact CD2-CD1 3.93Å; L651-L669 HydrophobicContact CD2-CD2 3.91Å; L651-L673 HydrophobicContact CD1-CD2 4Å; L651-L676 HydrophobicContact CD1-CD1 3.63Å; L651-T687 HydrophobicContact CB-CG2 3.87Å; L651-I691 HydrophobicContact CB-CD1 4.06Å; L651-I691 HydrophobicContact CB-CG1 4.08Å; L651-I691 HydrophobicContact CD2-CD1 3.94Å; L651-I691 HydrophobicContact CD2-CG1 4.16Å; L651-I691 WeakPolarHBondContact O-CD1 3.32Å
652	G	91.2	Very high	88.8	Confident	19 Å²	19	55.4 Å²	55.4	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-56.7	-31.4	176	0	0	0	0	0	113.8	V648 D649 K656	V648-G652 PolarHBondContact O-N 2.53Å; D649-G652 PolarHBondContact O-N 3.36Å; D649-G652 VanDerWaalsContact O-N 3.16Å; G652-K656 WeakPolarHBondContact O-CG 3.2Å
653	I	89.7	Confident	88.7	Confident	98 Å²	98	49.4 Å²	49.4	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-75.1	-44.1	172.2	-64.3	165.6	0	0	0	111.3	D649 V650 L651 A655 K656	D649-I653 WeakPolarHBondContact O-CG1 3.32Å; D649-I653 PolarHBondContact O-N 2.96Å; V650-I653 PolarHBondContact O-N 3.36Å; L651-I653 PolarHBondContact O-N 2.9Å; L651-I653 VanDerWaalsContact O-N 3.16Å; I653-A655 VanDerWaalsContact C-N 3.31Å; I653-A655 PolarHBondContact O-N 3.1Å; I653-K656 PolarHBondContact O-N 3.01Å; I653-K656 VanDerWaalsContact O-N 3.17Å
654	L	89.7	Confident	88.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-34.8	177.1	-76.1	168.9	0	0	0	113.5	W626 V631 V635 V650 L651 K656 N657 Y660 W661 L665 L669 I691	W626-L654 HydrophobicContact CH2-CD2 3.63Å; W626-L654 HydrophobicContact CH2-CG 3.9Å; W626-L654 HydrophobicContact CZ2-CD2 4.19Å; V631-L654 HydrophobicContact CG1-CD2 3.89Å; V635-L654 HydrophobicContact CG2-CD1 3.75Å; V650-L654 HydrophobicContact CG1-CD1 4.43Å; V650-L654 WeakPolarHBondContact O-CG 3.31Å; V650-L654 PolarHBondContact O-N 3.03Å; L651-L654 HydrophobicContact CD2-CD1 4.32Å; L651-L654 PolarHBondContact O-N 2.78Å; L654-K656 PolarHBondContact O-N 3.03Å; L654-N657 PolarHBondContact O-N 2.68Å; L654-Y660 HydrophobicContact CD2-CD2 4.44Å; L654-W661 HydrophobicContact CB-CZ2 3.83Å; L654-W661 PolarHBondContact O-NE1 2.87Å; L654-L665 HydrophobicContact CD2-CD2 4.43Å; L654-L669 HydrophobicContact CD1-CD1 4.24Å; L654-I691 HydrophobicContact CB-CD1 4.16Å
655	A	88.8	Confident	88.6	Confident	18 Å²	18	46.3 Å²	46.3	15%	0.149	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-30.6	176.1	0	0	0	0	0	112.4	L651 I653 Q690 I691	L651-A655 PolarHBondContact O-N 3.09Å; I653-A655 VanDerWaalsContact C-N 3.31Å; I653-A655 PolarHBondContact O-N 3.1Å; A655-Q690 HydrophobicContact CB-CB 4.19Å; A655-I691 HydrophobicContact CB-CD1 3.91Å; A655-I691 HydrophobicContact CB-CG1 4.39Å
656	K	85.6	Confident	88.6	Confident	188 Å²	188	45.4 Å²	45.4	82%	0.817	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.5	179.8	-67.1	177.7	-178.9	-175.8	0	114.2	G652 I653 L654	G652-K656 WeakPolarHBondContact O-CG 3.2Å; I653-K656 PolarHBondContact O-N 3.01Å; I653-K656 VanDerWaalsContact O-N 3.17Å; L654-K656 PolarHBondContact O-N 3.03Å
657	N	82.8	Confident	88.5	Confident	50 Å²	50	46.2 Å²	46.2	27%	0.267	24%	0.237	S	C	.	.			trans	-135	97.1	-176.1	-165.5	-21.6	0	0	0	112.2	L654 K659 Y660	L654-N657 PolarHBondContact O-N 2.68Å; N657-K659 PolarHBondContact O-N 3.05Å; N657-K659 VanDerWaalsContact O-N 3.14Å; N657-K659 WeakPolarHBondContact OD1-CB 3.43Å; N657-K659 WeakPolarHBondContact OD1-CG 3.29Å; N657-K659 PolarHBondContact OD1-N 3Å; N657-Y660 HydrophobicContact CB-CD2 3.92Å; N657-Y660 HydrophobicContact CB-CE2 3.91Å; N657-Y660 WeakPolarHBondContact ND2-CE2 3.27Å
658	S	78.4	Confident	88.5	Confident	65 Å²	65	48.6 Å²	48.6	46%	0.455	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-61.2	-20.2	-179.2	55	0	0	0	0	114.4	Y660 W661	S658-Y660 VanDerWaalsContact C-N 3.31Å; S658-Y660 PolarHBondContact O-N 2.9Å; S658-W661 PolarHBondContact O-N 2.77Å
659	K	81.7	Confident	88.4	Confident	177 Å²	177	48.1 Å²	48.1	77%	0.77	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-70	-21.9	-172.1	-60.4	-177.8	179.4	-178.4	0	114.6	N657	N657-K659 PolarHBondContact O-N 3.05Å; N657-K659 VanDerWaalsContact O-N 3.14Å; N657-K659 WeakPolarHBondContact OD1-CB 3.43Å; N657-K659 WeakPolarHBondContact OD1-CG 3.29Å; N657-K659 PolarHBondContact OD1-N 3Å
660	Y	83.5	Confident	88.5	Confident	68 Å²	68	45.9 Å²	45.9	27%	0.267	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-87	-5.5	-176.5	-60.1	-52.4	0	0	0	114.2	W626 V631 L654 N657 S658	W626-Y660 AromaticContact CZ2-CD2 3.98Å; W626-Y660 HydrophobicContact CZ2-CD2 3.98Å; W626-Y660 AromaticContact CZ2-CE2 4Å; W626-Y660 HydrophobicContact CZ2-CE2 4Å; V631-Y660 HydrophobicContact CG2-CD1 3.68Å; V631-Y660 HydrophobicContact CG2-CE1 4.32Å; V631-Y660 HydrophobicContact CG2-CG 4.03Å; L654-Y660 HydrophobicContact CD2-CD2 4.44Å; N657-Y660 HydrophobicContact CB-CD2 3.92Å; N657-Y660 HydrophobicContact CB-CE2 3.91Å; N657-Y660 WeakPolarHBondContact ND2-CE2 3.27Å; S658-Y660 VanDerWaalsContact C-N 3.31Å; S658-Y660 PolarHBondContact O-N 2.9Å
661	W	87	Confident	88.5	Confident	22 Å²	22	47.8 Å²	47.8	8%	0.083	24%	0.244	C	C	.	.			trans	-83	127.7	-173.6	-69.2	85	0	0	0	112.1	L654 S658 L665 V666 L669 I691 V694 I695 F699	L654-W661 HydrophobicContact CB-CZ2 3.83Å; L654-W661 PolarHBondContact O-NE1 2.87Å; S658-W661 PolarHBondContact O-N 2.77Å; W661-L665 HydrophobicContact CE3-CD2 4.34Å; W661-V666 HydrophobicContact CE3-CG2 3.72Å; W661-V666 HydrophobicContact CZ3-CG2 4.16Å; W661-L669 HydrophobicContact CH2-CD1 3.72Å; W661-L669 HydrophobicContact CZ3-CD1 3.85Å; W661-I691 HydrophobicContact CH2-CD1 3.83Å; W661-I691 HydrophobicContact CH2-CG2 3.6Å; W661-I691 HydrophobicContact CZ2-CD1 3.54Å; W661-I691 HydrophobicContact CZ2-CG2 4.2Å; W661-I691 HydrophobicContact CZ3-CG2 4.47Å; W661-V694 HydrophobicContact CD2-CG1 4.39Å; W661-V694 HydrophobicContact CG-CG1 4.34Å; W661-I695 HydrophobicContact CE3-CG1 4.11Å; W661-I695 HydrophobicContact CH2-CD1 4.26Å; W661-I695 HydrophobicContact CH2-CG1 4.22Å; W661-I695 HydrophobicContact CZ3-CD1 3.87Å; W661-I695 HydrophobicContact CZ3-CG1 3.72Å; W661-F699 HydrophobicContact CB-CE2 3.74Å; W661-F699 HydrophobicContact CB-CZ 3.88Å
662	N	88.1	Confident	88.5	Confident	76 Å²	76	50.6 Å²	50.6	41%	0.406	26%	0.257	S	S	.	.			trans	-136.2	166.1	169.8	65.1	33.7	0	0	0	110.1	D664 L665 V666	N662-D664 VanDerWaalsContact C-N 3.25Å; N662-D664 PolarHBondContact O-N 3.41Å; N662-D664 PolarHBondContact OD1-N 3.02Å; N662-L665 PolarHBondContact O-N 3.3Å; N662-L665 VanDerWaalsContact OD1-CB 3.31Å; N662-L665 WeakPolarHBondContact OD1-CB 3.44Å; N662-L665 PolarHBondContact OD1-N 2.79Å; N662-V666 WeakPolarHBondContact O-CG2 3.48Å; N662-V666 PolarHBondContact O-N 3.42Å
663	L	87.7	Confident	88.6	Confident	29 Å²	29	49.7 Å²	49.7	15%	0.152	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-33.2	-174.4	-174.3	64.8	0	0	0	112.6	V666 S667 F699 R722 K725	L663-V666 PolarHBondContact O-N 2.97Å; L663-S667 WeakPolarHBondContact O-CB 3.45Å; L663-S667 PolarHBondContact O-N 3Å; L663-S667 PolarHBondContact O-OG 3.21Å; L663-F699 HydrophobicContact CD1-CD1 4.49Å; L663-R722 HydrophobicContact CD2-CG 3.83Å; L663-K725 HydrophobicContact CD2-CB 4.19Å; L663-K725 HydrophobicContact CG-CB 4.31Å
664	D	88.2	Confident	88.7	Confident	65 Å²	65	46.4 Å²	46.4	35%	0.348	23%	0.232	S	C	.	.	H	α-helix	trans	-65	-45.8	177.6	-60.5	-60.1	0	0	0	111.5	K632 N662 S667 F668 K725	K632-D664 HydrophobicContact CD-CB 4.27Å; N662-D664 VanDerWaalsContact C-N 3.25Å; N662-D664 PolarHBondContact O-N 3.41Å; N662-D664 PolarHBondContact OD1-N 3.02Å; D664-S667 PolarHBondContact O-N 2.63Å; D664-S667 PolarHBondContact O-OG 3.08Å; D664-F668 WeakPolarHBondContact O-CB 3.46Å; D664-F668 PolarHBondContact O-N 2.92Å; D664-K725 WeakPolarHBondContact OD1-CE 3.38Å; D664-K725 IonicContact OD1-NZ 3.19Å; D664-K725 PolarHBondContact OD1-NZ 3.15Å
665	L	90.5	Very high	88.8	Confident	1 Å²	1	53 Å²	53	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-39.8	175.3	-175.7	65.3	0	0	0	111.6	V631 K632 V635 L654 W661 N662 F668 L669	V631-L665 HydrophobicContact CG1-CD2 4.43Å; K632-L665 HydrophobicContact CB-CD1 4.4Å; V635-L665 HydrophobicContact CB-CD1 4.21Å; V635-L665 HydrophobicContact CG1-CD1 4.25Å; V635-L665 HydrophobicContact CG2-CD1 4.15Å; L654-L665 HydrophobicContact CD2-CD2 4.43Å; W661-L665 HydrophobicContact CE3-CD2 4.34Å; N662-L665 PolarHBondContact O-N 3.3Å; N662-L665 VanDerWaalsContact OD1-CB 3.31Å; N662-L665 WeakPolarHBondContact OD1-CB 3.44Å; N662-L665 PolarHBondContact OD1-N 2.79Å; L665-F668 PolarHBondContact O-N 2.93Å; L665-L669 HydrophobicContact CD1-CD1 3.97Å; L665-L669 HydrophobicContact CD1-CG 4.2Å; L665-L669 HydrophobicContact CG-CD1 3.95Å; L665-L669 HydrophobicContact CG-CG 4.48Å; L665-L669 WeakPolarHBondContact O-CB 3.41Å; L665-L669 PolarHBondContact O-N 3.05Å
666	V	92.1	Very high	89	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-48.2	175.7	174.4	0	0	0	0	111.1	W661 N662 L663 F668 L669 L670 I695 F699	W661-V666 HydrophobicContact CE3-CG2 3.72Å; W661-V666 HydrophobicContact CZ3-CG2 4.16Å; N662-V666 WeakPolarHBondContact O-CG2 3.48Å; N662-V666 PolarHBondContact O-N 3.42Å; L663-V666 PolarHBondContact O-N 2.97Å; V666-F668 PolarHBondContact O-N 2.85Å; V666-L669 PolarHBondContact O-N 3.06Å; V666-L670 HydrophobicContact CG1-CD1 3.59Å; V666-L670 HydrophobicContact CG1-CG 4.15Å; V666-L670 WeakPolarHBondContact O-CB 3.29Å; V666-L670 WeakPolarHBondContact O-CG 3.37Å; V666-L670 PolarHBondContact O-N 2.94Å; V666-I695 HydrophobicContact CG1-CD1 4.41Å; V666-I695 HydrophobicContact CG1-CG1 4.49Å; V666-I695 HydrophobicContact CG1-CG2 3.67Å; V666-I695 HydrophobicContact CG2-CG1 4.3Å; V666-I695 HydrophobicContact CG2-CG2 4.46Å; V666-F699 HydrophobicContact CG2-CD1 4.4Å; V666-F699 HydrophobicContact CG2-CD2 3.87Å; V666-F699 HydrophobicContact CG2-CE1 4.27Å; V666-F699 HydrophobicContact CG2-CE2 3.75Å; V666-F699 HydrophobicContact CG2-CG 4.22Å; V666-F699 HydrophobicContact CG2-CZ 3.96Å
667	S	91	Very high	89.3	Confident	23 Å²	23	43.8 Å²	43.8	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-33.1	178.5	67.7	0	0	0	0	112.7	L663 D664 P671	L663-S667 WeakPolarHBondContact O-CB 3.45Å; L663-S667 PolarHBondContact O-N 3Å; L663-S667 PolarHBondContact O-OG 3.21Å; D664-S667 PolarHBondContact O-N 2.63Å; D664-S667 PolarHBondContact O-OG 3.08Å; S667-P671 VanDerWaalsContact O-CD 3.29Å; S667-P671 WeakPolarHBondContact O-CD 3.4Å
668	F	91.4	Very high	89.8	Confident	60 Å²	60	46.4 Å²	46.4	26%	0.263	23%	0.231	S	C	.	.	H	α-helix	trans	-77.7	-37.6	177.8	178.3	-111.8	0	0	0	113.7	V635 E636 L639 D664 L665 V666	V635-F668 HydrophobicContact CG1-CD1 4.49Å; V635-F668 HydrophobicContact CG1-CE1 4.18Å; E636-F668 HydrophobicContact CB-CE1 4.29Å; E636-F668 HydrophobicContact CB-CZ 4.18Å; E636-F668 HydrophobicContact CG-CD1 4.25Å; E636-F668 HydrophobicContact CG-CE1 3.44Å; E636-F668 VanDerWaalsContact CG-CE1 3.44Å; E636-F668 HydrophobicContact CG-CE2 4.04Å; E636-F668 HydrophobicContact CG-CZ 3.33Å; L639-F668 HydrophobicContact CD1-CD1 4.39Å; L639-F668 HydrophobicContact CD1-CE1 3.36Å; L639-F668 HydrophobicContact CD1-CE2 4.46Å; L639-F668 HydrophobicContact CD1-CZ 3.38Å; D664-F668 WeakPolarHBondContact O-CB 3.46Å; D664-F668 PolarHBondContact O-N 2.92Å; L665-F668 PolarHBondContact O-N 2.93Å; V666-F668 PolarHBondContact O-N 2.85Å
669	L	92.6	Very high	90.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-81.3	-35	-177.9	-81.7	178.2	0	0	0	114.1	V635 L651 L654 W661 L665 V666 P671 Q672 L673	V635-L669 HydrophobicContact CG1-CD1 4.39Å; V635-L669 HydrophobicContact CG1-CD2 3.53Å; V635-L669 HydrophobicContact CG1-CG 4.13Å; L651-L669 HydrophobicContact CD2-CD1 3.93Å; L651-L669 HydrophobicContact CD2-CD2 3.91Å; L654-L669 HydrophobicContact CD1-CD1 4.24Å; W661-L669 HydrophobicContact CH2-CD1 3.72Å; W661-L669 HydrophobicContact CZ3-CD1 3.85Å; L665-L669 HydrophobicContact CD1-CD1 3.97Å; L665-L669 HydrophobicContact CD1-CG 4.2Å; L665-L669 HydrophobicContact CG-CD1 3.95Å; L665-L669 HydrophobicContact CG-CG 4.48Å; L665-L669 WeakPolarHBondContact O-CB 3.41Å; L665-L669 PolarHBondContact O-N 3.05Å; V666-L669 PolarHBondContact O-N 3.06Å; L669-P671 VanDerWaalsContact C-CD 3.49Å; L669-Q672 WeakPolarHBondContact O-CB 3.29Å; L669-Q672 PolarHBondContact O-N 3.4Å; L669-L673 HydrophobicContact CB-CD1 4.4Å; L669-L673 WeakPolarHBondContact O-CG 3.43Å; L669-L673 PolarHBondContact O-N 3.34Å; L669-L673 VanDerWaalsContact O-N 3.09Å
670	L	93.1	Very high	90.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-40.4	-174.9	-82.4	170.5	0	0	0	115.1	V666 Q672 L673 V674 I695 C729 H732 L733 I736	V666-L670 HydrophobicContact CG1-CD1 3.59Å; V666-L670 HydrophobicContact CG1-CG 4.15Å; V666-L670 WeakPolarHBondContact O-CB 3.29Å; V666-L670 WeakPolarHBondContact O-CG 3.37Å; V666-L670 PolarHBondContact O-N 2.94Å; L670-Q672 VanDerWaalsContact C-N 3.33Å; L670-Q672 PolarHBondContact O-N 3.28Å; L670-L673 HydrophobicContact CD2-CD1 4.25Å; L670-L673 PolarHBondContact O-N 3.25Å; L670-V674 PolarHBondContact O-N 3.41Å; L670-I695 HydrophobicContact CD2-CD1 3.97Å; L670-I695 HydrophobicContact CG-CD1 4.24Å; L670-C729 HydrophobicContact CD1-CB 3.62Å; L670-H732 HydrophobicContact CB-CB 3.84Å; L670-L733 HydrophobicContact CD1-CD1 4.31Å; L670-L733 HydrophobicContact CD1-CG 4.05Å; L670-L733 HydrophobicContact CD2-CD2 3.8Å; L670-L733 HydrophobicContact CD2-CG 3.98Å; L670-I736 HydrophobicContact CD2-CD1 3.96Å
671	P	92.7	Very high	91.2	Very high	44 Å²	44	45.9 Å²	45.9	29%	0.286	22%	0.222	S	C	.	.	H	α-helix	trans	-56.8	-43.9	172.4	-24.3	32.2	0	0	0	113.1	S667 L669 L673 V674	S667-P671 VanDerWaalsContact O-CD 3.29Å; S667-P671 WeakPolarHBondContact O-CD 3.4Å; L669-P671 VanDerWaalsContact C-CD 3.49Å; P671-L673 VanDerWaalsContact C-N 3.31Å; P671-L673 PolarHBondContact O-N 2.88Å; P671-V674 WeakPolarHBondContact O-CB 3.43Å; P671-V674 PolarHBondContact O-N 3.37Å
672	Q	92.3	Very high	91.4	Very high	59 Å²	59	48.4 Å²	48.4	28%	0.276	24%	0.24	S	C	.	.	H	α-helix	trans	-68.3	-32.1	-178.6	-56.3	-63.4	-39.2	0	0	111.9	L639 L669 L670 V674 E675 L676	L639-Q672 HydrophobicContact CD1-CG 4.05Å; L639-Q672 HydrophobicContact CD2-CB 4.31Å; L639-Q672 HydrophobicContact CD2-CG 3.71Å; L669-Q672 WeakPolarHBondContact O-CB 3.29Å; L669-Q672 PolarHBondContact O-N 3.4Å; L670-Q672 VanDerWaalsContact C-N 3.33Å; L670-Q672 PolarHBondContact O-N 3.28Å; Q672-V674 VanDerWaalsContact C-N 3.33Å; Q672-E675 PolarHBondContact O-N 2.85Å; Q672-L676 WeakPolarHBondContact O-CG 3.24Å; Q672-L676 PolarHBondContact O-N 3.36Å
673	L	93.1	Very high	91.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-70.8	-27.3	176	-63	169.3	0	0	0	112.6	L651 L669 L670 P671 E675 L676 I677 T688 I691 V692 I695 I736	L651-L673 HydrophobicContact CD1-CD2 4Å; L669-L673 HydrophobicContact CB-CD1 4.4Å; L669-L673 WeakPolarHBondContact O-CG 3.43Å; L669-L673 PolarHBondContact O-N 3.34Å; L669-L673 VanDerWaalsContact O-N 3.09Å; L670-L673 HydrophobicContact CD2-CD1 4.25Å; L670-L673 PolarHBondContact O-N 3.25Å; P671-L673 VanDerWaalsContact C-N 3.31Å; P671-L673 PolarHBondContact O-N 2.88Å; L673-E675 VanDerWaalsContact C-N 3.29Å; L673-L676 HydrophobicContact CD2-CD1 4.32Å; L673-I677 WeakPolarHBondContact O-CB 3.4Å; L673-I677 PolarHBondContact O-N 2.92Å; L673-T688 HydrophobicContact CB-CG2 3.99Å; L673-T688 HydrophobicContact CD2-CG2 3.99Å; L673-I691 HydrophobicContact CD1-CB 4.45Å; L673-I691 HydrophobicContact CD1-CG2 3.44Å; L673-I691 VanDerWaalsContact CD1-CG2 3.44Å; L673-I691 HydrophobicContact CD2-CB 4.32Å; L673-I691 HydrophobicContact CD2-CG2 4Å; L673-I691 HydrophobicContact CG-CG2 4.4Å; L673-V692 HydrophobicContact CD1-CG2 4.15Å; L673-I695 HydrophobicContact CD1-CD1 3.94Å; L673-I736 HydrophobicContact CB-CD1 3.99Å
674	V	93.4	Very high	91.7	Very high	28 Å²	28	47.7 Å²	47.7	17%	0.17	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-31.2	172.4	174.8	0	0	0	0	111.4	L670 P671 Q672 I677 H678 H732 T735 I736	L670-V674 PolarHBondContact O-N 3.41Å; P671-V674 WeakPolarHBondContact O-CB 3.43Å; P671-V674 PolarHBondContact O-N 3.37Å; Q672-V674 VanDerWaalsContact C-N 3.33Å; V674-I677 WeakPolarHBondContact O-CG2 3.34Å; V674-H678 PolarHBondContact O-CE1 3.3Å; V674-H678 PolarHBondContact O-ND1 2.78Å; V674-H732 HydrophobicContact CG2-CB 4.18Å; V674-T735 HydrophobicContact CG1-CG2 3.75Å; V674-T735 HydrophobicContact CG2-CG2 4.36Å; V674-I736 HydrophobicContact CG2-CD1 4.18Å; V674-I736 HydrophobicContact CG2-CG1 3.76Å
675	E	91.7	Very high	91.9	Very high	139 Å²	139	44.6 Å²	44.6	65%	0.65	22%	0.222	S	C	*	.	H	α-helix	trans	-78.3	-46.7	173.4	-62.5	-175.4	-175	0	0	111.1	Q672 L673 I677 H678	Q672-E675 PolarHBondContact O-N 2.85Å; L673-E675 VanDerWaalsContact C-N 3.29Å; E675-I677 VanDerWaalsContact C-N 3.34Å; E675-I677 PolarHBondContact O-N 3.27Å; E675-H678 PolarHBondContact O-N 2.82Å
676	L	92.1	Very high	91.9	Very high	12 Å²	12	48.2 Å²	48.2	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-31.9	-178.2	-73.9	169.4	0	0	0	114.3	L647 V648 L651 Q672 L673 H678 S679 T688	L647-L676 HydrophobicContact CD2-CD1 3.91Å; L647-L676 HydrophobicContact CG-CD1 4.44Å; V648-L676 HydrophobicContact CG2-CD2 4.05Å; L651-L676 HydrophobicContact CD1-CD1 3.63Å; Q672-L676 WeakPolarHBondContact O-CG 3.24Å; Q672-L676 PolarHBondContact O-N 3.36Å; L673-L676 HydrophobicContact CD2-CD1 4.32Å; L676-H678 PolarHBondContact O-N 3.12Å; L676-S679 WeakPolarHBondContact O-CB 3.39Å; L676-S679 PolarHBondContact O-N 3.36Å; L676-T688 WeakPolarHBondContact CB-OG1 3.2Å
677	I	92.8	Very high	91.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-24	178.5	-160.7	72.8	0	0	0	112.7	L673 V674 E675 S679 V685 T688 A739 L740 V745	L673-I677 WeakPolarHBondContact O-CB 3.4Å; L673-I677 PolarHBondContact O-N 2.92Å; V674-I677 WeakPolarHBondContact O-CG2 3.34Å; E675-I677 VanDerWaalsContact C-N 3.34Å; E675-I677 PolarHBondContact O-N 3.27Å; I677-S679 VanDerWaalsContact C-N 3.32Å; I677-V685 HydrophobicContact CD1-CG1 3.86Å; I677-V685 WeakPolarHBondContact O-CG2 3.21Å; I677-T688 HydrophobicContact CB-CG2 3.99Å; I677-T688 HydrophobicContact CD1-CG2 3.73Å; I677-T688 HydrophobicContact CG1-CG2 4.43Å; I677-A739 HydrophobicContact CG1-CB 4.47Å; I677-A739 HydrophobicContact CG2-CB 3.79Å; I677-L740 HydrophobicContact CD1-CD2 4.3Å; I677-V745 HydrophobicContact CD1-CG1 4.16Å; I677-V745 HydrophobicContact CG1-CG1 3.72Å
678	H	91.9	Very high	92.1	Very high	104 Å²	104	48 Å²	48	48%	0.481	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.9	177	-63	97.7	0	0	0	113.2	V674 E675 L676	V674-H678 PolarHBondContact O-CE1 3.3Å; V674-H678 PolarHBondContact O-ND1 2.78Å; E675-H678 PolarHBondContact O-N 2.82Å; L676-H678 PolarHBondContact O-N 3.12Å
679	S	91.7	Very high	92.1	Very high	23 Å²	23	45.2 Å²	45.2	16%	0.161	23%	0.225	C	C	.	.			trans	-60.5	151.8	-176.7	-166.2	0	0	0	0	113.3	L676 I677 Y681 H684 K748	L676-S679 WeakPolarHBondContact O-CB 3.39Å; L676-S679 PolarHBondContact O-N 3.36Å; I677-S679 VanDerWaalsContact C-N 3.32Å; S679-Y681 VanDerWaalsContact C-N 3.27Å; S679-Y681 PolarHBondContact OG-N 2.84Å; S679-H684 PolarHBondContact OG-ND1 2.81Å; S679-K748 PolarHBondContact O-NZ 2.87Å
680	K	90.6	Very high	92	Very high	158 Å²	158	49.1 Å²	49.1	69%	0.687	24%	0.243	S	C	*	.	S	Bend	trans	-70.1	-23.8	169.7	67.2	-176.9	-176.9	-179.5	0	112.8
681	Y	91	Very high	92	Very high	119 Å²	119	49.1 Å²	49.1	47%	0.467	24%	0.243	S	C	.	.			trans	-88.3	125	-177.4	-57.4	-71.3	0	0	0	111.7	S679 T683 H684 V685	S679-Y681 VanDerWaalsContact C-N 3.27Å; S679-Y681 PolarHBondContact OG-N 2.84Å; Y681-T683 VanDerWaalsContact C-N 3.34Å; Y681-T683 PolarHBondContact O-N 2.85Å; Y681-H684 AromaticContact CD2-CE1 3.81Å; Y681-H684 PolarHBondContact O-N 3.48Å; Y681-V685 PolarHBondContact O-N 3.06Å
682	T	90.7	Very high	92	Very high	75 Å²	75	47 Å²	47	46%	0.46	23%	0.229	S	C	.	.	H	α-helix	trans	-56.7	-45.5	178.7	47	0	0	0	0	112.3	H684 V685 E686 K748	T682-H684 PolarHBondContact O-N 3.23Å; T682-V685 WeakPolarHBondContact O-CB 3.41Å; T682-V685 PolarHBondContact O-N 2.77Å; T682-E686 WeakPolarHBondContact O-CG 3.33Å; T682-E686 PolarHBondContact O-N 2.83Å; T682-K748 HydrophobicContact CG2-CB 4.3Å; T682-K748 HydrophobicContact CG2-CG 4.18Å
683	T	90	Very high	91.9	Very high	74 Å²	74	48.1 Å²	48.1	45%	0.454	23%	0.231	S	C	.	.	H	α-helix	trans	-58	-33	179.4	52.5	0	0	0	0	113.4	Y681 T687	Y681-T683 VanDerWaalsContact C-N 3.34Å; Y681-T683 PolarHBondContact O-N 2.85Å; T683-T687 VanDerWaalsContact O-CB 3.29Å; T683-T687 WeakPolarHBondContact O-CB 3.45Å; T683-T687 PolarHBondContact O-N 2.97Å; T683-T687 PolarHBondContact O-OG1 2.89Å
684	H	93	Very high	91.8	Very high	15 Å²	15	49.1 Å²	49.1	7%	0.069	24%	0.237	C	C	.	.	H	α-helix	trans	-70.9	-42.1	176.8	-67.3	-152.1	0	0	0	110.5	V648 S679 Y681 T682 T688	V648-H684 HydrophobicContact CG2-CB 4.25Å; S679-H684 PolarHBondContact OG-ND1 2.81Å; Y681-H684 AromaticContact CD2-CE1 3.81Å; Y681-H684 PolarHBondContact O-N 3.48Å; T682-H684 PolarHBondContact O-N 3.23Å; H684-T688 VanDerWaalsContact O-CB 3.32Å; H684-T688 WeakPolarHBondContact O-CB 3.42Å; H684-T688 PolarHBondContact O-N 2.86Å; H684-T688 PolarHBondContact O-OG1 3.01Å
685	V	92.6	Very high	91.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-44.3	176.7	-177	0	0	0	0	111	I677 Y681 T682 T688 C689 V745 K748 A749	I677-V685 HydrophobicContact CD1-CG1 3.86Å; I677-V685 WeakPolarHBondContact O-CG2 3.21Å; Y681-V685 PolarHBondContact O-N 3.06Å; T682-V685 WeakPolarHBondContact O-CB 3.41Å; T682-V685 PolarHBondContact O-N 2.77Å; V685-T688 WeakPolarHBondContact O-CB 3.26Å; V685-T688 PolarHBondContact O-N 2.89Å; V685-C689 PolarHBondContact O-N 2.96Å; V685-C689 PolarHBondContact O-SG 3.38Å; V685-V745 HydrophobicContact CG1-CG1 4.12Å; V685-K748 HydrophobicContact CB-CB 4.11Å; V685-K748 HydrophobicContact CG1-CB 4.05Å; V685-K748 HydrophobicContact CG2-CB 4.06Å; V685-K748 HydrophobicContact CG2-CD 4.01Å; V685-A749 HydrophobicContact CG1-CB 3.89Å
686	E	90.8	Very high	91.7	Very high	78 Å²	78	41.3 Å²	41.3	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-47.2	177	-71	179.2	150.3	0	0	112	T682 T688 C689 Q690	T682-E686 WeakPolarHBondContact O-CG 3.33Å; T682-E686 PolarHBondContact O-N 2.83Å; E686-T688 VanDerWaalsContact C-N 3.3Å; E686-T688 PolarHBondContact O-N 2.99Å; E686-C689 WeakPolarHBondContact O-CB 3.32Å; E686-C689 PolarHBondContact O-N 2.89Å; E686-C689 VanDerWaalsContact O-N 3.13Å; E686-Q690 WeakPolarHBondContact O-CG 3.07Å; E686-Q690 PolarHBondContact O-N 2.85Å
687	T	91.9	Very high	91.5	Very high	18 Å²	18	47.8 Å²	47.8	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-41.2	176.2	-55.5	0	0	0	0	110.8	V648 L651 T683 C689 Q690 I691	V648-T687 HydrophobicContact CG1-CG2 4.23Å; L651-T687 HydrophobicContact CB-CG2 3.87Å; T683-T687 VanDerWaalsContact O-CB 3.29Å; T683-T687 WeakPolarHBondContact O-CB 3.45Å; T683-T687 PolarHBondContact O-N 2.97Å; T683-T687 PolarHBondContact O-OG1 2.89Å; T687-C689 VanDerWaalsContact C-N 3.34Å; T687-C689 PolarHBondContact O-N 2.86Å; T687-Q690 PolarHBondContact O-N 2.78Å; T687-I691 VanDerWaalsContact O-CG1 3.32Å; T687-I691 WeakPolarHBondContact O-CG1 3.27Å; T687-I691 PolarHBondContact O-N 2.79Å
688	T	93.9	Very high	91.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-43.7	174	-59.4	0	0	0	0	111.4	L673 L676 I677 H684 V685 E686 I691 V692	L673-T688 HydrophobicContact CB-CG2 3.99Å; L673-T688 HydrophobicContact CD2-CG2 3.99Å; L676-T688 WeakPolarHBondContact CB-OG1 3.2Å; I677-T688 HydrophobicContact CB-CG2 3.99Å; I677-T688 HydrophobicContact CD1-CG2 3.73Å; I677-T688 HydrophobicContact CG1-CG2 4.43Å; H684-T688 VanDerWaalsContact O-CB 3.32Å; H684-T688 WeakPolarHBondContact O-CB 3.42Å; H684-T688 PolarHBondContact O-N 2.86Å; H684-T688 PolarHBondContact O-OG1 3.01Å; V685-T688 WeakPolarHBondContact O-CB 3.26Å; V685-T688 PolarHBondContact O-N 2.89Å; E686-T688 VanDerWaalsContact C-N 3.3Å; E686-T688 PolarHBondContact O-N 2.99Å; T688-I691 PolarHBondContact O-N 2.92Å; T688-V692 HydrophobicContact CG2-CG2 4.37Å; T688-V692 VanDerWaalsContact O-CG2 3.25Å; T688-V692 WeakPolarHBondContact O-CG2 3.41Å; T688-V692 PolarHBondContact O-N 3.04Å
689	C	92.7	Very high	91.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-42.4	175.3	-66.5	0	0	0	0	112.4	V685 E686 T687 I691 V692 R693 C752 L756	V685-C689 PolarHBondContact O-N 2.96Å; V685-C689 PolarHBondContact O-SG 3.38Å; E686-C689 WeakPolarHBondContact O-CB 3.32Å; E686-C689 PolarHBondContact O-N 2.89Å; E686-C689 VanDerWaalsContact O-N 3.13Å; T687-C689 VanDerWaalsContact C-N 3.34Å; T687-C689 PolarHBondContact O-N 2.86Å; C689-I691 PolarHBondContact O-N 2.81Å; C689-V692 PolarHBondContact O-N 2.95Å; C689-R693 WeakPolarHBondContact O-CB 3.15Å; C689-R693 PolarHBondContact O-N 3.07Å; C689-C752 HydrophobicContact CB-CB 3.85Å; C689-L756 HydrophobicContact CB-CD1 3.72Å; C689-L756 WeakPolarHBondContact O-CD1 3.24Å
690	Q	91.1	Very high	90.9	Very high	82 Å²	82	45.7 Å²	45.7	38%	0.383	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-43.8	176.7	-69.4	173.2	11.1	0	0	111.7	A655 E686 T687 R693 V694	A655-Q690 HydrophobicContact CB-CB 4.19Å; E686-Q690 WeakPolarHBondContact O-CG 3.07Å; E686-Q690 PolarHBondContact O-N 2.85Å; T687-Q690 PolarHBondContact O-N 2.78Å; Q690-R693 WeakPolarHBondContact O-CB 3.37Å; Q690-R693 PolarHBondContact O-N 2.79Å; Q690-V694 WeakPolarHBondContact O-CG2 3.43Å; Q690-V694 PolarHBondContact O-N 3.26Å
691	I	92.8	Very high	90.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-51.6	175.6	-69.4	-73.1	0	0	0	111.4	L651 L654 A655 W661 L673 T687 T688 C689 R693 V694 I695	L651-I691 HydrophobicContact CB-CD1 4.06Å; L651-I691 HydrophobicContact CB-CG1 4.08Å; L651-I691 HydrophobicContact CD2-CD1 3.94Å; L651-I691 HydrophobicContact CD2-CG1 4.16Å; L651-I691 WeakPolarHBondContact O-CD1 3.32Å; L654-I691 HydrophobicContact CB-CD1 4.16Å; A655-I691 HydrophobicContact CB-CD1 3.91Å; A655-I691 HydrophobicContact CB-CG1 4.39Å; W661-I691 HydrophobicContact CH2-CD1 3.83Å; W661-I691 HydrophobicContact CH2-CG2 3.6Å; W661-I691 HydrophobicContact CZ2-CD1 3.54Å; W661-I691 HydrophobicContact CZ2-CG2 4.2Å; W661-I691 HydrophobicContact CZ3-CG2 4.47Å; L673-I691 HydrophobicContact CD1-CB 4.45Å; L673-I691 HydrophobicContact CD1-CG2 3.44Å; L673-I691 VanDerWaalsContact CD1-CG2 3.44Å; L673-I691 HydrophobicContact CD2-CB 4.32Å; L673-I691 HydrophobicContact CD2-CG2 4Å; L673-I691 HydrophobicContact CG-CG2 4.4Å; T687-I691 VanDerWaalsContact O-CG1 3.32Å; T687-I691 WeakPolarHBondContact O-CG1 3.27Å; T687-I691 PolarHBondContact O-N 2.79Å; T688-I691 PolarHBondContact O-N 2.92Å; C689-I691 PolarHBondContact O-N 2.81Å; I691-R693 VanDerWaalsContact C-N 3.25Å; I691-R693 PolarHBondContact O-N 3.09Å; I691-V694 WeakPolarHBondContact O-CB 3.39Å; I691-V694 PolarHBondContact O-N 3.28Å; I691-I695 HydrophobicContact CG2-CD1 3.73Å; I691-I695 HydrophobicContact CG2-CG1 4.33Å; I691-I695 WeakPolarHBondContact O-CG1 3.32Å; I691-I695 PolarHBondContact O-N 3.05Å
692	V	92.9	Very high	90.5	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-32.9	-176.9	179.9	0	0	0	0	110.7	L673 T688 C689 V694 I695 I696 L733 I736 L756 F760	L673-V692 HydrophobicContact CD1-CG2 4.15Å; T688-V692 HydrophobicContact CG2-CG2 4.37Å; T688-V692 VanDerWaalsContact O-CG2 3.25Å; T688-V692 WeakPolarHBondContact O-CG2 3.41Å; T688-V692 PolarHBondContact O-N 3.04Å; C689-V692 PolarHBondContact O-N 2.95Å; V692-V694 PolarHBondContact O-N 2.89Å; V692-I695 PolarHBondContact O-N 3.28Å; V692-I696 HydrophobicContact CG1-CD1 3.9Å; V692-I696 HydrophobicContact CG1-CG1 4.18Å; V692-I696 VanDerWaalsContact O-CG1 3.28Å; V692-I696 WeakPolarHBondContact O-CG1 3.39Å; V692-I696 PolarHBondContact O-N 2.92Å; V692-L733 HydrophobicContact CG1-CD2 3.77Å; V692-I736 HydrophobicContact CG1-CG2 4.42Å; V692-I736 HydrophobicContact CG2-CD1 3.84Å; V692-I736 HydrophobicContact CG2-CG2 4.29Å; V692-L756 HydrophobicContact CB-CD1 4.15Å; V692-L756 HydrophobicContact CB-CD2 4.46Å; V692-L756 HydrophobicContact CG1-CD1 4.42Å; V692-L756 HydrophobicContact CG1-CD2 3.85Å; V692-F760 HydrophobicContact CG1-CZ 4.31Å
693	R	90.1	Very high	90.4	Very high	81 Å²	81	35 Å²	35	31%	0.306	18%	0.178	S	C	.	.	H	α-helix	trans	-56.7	-46	169.5	-170.5	-153.6	-168.5	91.5	-5	112.1	C689 Q690 I691 K697 E755 M759	C689-R693 WeakPolarHBondContact O-CB 3.15Å; C689-R693 PolarHBondContact O-N 3.07Å; Q690-R693 WeakPolarHBondContact O-CB 3.37Å; Q690-R693 PolarHBondContact O-N 2.79Å; I691-R693 VanDerWaalsContact C-N 3.25Å; I691-R693 PolarHBondContact O-N 3.09Å; R693-K697 WeakPolarHBondContact O-CB 3.39Å; R693-K697 PolarHBondContact O-N 2.9Å; R693-E755 IonicContact CZ-OE2 4Å; R693-E755 IonicContact NH1-OE2 3.52Å; R693-E755 PolarHBondContact NH1-OE2 2.85Å; R693-E755 IonicContact NH2-OE2 2.65Å; R693-E755 PolarHBondContact NH2-OE2 2.65Å; R693-M759 HydrophobicContact CG-CE 4.19Å; R693-M759 HydrophobicContact CG-SD 3.59Å; R693-M759 VanDerWaalsContact CG-SD 3.59Å
694	V	89.8	Confident	90.2	Very high	23 Å²	23	34.9 Å²	34.9	14%	0.139	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-42.4	176.8	175.4	0	0	0	0	111.1	W661 Q690 I691 V692 K697 N698	W661-V694 HydrophobicContact CD2-CG1 4.39Å; W661-V694 HydrophobicContact CG-CG1 4.34Å; Q690-V694 WeakPolarHBondContact O-CG2 3.43Å; Q690-V694 PolarHBondContact O-N 3.26Å; I691-V694 WeakPolarHBondContact O-CB 3.39Å; I691-V694 PolarHBondContact O-N 3.28Å; V692-V694 PolarHBondContact O-N 2.89Å; V694-K697 PolarHBondContact O-N 2.74Å; V694-N698 WeakPolarHBondContact O-CB 3.26Å; V694-N698 PolarHBondContact O-N 2.59Å; V694-N698 VanDerWaalsContact O-N 3.1Å
695	I	92	Very high	89.9	Confident	1 Å²	1	41 Å²	41	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-49.4	177.1	-64.9	171.6	0	0	0	110.8	W661 V666 L670 L673 I691 V692 N698 F699 L733	W661-I695 HydrophobicContact CE3-CG1 4.11Å; W661-I695 HydrophobicContact CH2-CD1 4.26Å; W661-I695 HydrophobicContact CH2-CG1 4.22Å; W661-I695 HydrophobicContact CZ3-CD1 3.87Å; W661-I695 HydrophobicContact CZ3-CG1 3.72Å; V666-I695 HydrophobicContact CG1-CD1 4.41Å; V666-I695 HydrophobicContact CG1-CG1 4.49Å; V666-I695 HydrophobicContact CG1-CG2 3.67Å; V666-I695 HydrophobicContact CG2-CG1 4.3Å; V666-I695 HydrophobicContact CG2-CG2 4.46Å; L670-I695 HydrophobicContact CD2-CD1 3.97Å; L670-I695 HydrophobicContact CG-CD1 4.24Å; L673-I695 HydrophobicContact CD1-CD1 3.94Å; I691-I695 HydrophobicContact CG2-CD1 3.73Å; I691-I695 HydrophobicContact CG2-CG1 4.33Å; I691-I695 WeakPolarHBondContact O-CG1 3.32Å; I691-I695 PolarHBondContact O-N 3.05Å; V692-I695 PolarHBondContact O-N 3.28Å; I695-N698 PolarHBondContact O-N 2.82Å; I695-F699 WeakPolarHBondContact O-CA 3.35Å; I695-F699 WeakPolarHBondContact O-CB 3.31Å; I695-F699 PolarHBondContact O-N 2.67Å; I695-L733 HydrophobicContact CG2-CD1 4.48Å; I695-L733 HydrophobicContact CG2-CD2 4.32Å
696	I	90.5	Very high	89.5	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-48.1	179.3	-63.7	174.5	0	0	0	110.4	V692 N698 A700 L733 L756 M759 F760 L762 L763	V692-I696 HydrophobicContact CG1-CD1 3.9Å; V692-I696 HydrophobicContact CG1-CG1 4.18Å; V692-I696 VanDerWaalsContact O-CG1 3.28Å; V692-I696 WeakPolarHBondContact O-CG1 3.39Å; V692-I696 PolarHBondContact O-N 2.92Å; I696-N698 VanDerWaalsContact C-N 3.28Å; I696-N698 PolarHBondContact O-N 2.77Å; I696-A700 HydrophobicContact CG2-CB 4.11Å; I696-A700 WeakPolarHBondContact O-CB 3.42Å; I696-A700 PolarHBondContact O-N 3.21Å; I696-A700 VanDerWaalsContact O-N 3.12Å; I696-L733 HydrophobicContact CG1-CD2 4.17Å; I696-L756 HydrophobicContact CD1-CD2 3.63Å; I696-M759 HydrophobicContact CG2-CB 4.13Å; I696-F760 HydrophobicContact CD1-CD1 3.86Å; I696-F760 HydrophobicContact CD1-CD2 4.44Å; I696-F760 HydrophobicContact CD1-CE1 3.68Å; I696-F760 HydrophobicContact CD1-CE2 4.32Å; I696-F760 HydrophobicContact CD1-CG 4.23Å; I696-F760 HydrophobicContact CD1-CZ 3.93Å; I696-L762 HydrophobicContact CG2-CB 4.43Å; I696-L763 HydrophobicContact CD1-CD1 4.05Å; I696-L763 HydrophobicContact CG1-CD1 3.79Å; I696-L763 HydrophobicContact CG2-CD1 4.28Å
697	K	88.3	Confident	89.3	Confident	147 Å²	147	40.9 Å²	40.9	64%	0.639	20%	0.2	S	C	*	.	H	α-helix	trans	-55.4	-42.8	-179.4	-174.2	-178	177.4	-175.5	0	112.2	R693 V694	R693-K697 WeakPolarHBondContact O-CB 3.39Å; R693-K697 PolarHBondContact O-N 2.9Å; V694-K697 PolarHBondContact O-N 2.74Å
698	N	86.3	Confident	88.9	Confident	60 Å²	60	46.9 Å²	46.9	32%	0.321	23%	0.227	S	C	.	.	H	α-helix	trans	-95.2	-31.2	-171.2	-63.7	-5.7	0	0	0	113.7	V694 I695 I696	V694-N698 WeakPolarHBondContact O-CB 3.26Å; V694-N698 PolarHBondContact O-N 2.59Å; V694-N698 VanDerWaalsContact O-N 3.1Å; I695-N698 PolarHBondContact O-N 2.82Å; I696-N698 VanDerWaalsContact C-N 3.28Å; I696-N698 PolarHBondContact O-N 2.77Å
699	F	90.1	Very high	88.1	Confident	23 Å²	23	47.7 Å²	47.7	10%	0.101	24%	0.235	C	C	.	.	H	α-helix	trans	-113.5	-14.7	-170.1	-63.6	-91.5	0	0	0	114.9	W661 L663 V666 I695 V702 I703	W661-F699 HydrophobicContact CB-CE2 3.74Å; W661-F699 HydrophobicContact CB-CZ 3.88Å; L663-F699 HydrophobicContact CD1-CD1 4.49Å; V666-F699 HydrophobicContact CG2-CD1 4.4Å; V666-F699 HydrophobicContact CG2-CD2 3.87Å; V666-F699 HydrophobicContact CG2-CE1 4.27Å; V666-F699 HydrophobicContact CG2-CE2 3.75Å; V666-F699 HydrophobicContact CG2-CG 4.22Å; V666-F699 HydrophobicContact CG2-CZ 3.96Å; I695-F699 WeakPolarHBondContact O-CA 3.35Å; I695-F699 WeakPolarHBondContact O-CB 3.31Å; I695-F699 PolarHBondContact O-N 2.67Å; F699-V702 WeakPolarHBondContact O-CB 3.47Å; F699-V702 PolarHBondContact O-N 3.44Å; F699-I703 HydrophobicContact CB-CD1 4.17Å; F699-I703 VanDerWaalsContact O-CG1 3.31Å; F699-I703 WeakPolarHBondContact O-CG1 3.14Å; F699-I703 PolarHBondContact O-N 2.76Å
700	A	88.1	Confident	87.1	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.017	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-42.1	178.6	0	0	0	0	0	113.8	I696 V702 I703 R704 L762 L763	I696-A700 HydrophobicContact CG2-CB 4.11Å; I696-A700 WeakPolarHBondContact O-CB 3.42Å; I696-A700 PolarHBondContact O-N 3.21Å; I696-A700 VanDerWaalsContact O-N 3.12Å; A700-V702 VanDerWaalsContact C-N 3.31Å; A700-V702 PolarHBondContact O-N 3.47Å; A700-I703 PolarHBondContact O-N 2.88Å; A700-R704 PolarHBondContact O-N 3.05Å; A700-L762 WeakPolarHBondContact CB-O 3.38Å; A700-L763 HydrophobicContact CB-CD2 4.18Å; A700-L763 HydrophobicContact CB-CG 3.98Å
701	P	86.8	Confident	86	Confident	84 Å²	84	54 Å²	54	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-39.3	173.9	-22.1	34	0	0	0	112.5	Q705	P701-Q705 VanDerWaalsContact O-CB 3.29Å; P701-Q705 WeakPolarHBondContact O-CB 3.48Å; P701-Q705 PolarHBondContact O-N 2.64Å
702	V	86.8	Confident	84.6	Confident	42 Å²	42	57.4 Å²	57.4	26%	0.255	30%	0.303	S	S	.	.	H	α-helix	trans	-68.4	-40.9	-179.7	-175.4	0	0	0	0	111.4	F699 A700 T706 R722	F699-V702 WeakPolarHBondContact O-CB 3.47Å; F699-V702 PolarHBondContact O-N 3.44Å; A700-V702 VanDerWaalsContact C-N 3.31Å; A700-V702 PolarHBondContact O-N 3.47Å; V702-T706 VanDerWaalsContact O-CB 3.28Å; V702-T706 WeakPolarHBondContact O-CB 3.24Å; V702-T706 PolarHBondContact O-N 3.48Å; V702-T706 PolarHBondContact O-OG1 3.44Å; V702-R722 VanDerWaalsContact CG1-NH2 3.29Å
703	I	87.3	Confident	83	Confident	2 Å²	2	64 Å²	64	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-52.5	177.4	-69.8	166	0	0	0	109.6	F699 A700 T706 I707 C726 C729 L730 L733 L763	F699-I703 HydrophobicContact CB-CD1 4.17Å; F699-I703 VanDerWaalsContact O-CG1 3.31Å; F699-I703 WeakPolarHBondContact O-CG1 3.14Å; F699-I703 PolarHBondContact O-N 2.76Å; A700-I703 PolarHBondContact O-N 2.88Å; I703-T706 PolarHBondContact O-N 2.86Å; I703-I707 HydrophobicContact CG2-CD1 3.71Å; I703-I707 WeakPolarHBondContact O-CG1 3.38Å; I703-I707 PolarHBondContact O-N 3.23Å; I703-C726 HydrophobicContact CG1-CB 4.43Å; I703-C729 HydrophobicContact CD1-CB 4.1Å; I703-L730 HydrophobicContact CG2-CB 4.2Å; I703-L733 HydrophobicContact CD1-CD1 3.91Å; I703-L763 HydrophobicContact CG2-CD2 4.42Å
704	R	87.1	Confident	81.9	Confident	70 Å²	70	63.3 Å²	63.3	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-55.5	-55	176.2	-78.1	-173.4	177.4	157.9	-6.8	111.7	A700 T706 I707 E708 Q761 L762 L763 V764	A700-R704 PolarHBondContact O-N 3.05Å; R704-T706 PolarHBondContact O-N 2.6Å; R704-I707 PolarHBondContact O-N 2.73Å; R704-E708 WeakPolarHBondContact O-CB 3.32Å; R704-E708 PolarHBondContact O-N 2.78Å; R704-Q761 PolarHBondContact NH2-O 3.22Å; R704-Q761 VanDerWaalsContact NH2-O 3.08Å; R704-L762 PolarHBondContact NE-O 3.34Å; R704-L762 PolarHBondContact NH1-O 3.46Å; R704-L762 PolarHBondContact NH2-O 2.94Å; R704-L763 PolarHBondContact NE-O 3.43Å; R704-L763 VanDerWaalsContact NE-O 3.13Å; R704-V764 PolarHBondContact NH2-OXT 3.03Å
705	Q	85.3	Confident	80.8	Confident	144 Å²	144	69.4 Å²	69.4	67%	0.673	40%	0.401	S	S	*	.	H	α-helix	trans	-60.2	-31.7	-178.2	-167.9	-175.2	30.5	0	0	113.3	P701 G709	P701-Q705 VanDerWaalsContact O-CB 3.29Å; P701-Q705 WeakPolarHBondContact O-CB 3.48Å; P701-Q705 PolarHBondContact O-N 2.64Å; Q705-G709 WeakPolarHBondContact O-CA 3.49Å; Q705-G709 PolarHBondContact O-N 3.06Å; Q705-G709 VanDerWaalsContact O-N 3.11Å
706	T	85.4	Confident	80	Confident	17 Å²	17	73.4 Å²	73.4	10%	0.104	42%	0.423	C	S	.	.	H	α-helix	trans	-76.9	-31.7	178.2	-54.7	0	0	0	0	112.3	V702 I703 R704 R722 R723 C726	V702-T706 VanDerWaalsContact O-CB 3.28Å; V702-T706 WeakPolarHBondContact O-CB 3.24Å; V702-T706 PolarHBondContact O-N 3.48Å; V702-T706 PolarHBondContact O-OG1 3.44Å; I703-T706 PolarHBondContact O-N 2.86Å; R704-T706 PolarHBondContact O-N 2.6Å; T706-R722 HydrophobicContact CG2-CG 4.17Å; T706-R723 HydrophobicContact CG2-CB 4.31Å; T706-C726 HydrophobicContact CG2-CB 4.25Å
707	I	85.5	Confident	79.3	Confident	59 Å²	59	79.6 Å²	79.6	30%	0.303	46%	0.455	S	S	.	.	H	α-helix	trans	-85.4	-45.8	-178.7	-67.4	173.8	0	0	0	111.5	I703 R704 G709 C726 Q727 L730	I703-I707 HydrophobicContact CG2-CD1 3.71Å; I703-I707 WeakPolarHBondContact O-CG1 3.38Å; I703-I707 PolarHBondContact O-N 3.23Å; R704-I707 PolarHBondContact O-N 2.73Å; I707-G709 VanDerWaalsContact C-N 3.34Å; I707-C726 HydrophobicContact CD1-CB 4.4Å; I707-C726 HydrophobicContact CG1-CB 4.3Å; I707-Q727 HydrophobicContact CD1-CG 4.38Å; I707-Q727 HydrophobicContact CG1-CG 4.38Å; I707-L730 HydrophobicContact CD1-CB 4.21Å; I707-L730 HydrophobicContact CD1-CD2 3.67Å
708	E	83.3	Confident	78.8	Confident	144 Å²	144	79.2 Å²	79.2	67%	0.673	46%	0.457	S	S	*	.	H	α-helix	trans	-76.2	-22	177.8	-65.1	167.8	-163.5	0	0	112.7	R704	R704-E708 WeakPolarHBondContact O-CB 3.32Å; R704-E708 PolarHBondContact O-N 2.78Å
709	G	77.4	Confident	78.4	Confident	16 Å²	16	80.7 Å²	80.7	17%	0.165	46%	0.458	C	S	.	.	S	Bend	trans	-64.8	134.9	-175.8	0	0	0	0	0	113	Q705 I707 T711	Q705-G709 WeakPolarHBondContact O-CA 3.49Å; Q705-G709 PolarHBondContact O-N 3.06Å; Q705-G709 VanDerWaalsContact O-N 3.11Å; I707-G709 VanDerWaalsContact C-N 3.34Å; G709-T711 PolarHBondContact O-N 2.99Å
710	P	72.7	Confident	78	Confident	110 Å²	110	84 Å²	84	71%	0.714	47%	0.474	S	S	*	.			trans	-57.5	135.8	-171.5	22.9	-34.4	0	0	0	112.2	P712 R719	P710-P712 WeakPolarHBondContact O-CD 3.48Å; P710-R719 PolarHBondContact O-NH2 2.96Å
711	T	67.7	Low	77.9	Confident	107 Å²	107	87.3 Å²	87.3	66%	0.656	49%	0.489	S	S	*	.			trans	-70.5	107.2	171.9	36.5	0	0	0	0	109.9	G709	G709-T711 PolarHBondContact O-N 2.99Å
712	P	62.3	Low	77.8	Confident	70 Å²	70	88.8 Å²	88.8	46%	0.455	48%	0.484	S	S	.	.			trans	-73.3	147.9	174.3	-4.6	23.2	0	0	0	109.2	P710 G714	P710-P712 WeakPolarHBondContact O-CD 3.48Å; P712-G714 PolarHBondContact O-N 3.04Å; P712-G714 VanDerWaalsContact O-N 3.15Å
713	P	59.9	Low	77.8	Confident	139 Å²	139	87.8 Å²	87.8	90%	0.903	48%	0.476	S	S	*	.	S	Bend	trans	-67.1	111.7	168.9	27.6	-32.5	0	0	0	110
714	G	68.1	Low	77.9	Confident	68 Å²	68	94 Å²	94	70%	0.701	50%	0.499	S	S	*	.	S	Bend	trans	157.1	158.9	177.6	0	0	0	0	0	112.7	P712	P712-G714 PolarHBondContact O-N 3.04Å; P712-G714 VanDerWaalsContact O-N 3.15Å
715	V	66.7	Low	78.1	Confident	151 Å²	151	92 Å²	92	92%	0.915	49%	0.492	S	S	*	.			trans	-96.5	93.7	174.5	-177.3	0	0	0	0	109
716	D	74.8	Confident	78.3	Confident	85 Å²	85	85.1 Å²	85.1	46%	0.455	46%	0.46	S	S	.	.			trans	-104.8	96.7	169.4	179.2	-11.2	0	0	0	108.8	M718 R719 E720	D716-M718 VanDerWaalsContact C-N 3.26Å; D716-M718 PolarHBondContact O-N 2.86Å; D716-M718 PolarHBondContact OD1-N 3.44Å; D716-M718 VanDerWaalsContact OD1-N 3.09Å; D716-R719 HydrophobicContact CB-CB 3.94Å; D716-R719 PolarHBondContact O-N 2.65Å; D716-R719 PolarHBondContact OD1-N 3.03Å; D716-R719 VanDerWaalsContact OD2-CB 3.25Å; D716-R719 WeakPolarHBondContact OD2-CB 3.46Å; D716-E720 WeakPolarHBondContact O-CB 3.35Å; D716-E720 PolarHBondContact O-N 2.95Å
717	L	75	Confident	78.6	Confident	132 Å²	132	88.9 Å²	88.9	69%	0.691	48%	0.476	S	S	*	.	H	α-helix	trans	-60.3	-35.2	-177.4	-175.5	64.2	0	0	0	112.3	E720 E721	L717-E720 PolarHBondContact O-N 3.29Å; L717-E721 VanDerWaalsContact O-CB 3.29Å; L717-E721 WeakPolarHBondContact O-CB 3.45Å; L717-E721 PolarHBondContact O-N 3.46Å
718	M	77.7	Confident	78.9	Confident	139 Å²	139	89.4 Å²	89.4	69%	0.685	48%	0.477	S	S	*	.	H	α-helix	trans	-71.3	-40.4	-179.5	-64.9	-63.5	-63.3	0	0	111.2	D716 R722	D716-M718 VanDerWaalsContact C-N 3.26Å; D716-M718 PolarHBondContact O-N 2.86Å; D716-M718 PolarHBondContact OD1-N 3.44Å; D716-M718 VanDerWaalsContact OD1-N 3.09Å; M718-R722 WeakPolarHBondContact O-CB 3.42Å; M718-R722 PolarHBondContact O-N 3.34Å
719	R	78.8	Confident	79.3	Confident	91 Å²	91	82.5 Å²	82.5	34%	0.343	45%	0.445	S	S	.	.	H	α-helix	trans	-70	-36.9	175.4	-176	170.3	179.9	174.3	-6.6	112.1	P710 D716 R722 R723	P710-R719 PolarHBondContact O-NH2 2.96Å; D716-R719 HydrophobicContact CB-CB 3.94Å; D716-R719 PolarHBondContact O-N 2.65Å; D716-R719 PolarHBondContact OD1-N 3.03Å; D716-R719 VanDerWaalsContact OD2-CB 3.25Å; D716-R719 WeakPolarHBondContact OD2-CB 3.46Å; R719-R722 PolarHBondContact O-N 2.74Å; R719-R723 WeakPolarHBondContact O-CB 3.39Å; R719-R723 PolarHBondContact O-N 3.05Å
720	E	81.7	Confident	80	Confident	93 Å²	93	84 Å²	84	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-72.2	-39.5	177.7	-161.8	55.9	-149.1	0	0	111.8	D716 L717 R722 R723 R724	D716-E720 WeakPolarHBondContact O-CB 3.35Å; D716-E720 PolarHBondContact O-N 2.95Å; L717-E720 PolarHBondContact O-N 3.29Å; E720-R722 VanDerWaalsContact C-N 3.34Å; E720-R722 PolarHBondContact O-N 3.05Å; E720-R723 PolarHBondContact O-N 3.14Å; E720-R723 IonicContact OE2-CZ 2.68Å; E720-R723 IonicContact OE2-NH1 2.65Å; E720-R723 PolarHBondContact OE2-NH1 2.75Å; E720-R724 WeakPolarHBondContact O-CB 3.31Å; E720-R724 PolarHBondContact O-N 3.22Å
721	E	85.7	Confident	80.9	Confident	70 Å²	70	81.9 Å²	81.9	33%	0.327	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-43.3	170.7	-171.7	-172.7	168.1	0	0	111.5	L717 R724 K725	L717-E721 VanDerWaalsContact O-CB 3.29Å; L717-E721 WeakPolarHBondContact O-CB 3.45Å; L717-E721 PolarHBondContact O-N 3.46Å; E721-R724 PolarHBondContact O-N 3.45Å; E721-K725 HydrophobicContact CG-CD 4.49Å; E721-K725 WeakPolarHBondContact O-CG 3.35Å; E721-K725 PolarHBondContact O-N 2.95Å; E721-K725 WeakPolarHBondContact OE1-CE 3.4Å; E721-K725 IonicContact OE1-NZ 3.11Å; E721-K725 PolarHBondContact OE1-NZ 2.79Å
722	R	85.1	Confident	82.2	Confident	115 Å²	115	79.3 Å²	79.3	43%	0.434	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-43.1	174.6	-175.5	-176.9	173.4	164.6	0.5	111.8	L663 V702 T706 M718 R719 E720 K725 C726	L663-R722 HydrophobicContact CD2-CG 3.83Å; V702-R722 VanDerWaalsContact CG1-NH2 3.29Å; T706-R722 HydrophobicContact CG2-CG 4.17Å; M718-R722 WeakPolarHBondContact O-CB 3.42Å; M718-R722 PolarHBondContact O-N 3.34Å; R719-R722 PolarHBondContact O-N 2.74Å; E720-R722 VanDerWaalsContact C-N 3.34Å; E720-R722 PolarHBondContact O-N 3.05Å; R722-K725 PolarHBondContact O-N 3.41Å; R722-C726 PolarHBondContact O-N 2.87Å; R722-C726 PolarHBondContact O-SG 3.31Å; R722-C726 VanDerWaalsContact O-SG 3.38Å
723	R	86.3	Confident	83.6	Confident	22 Å²	22	76 Å²	76	8%	0.083	40%	0.396	C	S	.	.	H	α-helix	trans	-61.8	-46	175.9	178.2	179.3	-75.1	137.2	-10	111.2	T706 R719 E720 K725 C726 Q727	T706-R723 HydrophobicContact CG2-CB 4.31Å; R719-R723 WeakPolarHBondContact O-CB 3.39Å; R719-R723 PolarHBondContact O-N 3.05Å; E720-R723 PolarHBondContact O-N 3.14Å; E720-R723 IonicContact OE2-CZ 2.68Å; E720-R723 IonicContact OE2-NH1 2.65Å; E720-R723 PolarHBondContact OE2-NH1 2.75Å; R723-K725 PolarHBondContact O-N 2.79Å; R723-C726 PolarHBondContact O-N 2.95Å; R723-Q727 HydrophobicContact CG-CG 4.49Å; R723-Q727 WeakPolarHBondContact O-CG 3.21Å; R723-Q727 PolarHBondContact O-N 2.83Å
724	R	88.9	Confident	85.1	Confident	131 Å²	131	73.3 Å²	73.3	49%	0.494	37%	0.374	S	S	.	.	H	α-helix	trans	-57.8	-49.4	176.7	-160.3	-168.4	78.9	-149.4	-4.4	111.4	E720 E721 C726 Q727 E728	E720-R724 WeakPolarHBondContact O-CB 3.31Å; E720-R724 PolarHBondContact O-N 3.22Å; E721-R724 PolarHBondContact O-N 3.45Å; R724-C726 PolarHBondContact O-N 3.19Å; R724-Q727 WeakPolarHBondContact O-CB 3.36Å; R724-Q727 PolarHBondContact O-N 3.28Å; R724-Q727 VanDerWaalsContact O-N 3.12Å; R724-E728 WeakPolarHBondContact CD-OE1 3.09Å; R724-E728 WeakPolarHBondContact CG-OE1 3.2Å; R724-E728 IonicContact CZ-OE1 3.18Å; R724-E728 IonicContact NE-OE1 3.7Å; R724-E728 PolarHBondContact NE-OE1 3.4Å; R724-E728 IonicContact NH2-OE1 2.89Å; R724-E728 WeakPolarHBondContact O-CG 3.16Å; R724-E728 PolarHBondContact O-N 2.9Å
725	K	91.1	Very high	86.3	Confident	28 Å²	28	72.6 Å²	72.6	12%	0.122	36%	0.356	C	S	.	.	H	α-helix	trans	-57.2	-45.3	174.7	-72.4	173.6	-174.3	167.8	0	111.8	L663 D664 E721 R722 R723 Q727 E728 C729	L663-K725 HydrophobicContact CD2-CB 4.19Å; L663-K725 HydrophobicContact CG-CB 4.31Å; D664-K725 WeakPolarHBondContact OD1-CE 3.38Å; D664-K725 IonicContact OD1-NZ 3.19Å; D664-K725 PolarHBondContact OD1-NZ 3.15Å; E721-K725 HydrophobicContact CG-CD 4.49Å; E721-K725 WeakPolarHBondContact O-CG 3.35Å; E721-K725 PolarHBondContact O-N 2.95Å; E721-K725 WeakPolarHBondContact OE1-CE 3.4Å; E721-K725 IonicContact OE1-NZ 3.11Å; E721-K725 PolarHBondContact OE1-NZ 2.79Å; R722-K725 PolarHBondContact O-N 3.41Å; R723-K725 PolarHBondContact O-N 2.79Å; K725-Q727 VanDerWaalsContact C-N 3.34Å; K725-Q727 PolarHBondContact O-N 3.24Å; K725-E728 PolarHBondContact O-N 2.89Å; K725-C729 WeakPolarHBondContact O-CB 3.32Å; K725-C729 PolarHBondContact O-N 3.33Å; K725-C729 PolarHBondContact O-SG 3.47Å
726	C	90.5	Very high	87.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-36	176.4	-72	0	0	0	0	113.3	I703 T706 I707 R722 R723 R724 L730	I703-C726 HydrophobicContact CG1-CB 4.43Å; T706-C726 HydrophobicContact CG2-CB 4.25Å; I707-C726 HydrophobicContact CD1-CB 4.4Å; I707-C726 HydrophobicContact CG1-CB 4.3Å; R722-C726 PolarHBondContact O-N 2.87Å; R722-C726 PolarHBondContact O-SG 3.31Å; R722-C726 VanDerWaalsContact O-SG 3.38Å; R723-C726 PolarHBondContact O-N 2.95Å; R724-C726 PolarHBondContact O-N 3.19Å; C726-L730 WeakPolarHBondContact O-CB 3.3Å; C726-L730 PolarHBondContact O-N 2.76Å
727	Q	90.7	Very high	88.3	Confident	96 Å²	96	65.8 Å²	65.8	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-69.5	-44.6	175.5	-72.3	170.6	-22.3	0	0	112.1	I707 R723 R724 K725 L730 S731	I707-Q727 HydrophobicContact CD1-CG 4.38Å; I707-Q727 HydrophobicContact CG1-CG 4.38Å; R723-Q727 HydrophobicContact CG-CG 4.49Å; R723-Q727 WeakPolarHBondContact O-CG 3.21Å; R723-Q727 PolarHBondContact O-N 2.83Å; R724-Q727 WeakPolarHBondContact O-CB 3.36Å; R724-Q727 PolarHBondContact O-N 3.28Å; R724-Q727 VanDerWaalsContact O-N 3.12Å; K725-Q727 VanDerWaalsContact C-N 3.34Å; K725-Q727 PolarHBondContact O-N 3.24Å; Q727-L730 PolarHBondContact O-N 2.94Å; Q727-S731 PolarHBondContact O-N 3.47Å
728	E	91.8	Very high	89.1	Confident	70 Å²	70	63.2 Å²	63.2	33%	0.327	30%	0.3	S	S	.	.	H	α-helix	trans	-57.2	-48.3	172.3	-70.6	162.9	-172.8	0	0	110.3	R724 K725 L730 S731 H732	R724-E728 WeakPolarHBondContact CD-OE1 3.09Å; R724-E728 WeakPolarHBondContact CG-OE1 3.2Å; R724-E728 IonicContact CZ-OE1 3.18Å; R724-E728 IonicContact NE-OE1 3.7Å; R724-E728 PolarHBondContact NE-OE1 3.4Å; R724-E728 IonicContact NH2-OE1 2.89Å; R724-E728 WeakPolarHBondContact O-CG 3.16Å; R724-E728 PolarHBondContact O-N 2.9Å; K725-E728 PolarHBondContact O-N 2.89Å; E728-L730 PolarHBondContact O-N 3.1Å; E728-S731 WeakPolarHBondContact O-CB 3.41Å; E728-S731 PolarHBondContact O-N 2.96Å; E728-H732 PolarHBondContact O-CD2 3.31Å; E728-H732 PolarHBondContact O-N 3.14Å; E728-H732 VanDerWaalsContact O-N 3.11Å
729	C	92.3	Very high	89.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-46.2	175.4	-66.4	0	0	0	0	112.5	L670 I703 K725 S731 H732 L733	L670-C729 HydrophobicContact CD1-CB 3.62Å; I703-C729 HydrophobicContact CD1-CB 4.1Å; K725-C729 WeakPolarHBondContact O-CB 3.32Å; K725-C729 PolarHBondContact O-N 3.33Å; K725-C729 PolarHBondContact O-SG 3.47Å; C729-S731 VanDerWaalsContact C-N 3.34Å; C729-S731 PolarHBondContact O-N 2.8Å; C729-H732 PolarHBondContact O-N 2.97Å; C729-L733 VanDerWaalsContact O-CB 3.31Å; C729-L733 WeakPolarHBondContact O-CB 3.27Å; C729-L733 WeakPolarHBondContact O-CD1 3.27Å; C729-L733 WeakPolarHBondContact O-CG 3.49Å; C729-L733 PolarHBondContact O-N 3.44Å
730	L	91.6	Very high	90.2	Very high	46 Å²	46	52.6 Å²	52.6	24%	0.241	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-42	178.6	179.6	62.3	0	0	0	111.7	I703 I707 C726 Q727 E728 L733 L734 L763	I703-L730 HydrophobicContact CG2-CB 4.2Å; I707-L730 HydrophobicContact CD1-CB 4.21Å; I707-L730 HydrophobicContact CD1-CD2 3.67Å; C726-L730 WeakPolarHBondContact O-CB 3.3Å; C726-L730 PolarHBondContact O-N 2.76Å; Q727-L730 PolarHBondContact O-N 2.94Å; E728-L730 PolarHBondContact O-N 3.1Å; L730-L733 PolarHBondContact O-N 3.26Å; L730-L734 HydrophobicContact CD1-CD1 4.23Å; L730-L734 HydrophobicContact CD1-CG 4.28Å; L730-L734 HydrophobicContact CG-CD1 4.16Å; L730-L734 WeakPolarHBondContact O-CG 3.46Å; L730-L734 PolarHBondContact O-N 2.61Å; L730-L763 HydrophobicContact CD1-CD2 3.88Å
731	S	92.9	Very high	90.3	Very high	67 Å²	67	51.3 Å²	51.3	47%	0.469	27%	0.265	S	S	.	.	H	α-helix	trans	-58.1	-53.7	177	-175.6	0	0	0	0	111.4	Q727 E728 C729 L733 L734 T735	Q727-S731 PolarHBondContact O-N 3.47Å; E728-S731 WeakPolarHBondContact O-CB 3.41Å; E728-S731 PolarHBondContact O-N 2.96Å; C729-S731 VanDerWaalsContact C-N 3.34Å; C729-S731 PolarHBondContact O-N 2.8Å; S731-L733 PolarHBondContact O-N 2.94Å; S731-L734 PolarHBondContact O-N 2.8Å; S731-T735 PolarHBondContact O-N 3.02Å; S731-T735 PolarHBondContact O-OG1 3.2Å; S731-T735 VanDerWaalsContact O-OG1 3.13Å
732	H	94	Very high	90.5	Very high	53 Å²	53	51 Å²	51	25%	0.245	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-37.8	179.4	-63	-45.6	0	0	0	113	L670 V674 E728 C729 L734 T735 I736	L670-H732 HydrophobicContact CB-CB 3.84Å; V674-H732 HydrophobicContact CG2-CB 4.18Å; E728-H732 PolarHBondContact O-CD2 3.31Å; E728-H732 PolarHBondContact O-N 3.14Å; E728-H732 VanDerWaalsContact O-N 3.11Å; C729-H732 PolarHBondContact O-N 2.97Å; H732-L734 VanDerWaalsContact C-N 3.33Å; H732-L734 PolarHBondContact O-N 2.88Å; H732-T735 WeakPolarHBondContact O-CB 3.14Å; H732-T735 PolarHBondContact O-N 3.25Å; H732-I736 WeakPolarHBondContact O-CG1 3.22Å; H732-I736 PolarHBondContact O-N 3.4Å
733	L	93	Very high	90.5	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-40.3	174.5	-77	165.8	0	0	0	111.9	L670 V692 I695 I696 I703 C729 L730 S731 I736 R737 F760 L763	L670-L733 HydrophobicContact CD1-CD1 4.31Å; L670-L733 HydrophobicContact CD1-CG 4.05Å; L670-L733 HydrophobicContact CD2-CD2 3.8Å; L670-L733 HydrophobicContact CD2-CG 3.98Å; V692-L733 HydrophobicContact CG1-CD2 3.77Å; I695-L733 HydrophobicContact CG2-CD1 4.48Å; I695-L733 HydrophobicContact CG2-CD2 4.32Å; I696-L733 HydrophobicContact CG1-CD2 4.17Å; I703-L733 HydrophobicContact CD1-CD1 3.91Å; C729-L733 VanDerWaalsContact O-CB 3.31Å; C729-L733 WeakPolarHBondContact O-CB 3.27Å; C729-L733 WeakPolarHBondContact O-CD1 3.27Å; C729-L733 WeakPolarHBondContact O-CG 3.49Å; C729-L733 PolarHBondContact O-N 3.44Å; L730-L733 PolarHBondContact O-N 3.26Å; S731-L733 PolarHBondContact O-N 2.94Å; L733-I736 PolarHBondContact O-N 3.39Å; L733-R737 PolarHBondContact O-N 3.13Å; L733-F760 HydrophobicContact CB-CE1 4.23Å; L733-F760 HydrophobicContact CD2-CE1 4.43Å; L733-F760 VanDerWaalsContact O-CE1 3.23Å; L733-F760 WeakPolarHBondContact O-CE1 3.26Å; L733-F760 VanDerWaalsContact O-CZ 3.3Å; L733-F760 WeakPolarHBondContact O-CZ 3.46Å; L733-L763 HydrophobicContact CB-CD1 4.3Å; L733-L763 HydrophobicContact CD1-CD1 4.04Å; L733-L763 HydrophobicContact CD1-CD2 4.25Å
734	L	91.5	Very high	90.5	Very high	81 Å²	81	59.8 Å²	59.8	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-68.7	-35.4	174.1	-69	172.3	0	0	0	112.3	L730 S731 H732 R737 S738	L730-L734 HydrophobicContact CD1-CD1 4.23Å; L730-L734 HydrophobicContact CD1-CG 4.28Å; L730-L734 HydrophobicContact CG-CD1 4.16Å; L730-L734 WeakPolarHBondContact O-CG 3.46Å; L730-L734 PolarHBondContact O-N 2.61Å; S731-L734 PolarHBondContact O-N 2.8Å; H732-L734 VanDerWaalsContact C-N 3.33Å; H732-L734 PolarHBondContact O-N 2.88Å; L734-R737 WeakPolarHBondContact O-CB 3.22Å; L734-R737 PolarHBondContact O-N 3.09Å; L734-S738 PolarHBondContact O-N 2.71Å
735	T	93.2	Very high	90.5	Very high	54 Å²	54	53.7 Å²	53.7	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-48.5	171.2	-49.5	0	0	0	0	111.2	V674 S731 H732 R737 S738 A739	V674-T735 HydrophobicContact CG1-CG2 3.75Å; V674-T735 HydrophobicContact CG2-CG2 4.36Å; S731-T735 PolarHBondContact O-N 3.02Å; S731-T735 PolarHBondContact O-OG1 3.2Å; S731-T735 VanDerWaalsContact O-OG1 3.13Å; H732-T735 WeakPolarHBondContact O-CB 3.14Å; H732-T735 PolarHBondContact O-N 3.25Å; T735-R737 VanDerWaalsContact C-N 3.28Å; T735-R737 PolarHBondContact O-N 3.34Å; T735-S738 PolarHBondContact O-N 3.46Å; T735-S738 PolarHBondContact O-OG 3.34Å; T735-A739 PolarHBondContact O-N 2.97Å
736	I	92.3	Very high	90.2	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-40	176.8	-65.8	169.3	0	0	0	111.1	L670 L673 V674 V692 H732 L733 S738 A739 L740 F760	L670-I736 HydrophobicContact CD2-CD1 3.96Å; L673-I736 HydrophobicContact CB-CD1 3.99Å; V674-I736 HydrophobicContact CG2-CD1 4.18Å; V674-I736 HydrophobicContact CG2-CG1 3.76Å; V692-I736 HydrophobicContact CG1-CG2 4.42Å; V692-I736 HydrophobicContact CG2-CD1 3.84Å; V692-I736 HydrophobicContact CG2-CG2 4.29Å; H732-I736 WeakPolarHBondContact O-CG1 3.22Å; H732-I736 PolarHBondContact O-N 3.4Å; L733-I736 PolarHBondContact O-N 3.39Å; I736-S738 VanDerWaalsContact C-N 3.35Å; I736-S738 PolarHBondContact O-N 3.25Å; I736-A739 PolarHBondContact O-N 2.84Å; I736-L740 HydrophobicContact CG2-CD1 4.13Å; I736-L740 WeakPolarHBondContact O-CG 3.47Å; I736-L740 PolarHBondContact O-N 2.9Å; I736-F760 HydrophobicContact CG2-CZ 4.45Å
737	R	91.3	Very high	90.1	Very high	91 Å²	91	59 Å²	59	34%	0.343	33%	0.333	S	S	.	.	H	α-helix	trans	-59.1	-43.2	173.5	-172.4	-177.5	177.2	-164.9	-0.6	112.5	L733 L734 T735 L740 G741 F760	L733-R737 PolarHBondContact O-N 3.13Å; L734-R737 WeakPolarHBondContact O-CB 3.22Å; L734-R737 PolarHBondContact O-N 3.09Å; T735-R737 VanDerWaalsContact C-N 3.28Å; T735-R737 PolarHBondContact O-N 3.34Å; R737-L740 PolarHBondContact O-N 3.14Å; R737-G741 PolarHBondContact O-N 3.03Å; R737-F760 HydrophobicContact CB-CD1 4.09Å; R737-F760 HydrophobicContact CB-CD2 3.84Å; R737-F760 HydrophobicContact CB-CE1 3.89Å; R737-F760 HydrophobicContact CB-CE2 3.59Å; R737-F760 HydrophobicContact CB-CG 4.08Å; R737-F760 HydrophobicContact CB-CZ 3.64Å; R737-F760 HydrophobicContact CG-CB 4.29Å; R737-F760 HydrophobicContact CG-CD1 4.24Å; R737-F760 HydrophobicContact CG-CD2 3.63Å; R737-F760 HydrophobicContact CG-CE2 3.91Å; R737-F760 HydrophobicContact CG-CG 3.81Å; R737-F760 HydrophobicContact CG-CZ 4.37Å
738	S	91.1	Very high	90	Very high	78 Å²	78	56.6 Å²	56.6	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-65.3	-39.5	176.1	67.1	0	0	0	0	112.5	L734 T735 I736 L740 G741	L734-S738 PolarHBondContact O-N 2.71Å; T735-S738 PolarHBondContact O-N 3.46Å; T735-S738 PolarHBondContact O-OG 3.34Å; I736-S738 VanDerWaalsContact C-N 3.35Å; I736-S738 PolarHBondContact O-N 3.25Å; S738-L740 PolarHBondContact O-N 3.39Å; S738-G741 PolarHBondContact O-N 3.12Å
739	A	90.5	Very high	89.7	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.033	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-42.5	176.8	0	0	0	0	0	111.9	I677 T735 I736 G741 T742 V745	I677-A739 HydrophobicContact CG1-CB 4.47Å; I677-A739 HydrophobicContact CG2-CB 3.79Å; T735-A739 PolarHBondContact O-N 2.97Å; I736-A739 PolarHBondContact O-N 2.84Å; A739-G741 PolarHBondContact O-N 3.31Å; A739-T742 WeakPolarHBondContact O-CB 3.08Å; A739-T742 WeakPolarHBondContact O-CG2 3.3Å; A739-T742 PolarHBondContact O-N 3.21Å; A739-T742 PolarHBondContact O-OG1 2.92Å; A739-V745 WeakPolarHBondContact O-CB 3.25Å
740	L	88.5	Confident	89.3	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.3	174.8	-76.2	163.4	0	0	0	114.4	I677 I736 R737 S738 V745 A749 L756 F760	I677-L740 HydrophobicContact CD1-CD2 4.3Å; I736-L740 HydrophobicContact CG2-CD1 4.13Å; I736-L740 WeakPolarHBondContact O-CG 3.47Å; I736-L740 PolarHBondContact O-N 2.9Å; R737-L740 PolarHBondContact O-N 3.14Å; S738-L740 PolarHBondContact O-N 3.39Å; L740-V745 HydrophobicContact CD2-CG1 4.07Å; L740-A749 HydrophobicContact CD2-CB 3.89Å; L740-L756 HydrophobicContact CD1-CB 4.48Å; L740-L756 HydrophobicContact CD1-CD2 4.07Å; L740-F760 HydrophobicContact CD1-CE2 3.86Å
741	G	84.4	Confident	88.9	Confident	65 Å²	65	59.3 Å²	59.3	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.5	171.6	0	0	0	0	0	114	R737 S738 A739	R737-G741 PolarHBondContact O-N 3.03Å; S738-G741 PolarHBondContact O-N 3.12Å; A739-G741 PolarHBondContact O-N 3.31Å
742	T	89.1	Confident	88.3	Confident	63 Å²	63	57.8 Å²	57.8	39%	0.387	33%	0.33	S	S	.	.	S	Bend	trans	-76.7	142.1	178.6	70.3	0	0	0	0	111.2	A739 E744 V745 A746	A739-T742 WeakPolarHBondContact O-CB 3.08Å; A739-T742 WeakPolarHBondContact O-CG2 3.3Å; A739-T742 PolarHBondContact O-N 3.21Å; A739-T742 PolarHBondContact O-OG1 2.92Å; T742-E744 VanDerWaalsContact C-N 3.26Å; T742-E744 PolarHBondContact O-N 2.83Å; T742-V745 PolarHBondContact O-N 2.93Å; T742-V745 WeakPolarHBondContact OG1-CB 3.39Å; T742-V745 VanDerWaalsContact OG1-CG2 3.26Å; T742-V745 WeakPolarHBondContact OG1-CG2 3.38Å; T742-A746 WeakPolarHBondContact O-CB 3.17Å; T742-A746 PolarHBondContact O-N 3.06Å
743	K	85.6	Confident	87.8	Confident	180 Å²	180	55.6 Å²	55.6	78%	0.783	32%	0.321	S	S	*	.	H	α-helix	trans	-60.3	-34.7	-175.9	-171.2	-179.2	177.8	-173.9	0	113	S747	K743-S747 PolarHBondContact O-N 3.1Å; K743-S747 PolarHBondContact O-OG 3.13Å
744	E	87.3	Confident	87.3	Confident	142 Å²	142	64.8 Å²	64.8	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-73.5	-38.5	-178.6	-65.1	179	-161.1	0	0	113.6	T742 S747 K748	T742-E744 VanDerWaalsContact C-N 3.26Å; T742-E744 PolarHBondContact O-N 2.83Å; E744-S747 PolarHBondContact O-OG 2.74Å; E744-K748 WeakPolarHBondContact O-CD 3.41Å; E744-K748 WeakPolarHBondContact O-CG 3.24Å
745	V	87.5	Confident	87	Confident	4 Å²	4	64 Å²	64	2%	0.024	35%	0.351	C	S	.	.	H	α-helix	trans	-76.7	-41	175.5	177.2	0	0	0	0	109.6	I677 V685 A739 L740 T742 S747 K748 A749	I677-V745 HydrophobicContact CD1-CG1 4.16Å; I677-V745 HydrophobicContact CG1-CG1 3.72Å; V685-V745 HydrophobicContact CG1-CG1 4.12Å; A739-V745 WeakPolarHBondContact O-CB 3.25Å; L740-V745 HydrophobicContact CD2-CG1 4.07Å; T742-V745 PolarHBondContact O-N 2.93Å; T742-V745 WeakPolarHBondContact OG1-CB 3.39Å; T742-V745 VanDerWaalsContact OG1-CG2 3.26Å; T742-V745 WeakPolarHBondContact OG1-CG2 3.38Å; V745-S747 VanDerWaalsContact C-N 3.29Å; V745-S747 PolarHBondContact O-N 2.99Å; V745-K748 PolarHBondContact O-N 2.97Å; V745-K748 VanDerWaalsContact O-N 3.17Å; V745-A749 VanDerWaalsContact O-CB 3.26Å; V745-A749 WeakPolarHBondContact O-CB 3.04Å; V745-A749 PolarHBondContact O-N 3.02Å
746	A	85.6	Confident	86.7	Confident	49 Å²	49	61.6 Å²	61.6	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-61.9	-32.4	179.9	0	0	0	0	0	113.5	T742	T742-A746 WeakPolarHBondContact O-CB 3.17Å; T742-A746 PolarHBondContact O-N 3.06Å
747	S	87.5	Confident	86.3	Confident	90 Å²	90	64.6 Å²	64.6	63%	0.629	35%	0.351	S	S	*	.	H	α-helix	trans	-71.8	-40.3	174.1	63.2	0	0	0	0	112.3	K743 E744 V745	K743-S747 PolarHBondContact O-N 3.1Å; K743-S747 PolarHBondContact O-OG 3.13Å; E744-S747 PolarHBondContact O-OG 2.74Å; V745-S747 VanDerWaalsContact C-N 3.29Å; V745-S747 PolarHBondContact O-N 2.99Å
748	K	89.1	Confident	86	Confident	46 Å²	46	64.4 Å²	64.4	20%	0.2	36%	0.36	C	S	.	.	H	α-helix	trans	-73.2	-33.2	177.9	-65.5	169.6	-173.6	165.3	0	113.5	S679 T682 V685 E744 V745 G750	S679-K748 PolarHBondContact O-NZ 2.87Å; T682-K748 HydrophobicContact CG2-CB 4.3Å; T682-K748 HydrophobicContact CG2-CG 4.18Å; V685-K748 HydrophobicContact CB-CB 4.11Å; V685-K748 HydrophobicContact CG1-CB 4.05Å; V685-K748 HydrophobicContact CG2-CB 4.06Å; V685-K748 HydrophobicContact CG2-CD 4.01Å; E744-K748 WeakPolarHBondContact O-CD 3.41Å; E744-K748 WeakPolarHBondContact O-CG 3.24Å; V745-K748 PolarHBondContact O-N 2.97Å; V745-K748 VanDerWaalsContact O-N 3.17Å; K748-G750 VanDerWaalsContact C-N 3.29Å; K748-G750 PolarHBondContact O-N 3.46Å
749	A	85.2	Confident	85.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.008	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11	-177.1	0	0	0	0	0	114.1	V685 L740 V745 C752 G753	V685-A749 HydrophobicContact CG1-CB 3.89Å; L740-A749 HydrophobicContact CD2-CB 3.89Å; V745-A749 VanDerWaalsContact O-CB 3.26Å; V745-A749 WeakPolarHBondContact O-CB 3.04Å; V745-A749 PolarHBondContact O-N 3.02Å; A749-C752 PolarHBondContact O-N 3.1Å; A749-G753 PolarHBondContact O-N 3.35Å
750	G	83.4	Confident	85.6	Confident	30 Å²	30	62.6 Å²	62.6	31%	0.309	34%	0.343	S	S	.	.	H	α-helix	trans	53.3	-134.6	171.9	0	0	0	0	0	114.5	K748	K748-G750 VanDerWaalsContact C-N 3.29Å; K748-G750 PolarHBondContact O-N 3.46Å
751	Q	83.1	Confident	85.2	Confident	141 Å²	141	68.6 Å²	68.6	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-69.7	-36.9	176	178.5	172.4	-22.7	0	0	112.3	G753 R754 E755	Q751-G753 VanDerWaalsContact C-N 3.33Å; Q751-G753 PolarHBondContact O-N 2.9Å; Q751-R754 WeakPolarHBondContact O-CB 3.47Å; Q751-R754 PolarHBondContact O-N 2.98Å; Q751-E755 WeakPolarHBondContact CG-OE1 3.42Å; Q751-E755 PolarHBondContact NE2-OE1 3.16Å; Q751-E755 PolarHBondContact O-N 3.43Å
752	C	81.4	Confident	84.6	Confident	36 Å²	36	69.9 Å²	69.9	24%	0.243	36%	0.362	C	S	.	.	H	α-helix	trans	-56.6	-46.8	-178.8	-73.8	0	0	0	0	111.4	C689 A749 R754 E755 L756	C689-C752 HydrophobicContact CB-CB 3.85Å; A749-C752 PolarHBondContact O-N 3.1Å; C752-R754 VanDerWaalsContact C-N 3.28Å; C752-R754 PolarHBondContact O-N 3.4Å; C752-E755 PolarHBondContact O-N 3.28Å; C752-L756 WeakPolarHBondContact O-CB 3.05Å; C752-L756 PolarHBondContact O-N 2.77Å
753	G	82.7	Confident	83.8	Confident	6 Å²	6	67.5 Å²	67.5	6%	0.062	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-29.5	177.8	0	0	0	0	0	114.4	A749 Q751 N757	A749-G753 PolarHBondContact O-N 3.35Å; Q751-G753 VanDerWaalsContact C-N 3.33Å; Q751-G753 PolarHBondContact O-N 2.9Å; G753-N757 PolarHBondContact O-N 3.33Å; G753-N757 VanDerWaalsContact O-N 3.09Å; G753-N757 PolarHBondContact O-ND2 3.34Å
754	R	83.5	Confident	82.9	Confident	195 Å²	195	65 Å²	65	74%	0.736	35%	0.346	S	S	*	.	H	α-helix	trans	-71.1	-45.6	176.1	-63.3	179.9	-175.2	-177.6	1.4	111.6	Q751 C752 L756 N757 V758	Q751-R754 WeakPolarHBondContact O-CB 3.47Å; Q751-R754 PolarHBondContact O-N 2.98Å; C752-R754 VanDerWaalsContact C-N 3.28Å; C752-R754 PolarHBondContact O-N 3.4Å; R754-L756 VanDerWaalsContact C-N 3.28Å; R754-L756 PolarHBondContact O-N 3.43Å; R754-N757 PolarHBondContact O-N 3.38Å; R754-V758 PolarHBondContact O-N 3.45Å
755	E	84.6	Confident	82.7	Confident	65 Å²	65	61.1 Å²	61.1	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176	-66.8	179.1	-154.5	0	0	111.3	R693 Q751 C752 V758 M759	R693-E755 IonicContact CZ-OE2 4Å; R693-E755 IonicContact NH1-OE2 3.52Å; R693-E755 PolarHBondContact NH1-OE2 2.85Å; R693-E755 IonicContact NH2-OE2 2.65Å; R693-E755 PolarHBondContact NH2-OE2 2.65Å; Q751-E755 WeakPolarHBondContact CG-OE1 3.42Å; Q751-E755 PolarHBondContact NE2-OE1 3.16Å; Q751-E755 PolarHBondContact O-N 3.43Å; C752-E755 PolarHBondContact O-N 3.28Å; E755-V758 PolarHBondContact O-N 2.7Å; E755-M759 PolarHBondContact O-N 3.24Å
756	L	86.9	Confident	82.4	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-66.1	-39.5	177.9	-136.1	156.9	0	0	0	112.6	C689 V692 I696 L740 C752 R754 V758 M759 F760	C689-L756 HydrophobicContact CB-CD1 3.72Å; C689-L756 WeakPolarHBondContact O-CD1 3.24Å; V692-L756 HydrophobicContact CB-CD1 4.15Å; V692-L756 HydrophobicContact CB-CD2 4.46Å; V692-L756 HydrophobicContact CG1-CD1 4.42Å; V692-L756 HydrophobicContact CG1-CD2 3.85Å; I696-L756 HydrophobicContact CD1-CD2 3.63Å; L740-L756 HydrophobicContact CD1-CB 4.48Å; L740-L756 HydrophobicContact CD1-CD2 4.07Å; C752-L756 WeakPolarHBondContact O-CB 3.05Å; C752-L756 PolarHBondContact O-N 2.77Å; R754-L756 VanDerWaalsContact C-N 3.28Å; R754-L756 PolarHBondContact O-N 3.43Å; L756-V758 VanDerWaalsContact C-N 3.25Å; L756-V758 PolarHBondContact O-N 3.2Å; L756-M759 CarbonylContact O-C 3.57Å; L756-M759 PolarHBondContact O-N 2.92Å; L756-M759 VanDerWaalsContact O-N 3.11Å; L756-F760 HydrophobicContact CD2-CD2 3.71Å; L756-F760 HydrophobicContact CD2-CE2 3.2Å; L756-F760 HydrophobicContact CD2-CZ 3.76Å; L756-F760 VanDerWaalsContact O-CD2 3.28Å; L756-F760 WeakPolarHBondContact O-CD2 3.28Å; L756-F760 PolarHBondContact O-N 3.49Å
757	N	84.3	Confident	82.2	Confident	64 Å²	64	64.9 Å²	64.9	34%	0.342	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-32.6	172.9	-87.1	-52	0	0	0	113.1	G753 R754	G753-N757 PolarHBondContact O-N 3.33Å; G753-N757 VanDerWaalsContact O-N 3.09Å; G753-N757 PolarHBondContact O-ND2 3.34Å; R754-N757 PolarHBondContact O-N 3.38Å
758	V	85.7	Confident	81.9	Confident	88 Å²	88	63.5 Å²	63.5	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-72.6	-45	171	-178.4	0	0	0	0	110.4	R754 E755 L756 F760 Q761	R754-V758 PolarHBondContact O-N 3.45Å; E755-V758 PolarHBondContact O-N 2.7Å; L756-V758 VanDerWaalsContact C-N 3.25Å; L756-V758 PolarHBondContact O-N 3.2Å; V758-F760 PolarHBondContact O-N 3.47Å; V758-Q761 VanDerWaalsContact O-CB 3.24Å; V758-Q761 WeakPolarHBondContact O-CB 3.39Å; V758-Q761 WeakPolarHBondContact O-CG 3.47Å; V758-Q761 PolarHBondContact O-N 2.74Å
759	M	85.3	Confident	81.5	Confident	44 Å²	44	64.6 Å²	64.6	22%	0.217	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-25.3	178.2	-73.9	-168.8	166.2	0	0	114	R693 I696 E755 L756 Q761 L762	R693-M759 HydrophobicContact CG-CE 4.19Å; R693-M759 HydrophobicContact CG-SD 3.59Å; R693-M759 VanDerWaalsContact CG-SD 3.59Å; I696-M759 HydrophobicContact CG2-CB 4.13Å; E755-M759 PolarHBondContact O-N 3.24Å; L756-M759 CarbonylContact O-C 3.57Å; L756-M759 PolarHBondContact O-N 2.92Å; L756-M759 VanDerWaalsContact O-N 3.11Å; M759-Q761 PolarHBondContact O-N 3.22Å; M759-L762 WeakPolarHBondContact O-CA 3.42Å; M759-L762 WeakPolarHBondContact O-CB 3.32Å; M759-L762 PolarHBondContact O-N 3.28Å
760	F	87.1	Confident	81.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-63.7	-15.4	171.8	-85.2	-62.7	0	0	0	114.3	V692 I696 L733 I736 R737 L740 L756 V758 L762 L763 V764	V692-F760 HydrophobicContact CG1-CZ 4.31Å; I696-F760 HydrophobicContact CD1-CD1 3.86Å; I696-F760 HydrophobicContact CD1-CD2 4.44Å; I696-F760 HydrophobicContact CD1-CE1 3.68Å; I696-F760 HydrophobicContact CD1-CE2 4.32Å; I696-F760 HydrophobicContact CD1-CG 4.23Å; I696-F760 HydrophobicContact CD1-CZ 3.93Å; L733-F760 HydrophobicContact CB-CE1 4.23Å; L733-F760 HydrophobicContact CD2-CE1 4.43Å; L733-F760 VanDerWaalsContact O-CE1 3.23Å; L733-F760 WeakPolarHBondContact O-CE1 3.26Å; L733-F760 VanDerWaalsContact O-CZ 3.3Å; L733-F760 WeakPolarHBondContact O-CZ 3.46Å; I736-F760 HydrophobicContact CG2-CZ 4.45Å; R737-F760 HydrophobicContact CB-CD1 4.09Å; R737-F760 HydrophobicContact CB-CD2 3.84Å; R737-F760 HydrophobicContact CB-CE1 3.89Å; R737-F760 HydrophobicContact CB-CE2 3.59Å; R737-F760 HydrophobicContact CB-CG 4.08Å; R737-F760 HydrophobicContact CB-CZ 3.64Å; R737-F760 HydrophobicContact CG-CB 4.29Å; R737-F760 HydrophobicContact CG-CD1 4.24Å; R737-F760 HydrophobicContact CG-CD2 3.63Å; R737-F760 HydrophobicContact CG-CE2 3.91Å; R737-F760 HydrophobicContact CG-CG 3.81Å; R737-F760 HydrophobicContact CG-CZ 4.37Å; L740-F760 HydrophobicContact CD1-CE2 3.86Å; L756-F760 HydrophobicContact CD2-CD2 3.71Å; L756-F760 HydrophobicContact CD2-CE2 3.2Å; L756-F760 HydrophobicContact CD2-CZ 3.76Å; L756-F760 VanDerWaalsContact O-CD2 3.28Å; L756-F760 WeakPolarHBondContact O-CD2 3.28Å; L756-F760 PolarHBondContact O-N 3.49Å; V758-F760 PolarHBondContact O-N 3.47Å; F760-L762 PolarHBondContact O-N 3.18Å; F760-L763 HydrophobicContact CD1-CD1 3.68Å; F760-L763 HydrophobicContact CE1-CD1 3.87Å; F760-L763 PolarHBondContact O-N 3.01Å; F760-L763 VanDerWaalsContact O-N 3.11Å; F760-V764 PolarHBondContact O-N 3.33Å
761	Q	80.4	Confident	81.1	Confident	130 Å²	130	71.6 Å²	71.6	61%	0.607	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.2	-11.6	167.9	-56.9	176.8	-3.6	0	0	112.5	R704 V758 M759 L763	R704-Q761 PolarHBondContact NH2-O 3.22Å; R704-Q761 VanDerWaalsContact NH2-O 3.08Å; V758-Q761 VanDerWaalsContact O-CB 3.24Å; V758-Q761 WeakPolarHBondContact O-CB 3.39Å; V758-Q761 WeakPolarHBondContact O-CG 3.47Å; V758-Q761 PolarHBondContact O-N 2.74Å; M759-Q761 PolarHBondContact O-N 3.22Å; Q761-L763 VanDerWaalsContact C-N 3.31Å
762	L	71.7	Confident	80.9	Confident	92 Å²	92	66.2 Å²	66.2	48%	0.482	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-87.2	1	169.7	-54.5	174.3	0	0	0	112.9	I696 A700 R704 M759 F760	I696-L762 HydrophobicContact CG2-CB 4.43Å; A700-L762 WeakPolarHBondContact CB-O 3.38Å; R704-L762 PolarHBondContact NE-O 3.34Å; R704-L762 PolarHBondContact NH1-O 3.46Å; R704-L762 PolarHBondContact NH2-O 2.94Å; M759-L762 WeakPolarHBondContact O-CA 3.42Å; M759-L762 WeakPolarHBondContact O-CB 3.32Å; M759-L762 PolarHBondContact O-N 3.28Å; F760-L762 PolarHBondContact O-N 3.18Å
763	L	72.3	Confident	80.9	Confident	13 Å²	13	68.8 Å²	68.8	7%	0.068	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-42.9	172.7	-89.9	155.2	0	0	0	112.7	I696 A700 I703 R704 L730 L733 F760 Q761	I696-L763 HydrophobicContact CD1-CD1 4.05Å; I696-L763 HydrophobicContact CG1-CD1 3.79Å; I696-L763 HydrophobicContact CG2-CD1 4.28Å; A700-L763 HydrophobicContact CB-CD2 4.18Å; A700-L763 HydrophobicContact CB-CG 3.98Å; I703-L763 HydrophobicContact CG2-CD2 4.42Å; R704-L763 PolarHBondContact NE-O 3.43Å; R704-L763 VanDerWaalsContact NE-O 3.13Å; L730-L763 HydrophobicContact CD1-CD2 3.88Å; L733-L763 HydrophobicContact CB-CD1 4.3Å; L733-L763 HydrophobicContact CD1-CD1 4.04Å; L733-L763 HydrophobicContact CD1-CD2 4.25Å; F760-L763 HydrophobicContact CD1-CD1 3.68Å; F760-L763 HydrophobicContact CE1-CD1 3.87Å; F760-L763 PolarHBondContact O-N 3.01Å; F760-L763 VanDerWaalsContact O-N 3.11Å; Q761-L763 VanDerWaalsContact C-N 3.31Å
764	V	65.9	Low	80.7	Confident	126 Å²	126	74.5 Å²	74.5	76%	0.764	37%	0.369	S	S	*	.			trans	-71.3	0	173.5	-174.9	0	0	0	0	110.9	R704 F760	R704-V764 PolarHBondContact NH2-OXT 3.03Å; F760-V764 PolarHBondContact O-N 3.33Å

Retrieved 764 of 764 residues in 1134.5 ms (Link to these results)

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