A0A3Q0KCP9_SCHMA Loading...

Fragile X related 2, frx2 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KCP9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 777 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	79.2	Confident	86.1	Confident	162 Å²	162	36.3 Å²	36.3	80%	0.798	20%	0.195	S	C	*	.				0	145.3	0	-72.3	-171.4	-71.7	0	0	108.6	V17 V206	M1-V17 HydrophobicContact CB-CG1 3.8Å; M1-V17 HydrophobicContact CG-CG1 4.17Å; M1-V17 HydrophobicContact SD-CG1 3.92Å; M1-V206 CarbonylContact C-O 3.42Å; M1-V206 WeakPolarHBondContact CA-O 3.44Å; M1-V206 PolarHBondContact N-O 2.95Å
2	I	84.1	Confident	86.2	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.1	176.3	-62	159.1	0	0	0	107.9	I4 V17 L18 L46 P205 L220 T222	I2-I4 HydrophobicContact CG2-CG2 4.15Å; I2-V17 WeakPolarHBondContact O-CA 3.47Å; I2-L18 HydrophobicContact CB-CB 4.16Å; I2-L18 HydrophobicContact CB-CD2 4.26Å; I2-L18 HydrophobicContact CD1-CD2 3.74Å; I2-L18 HydrophobicContact CG2-CB 4.36Å; I2-L18 HydrophobicContact CG2-CD2 4.18Å; I2-L18 PolarHBondContact O-N 3.45Å; I2-L46 HydrophobicContact CG2-CD2 4.38Å; I2-P205 HydrophobicContact CG1-CB 4.13Å; I2-P205 WeakPolarHBondContact CG1-O 3.2Å; I2-L220 HydrophobicContact CD1-CB 4.32Å; I2-L220 WeakPolarHBondContact CD1-O 3.27Å; I2-T222 HydrophobicContact CD1-CG2 4.4Å; I2-T222 HydrophobicContact CG2-CG2 4.29Å
3	G	86.3	Confident	86.5	Confident	38 Å²	38	34.4 Å²	34.4	39%	0.392	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.1	172.7	0	0	0	0	0	110.7	P47	G3-P47 WeakPolarHBondContact O-CD 3.25Å
4	I	89.7	Confident	86.8	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	165.5	-177.2	52.8	166	0	0	0	110.1	I2 V6 A16 L18 V28 V44 L46 L169	I2-I4 HydrophobicContact CG2-CG2 4.15Å; I4-V6 HydrophobicContact CD1-CG2 4.18Å; I4-A16 HydrophobicContact CD1-CB 4.13Å; I4-A16 VanDerWaalsContact CG1-C 3.5Å; I4-A16 HydrophobicContact CG1-CB 3.97Å; I4-A16 WeakPolarHBondContact CG1-O 3.21Å; I4-A16 PolarHBondContact N-O 3.28Å; I4-A16 PolarHBondContact O-N 3.37Å; I4-A16 VanDerWaalsContact O-O 3.11Å; I4-L18 HydrophobicContact CD1-CB 4.08Å; I4-L18 HydrophobicContact CG1-CB 4.47Å; I4-L18 HydrophobicContact CG2-CB 4.03Å; I4-V28 HydrophobicContact CD1-CB 3.95Å; I4-V28 HydrophobicContact CD1-CG1 3.46Å; I4-V28 VanDerWaalsContact CD1-CG1 3.46Å; I4-V44 HydrophobicContact CB-CG1 3.77Å; I4-V44 HydrophobicContact CD1-CG1 3.71Å; I4-V44 HydrophobicContact CG1-CG1 4.26Å; I4-V44 HydrophobicContact CG2-CG1 4.11Å; I4-L46 HydrophobicContact CG2-CD2 4.45Å; I4-L169 HydrophobicContact CG2-CD1 4.08Å
5	E	91.2	Very high	87	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.8	171	-65.8	-175.8	176.8	0	0	110.1	Y13 I14 V44 R45 P47 R160	E5-Y13 HydrophobicContact CB-CD1 4.24Å; E5-I14 CarbonylContact C-O 3.57Å; E5-I14 WeakPolarHBondContact CA-O 3.47Å; E5-V44 WeakPolarHBondContact O-CA 3.17Å; E5-R45 HydrophobicContact CB-CG 3.97Å; E5-R45 PolarHBondContact N-O 3.2Å; E5-R45 PolarHBondContact O-N 3.05Å; E5-R45 IonicContact OE2-CZ 3.07Å; E5-R45 IonicContact OE2-NE 2.94Å; E5-R45 PolarHBondContact OE2-NE 2.85Å; E5-R45 IonicContact OE2-NH2 2.72Å; E5-R45 PolarHBondContact OE2-NH2 3.06Å; E5-P47 HydrophobicContact CG-CB 4.4Å; E5-P47 HydrophobicContact CG-CG 4.22Å; E5-R160 IonicContact OE1-CZ 3.23Å; E5-R160 VanDerWaalsContact OE1-CZ 3.27Å; E5-R160 IonicContact OE1-NH1 3.95Å; E5-R160 PolarHBondContact OE1-NH1 2.89Å; E5-R160 IonicContact OE1-NH2 2.69Å; E5-R160 PolarHBondContact OE1-NH2 3.23Å; E5-R160 IonicContact OE2-CZ 3.44Å; E5-R160 IonicContact OE2-NH1 3.89Å; E5-R160 IonicContact OE2-NH2 2.6Å; E5-R160 PolarHBondContact OE2-NH2 2.69Å
6	V	90.3	Very high	87.3	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.6	-175.9	-176.3	0	0	0	0	109.4	I4 G8 Y13 I14 A16 V28 Y30 V39 V44	I4-V6 HydrophobicContact CD1-CG2 4.18Å; V6-G8 PolarHBondContact O-N 3.22Å; V6-Y13 CarbonylContact O-C 3.6Å; V6-Y13 WeakPolarHBondContact O-CA 3.06Å; V6-I14 PolarHBondContact N-O 2.7Å; V6-I14 PolarHBondContact O-N 2.68Å; V6-A16 HydrophobicContact CG2-CB 3.73Å; V6-V28 HydrophobicContact CG2-CB 4.16Å; V6-V28 HydrophobicContact CG2-CG1 3.91Å; V6-V28 HydrophobicContact CG2-CG2 4.14Å; V6-Y30 HydrophobicContact CB-CE1 4.31Å; V6-Y30 WeakPolarHBondContact CG1-OH 3.12Å; V6-Y30 HydrophobicContact CG2-CE1 4.29Å; V6-V39 HydrophobicContact CG1-CB 4.47Å; V6-V39 HydrophobicContact CG1-CG1 3.91Å; V6-V39 HydrophobicContact CG1-CG2 4.15Å; V6-V44 HydrophobicContact CG2-CG1 4.48Å; V6-V44 HydrophobicContact CG2-CG2 4.41Å
7	K	88.8	Confident	87.4	Confident	69 Å²	69	35.5 Å²	35.5	30%	0.3	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	105.5	179.6	-169.1	-179.2	179.4	-173.7	0	110.5	N11 Y13 N43	K7-N11 WeakPolarHBondContact CE-OD1 3.27Å; K7-N11 PolarHBondContact NZ-OD1 2.88Å; K7-Y13 HydrophobicContact CB-CD1 4.14Å; K7-Y13 HydrophobicContact CB-CE1 3.73Å; K7-Y13 HydrophobicContact CD-CE1 4.43Å; K7-Y13 HydrophobicContact CG-CE1 4.03Å; K7-N43 HydrophobicContact CB-CB 4.22Å; K7-N43 VanDerWaalsContact CB-O 3.24Å; K7-N43 WeakPolarHBondContact CB-O 3.32Å; K7-N43 PolarHBondContact N-O 2.78Å
8	G	86.3	Confident	87.5	Confident	13 Å²	13	33.5 Å²	33.5	13%	0.134	17%	0.17	C	C	.	.			trans	-70.9	168.2	172.9	0	0	0	0	0	113.2	V6 L10 N11 Q12	V6-G8 PolarHBondContact O-N 3.22Å; G8-L10 PolarHBondContact O-N 2.84Å; G8-L10 VanDerWaalsContact O-N 3.13Å; G8-N11 PolarHBondContact O-N 3.06Å; G8-Q12 VanDerWaalsContact C-OE1 3.32Å; G8-Q12 PolarHBondContact N-O 2.85Å
9	R	83.3	Confident	87.4	Confident	67 Å²	67	36.5 Å²	36.5	25%	0.253	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.8	-172	178.6	58.6	-179	163.4	4.5	114.6	D135 E140	R9-D135 PolarHBondContact NH2-O 3.47Å; R9-E140 WeakPolarHBondContact CG-OE1 3.43Å; R9-E140 IonicContact CZ-OE1 3.37Å; R9-E140 IonicContact CZ-OE2 3.69Å; R9-E140 IonicContact NE-OE1 2.67Å; R9-E140 PolarHBondContact NE-OE1 2.76Å; R9-E140 IonicContact NE-OE2 3.77Å; R9-E140 IonicContact NH2-OE1 3.22Å; R9-E140 PolarHBondContact NH2-OE1 3.22Å; R9-E140 IonicContact NH2-OE2 2.76Å; R9-E140 PolarHBondContact NH2-OE2 3.04Å
10	L	84	Confident	87.3	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	23.5	-179.2	-51.3	-173.5	0	0	0	112.9	G8 Q12 L103 L106 W112 V130 E140 L143 L147	G8-L10 PolarHBondContact O-N 2.84Å; G8-L10 VanDerWaalsContact O-N 3.13Å; L10-Q12 PolarHBondContact O-N 2.95Å; L10-L103 HydrophobicContact CD1-CD2 4.43Å; L10-L103 HydrophobicContact CD2-CD2 4.34Å; L10-L103 HydrophobicContact CG-CD2 4.38Å; L10-L106 HydrophobicContact CD1-CD2 3.76Å; L10-L106 HydrophobicContact CG-CD2 4.38Å; L10-W112 HydrophobicContact CB-CH2 4.22Å; L10-W112 HydrophobicContact CB-CZ3 3.98Å; L10-W112 HydrophobicContact CD1-CH2 4.22Å; L10-W112 HydrophobicContact CD1-CZ3 4.45Å; L10-V130 HydrophobicContact CB-CG1 4.4Å; L10-V130 WeakPolarHBondContact O-CG1 3.12Å; L10-E140 HydrophobicContact CD2-CB 4.37Å; L10-E140 HydrophobicContact CD2-CG 4.3Å; L10-L143 HydrophobicContact CD1-CD1 4.18Å; L10-L143 HydrophobicContact CD1-CD2 3.56Å; L10-L143 HydrophobicContact CD1-CG 4.48Å; L10-L147 HydrophobicContact CD1-CD1 4.25Å
11	N	83.6	Confident	87.2	Confident	39 Å²	39	35.2 Å²	35.2	21%	0.209	17%	0.174	C	C	.	.	S	Bend	trans	64	16.1	-175.9	-55.3	-76	0	0	0	115.1	K7 G8 T131	K7-N11 WeakPolarHBondContact CE-OD1 3.27Å; K7-N11 PolarHBondContact NZ-OD1 2.88Å; G8-N11 PolarHBondContact O-N 3.06Å; N11-T131 PolarHBondContact ND2-O 2.97Å
12	Q	88	Confident	87.4	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.023	15%	0.15	C	C	.	.			trans	-78	150	168.4	81.4	-77	23.7	0	0	111.4	G8 L10 I14 W112	G8-Q12 VanDerWaalsContact C-OE1 3.32Å; G8-Q12 PolarHBondContact N-O 2.85Å; L10-Q12 PolarHBondContact O-N 2.95Å; Q12-I14 HydrophobicContact CG-CG1 4.3Å; Q12-W112 HydrophobicContact CB-CD2 3.63Å; Q12-W112 HydrophobicContact CB-CE3 3.69Å; Q12-W112 HydrophobicContact CB-CG 4.28Å; Q12-W112 HydrophobicContact CB-CH2 3.82Å; Q12-W112 HydrophobicContact CB-CZ2 3.77Å; Q12-W112 HydrophobicContact CB-CZ3 3.78Å; Q12-W112 HydrophobicContact CG-CH2 3.92Å; Q12-W112 HydrophobicContact CG-CZ2 3.77Å; Q12-W112 HydrophobicContact CG-CZ3 4.37Å
13	Y	89.9	Confident	87.2	Confident	43 Å²	43	36.6 Å²	36.6	17%	0.169	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	108.9	177.7	-73.9	-85.4	0	0	0	111.6	E5 V6 K7 R45 S110 W111	E5-Y13 HydrophobicContact CB-CD1 4.24Å; V6-Y13 CarbonylContact O-C 3.6Å; V6-Y13 WeakPolarHBondContact O-CA 3.06Å; K7-Y13 HydrophobicContact CB-CD1 4.14Å; K7-Y13 HydrophobicContact CB-CE1 3.73Å; K7-Y13 HydrophobicContact CD-CE1 4.43Å; K7-Y13 HydrophobicContact CG-CE1 4.03Å; Y13-R45 HydrophobicContact CD1-CG 4.17Å; Y13-R45 HydrophobicContact CE1-CG 4.01Å; Y13-S110 WeakPolarHBondContact O-CA 3.31Å; Y13-W111 PolarHBondContact N-O 2.61Å; Y13-W111 PolarHBondContact O-N 3.16Å
14	I	90.5	Very high	87.1	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.3	-179.4	-54.1	157.6	0	0	0	108.8	E5 V6 Q12 Y30 Y105 I108 S110	E5-I14 CarbonylContact C-O 3.57Å; E5-I14 WeakPolarHBondContact CA-O 3.47Å; V6-I14 PolarHBondContact N-O 2.7Å; V6-I14 PolarHBondContact O-N 2.68Å; Q12-I14 HydrophobicContact CG-CG1 4.3Å; I14-Y30 HydrophobicContact CB-CE1 4.08Å; I14-Y30 HydrophobicContact CG2-CD1 3.67Å; I14-Y30 HydrophobicContact CG2-CE1 3.53Å; I14-Y105 HydrophobicContact CD1-CG 4.22Å; I14-I108 HydrophobicContact CG2-CB 4.31Å; I14-I108 HydrophobicContact CG2-CD1 4.12Å; I14-I108 HydrophobicContact CG2-CG2 3.84Å; I14-S110 WeakPolarHBondContact CG1-OG 3.13Å
15	K	90.2	Very high	86.9	Confident	135 Å²	135	45 Å²	45	59%	0.587	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.4	178.3	-175.2	179.7	177.7	-177.4	0	111.3
16	A	90.7	Very high	86.8	Confident	2 Å²	2	44.8 Å²	44.8	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	-179.5	-179.1	0	0	0	0	0	112.5	I4 V6 V28 F29 Y30	I4-A16 HydrophobicContact CD1-CB 4.13Å; I4-A16 VanDerWaalsContact CG1-C 3.5Å; I4-A16 HydrophobicContact CG1-CB 3.97Å; I4-A16 WeakPolarHBondContact CG1-O 3.21Å; I4-A16 PolarHBondContact N-O 3.28Å; I4-A16 PolarHBondContact O-N 3.37Å; I4-A16 VanDerWaalsContact O-O 3.11Å; V6-A16 HydrophobicContact CG2-CB 3.73Å; A16-V28 HydrophobicContact CB-CB 4.26Å; A16-F29 CarbonylContact C-O 3.53Å; A16-F29 WeakPolarHBondContact CA-O 3.46Å; A16-F29 WeakPolarHBondContact CB-O 3.31Å; A16-Y30 HydrophobicContact CB-CD1 3.73Å; A16-Y30 HydrophobicContact CB-CE1 3.77Å
17	V	89.1	Confident	86.7	Confident	18 Å²	18	46.4 Å²	46.4	11%	0.109	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.9	174.5	173	0	0	0	0	109.7	M1 I2 R19 V28 F29 P31	M1-V17 HydrophobicContact CB-CG1 3.8Å; M1-V17 HydrophobicContact CG-CG1 4.17Å; M1-V17 HydrophobicContact SD-CG1 3.92Å; I2-V17 WeakPolarHBondContact O-CA 3.47Å; V17-R19 PolarHBondContact O-N 3.29Å; V17-V28 CarbonylContact O-C 3.59Å; V17-V28 WeakPolarHBondContact O-CA 3.44Å; V17-F29 HydrophobicContact CB-CD1 4.42Å; V17-F29 PolarHBondContact N-O 2.8Å; V17-F29 PolarHBondContact O-N 2.8Å; V17-P31 HydrophobicContact CG2-CG 4.08Å
18	L	89.3	Confident	86.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	116.9	172.2	163.4	61.8	0	0	0	109.5	I2 I4 N20 V21 V26 I174 S207 L220	I2-L18 HydrophobicContact CB-CB 4.16Å; I2-L18 HydrophobicContact CB-CD2 4.26Å; I2-L18 HydrophobicContact CD1-CD2 3.74Å; I2-L18 HydrophobicContact CG2-CB 4.36Å; I2-L18 HydrophobicContact CG2-CD2 4.18Å; I2-L18 PolarHBondContact O-N 3.45Å; I4-L18 HydrophobicContact CD1-CB 4.08Å; I4-L18 HydrophobicContact CG1-CB 4.47Å; I4-L18 HydrophobicContact CG2-CB 4.03Å; L18-N20 WeakPolarHBondContact CD1-O 3.36Å; L18-V21 HydrophobicContact CD1-CG2 3.94Å; L18-V26 HydrophobicContact CD1-CG1 3.39Å; L18-I174 HydrophobicContact CD2-CD1 4.31Å; L18-I174 HydrophobicContact CD2-CG2 4.48Å; L18-S207 VanDerWaalsContact O-CB 3.23Å; L18-S207 WeakPolarHBondContact O-CB 3.47Å; L18-S207 PolarHBondContact O-OG 3.3Å; L18-L220 HydrophobicContact CD1-CD1 4.39Å; L18-L220 HydrophobicContact CG-CD1 4.42Å
19	R	86.1	Confident	86.9	Confident	91 Å²	91	43 Å²	43	34%	0.343	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-50.5	171	-75.4	-170.1	-179.7	-144.1	2.1	112.1	V17 I27 F29 E36 Y209	V17-R19 PolarHBondContact O-N 3.29Å; R19-I27 PolarHBondContact N-O 3.31Å; R19-F29 HydrophobicContact CG-CB 3.88Å; R19-F29 VanDerWaalsContact NE-CB 3.28Å; R19-F29 VanDerWaalsContact NE-CG 3.3Å; R19-E36 WeakPolarHBondContact CD-OE1 3.45Å; R19-E36 IonicContact CZ-OE1 3.76Å; R19-E36 IonicContact NE-OE1 3.34Å; R19-E36 PolarHBondContact NE-OE1 2.79Å; R19-E36 IonicContact NH1-OE1 2.98Å; R19-E36 PolarHBondContact NH1-OE1 3.35Å; R19-Y209 WeakPolarHBondContact O-CD1 3.22Å
20	N	85.2	Confident	87.2	Confident	26 Å²	26	40 Å²	40	14%	0.139	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.1	-175	-166.3	10.3	0	0	0	112.5	L18 I27 Y209	L18-N20 WeakPolarHBondContact CD1-O 3.36Å; N20-I27 HydrophobicContact CB-CB 3.96Å; N20-I27 HydrophobicContact CB-CD1 4.01Å; N20-I27 HydrophobicContact CB-CG1 4.07Å; N20-I27 PolarHBondContact N-O 2.83Å; N20-I27 PolarHBondContact O-N 2.95Å; N20-Y209 HydrophobicContact CB-CD1 4.41Å; N20-Y209 HydrophobicContact CB-CE1 3.87Å; N20-Y209 VanDerWaalsContact CG-CE1 3.47Å; N20-Y209 VanDerWaalsContact CG-CZ 3.44Å; N20-Y209 VanDerWaalsContact CG-OH 3.22Å; N20-Y209 PolarHBondContact ND2-OH 3.43Å; N20-Y209 WeakPolarHBondContact OD1-CE1 3.36Å; N20-Y209 PolarHBondContact OD1-OH 3.45Å
21	V	84.5	Confident	87.1	Confident	19 Å²	19	43.1 Å²	43.1	12%	0.115	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.6	168.7	-174.6	0	0	0	0	108.8	L18 I174 R176 L220	L18-V21 HydrophobicContact CD1-CG2 3.94Å; V21-I174 HydrophobicContact CG2-CD1 3.89Å; V21-I174 HydrophobicContact CG2-CG2 4.13Å; V21-R176 PolarHBondContact O-NH1 3.06Å; V21-R176 VanDerWaalsContact O-NH1 3.14Å; V21-L220 HydrophobicContact CG2-CD1 4.33Å
22	V	83.7	Confident	87	Confident	48 Å²	48	47 Å²	47	29%	0.291	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	99.2	-176.8	-176.9	0	0	0	0	107.2	E24 N25 I27	V22-E24 PolarHBondContact O-N 3.31Å; V22-N25 CarbonylContact C-O 3.32Å; V22-N25 PolarHBondContact N-O 3.36Å; V22-N25 CarbonylContact O-C 3.59Å; V22-N25 WeakPolarHBondContact O-CA 3.48Å; V22-N25 WeakPolarHBondContact O-CB 3.38Å; V22-N25 PolarHBondContact O-N 2.55Å; V22-N25 VanDerWaalsContact O-O 3.07Å; V22-I27 HydrophobicContact CG2-CD1 4.12Å; V22-I27 HydrophobicContact CG2-CG1 4.3Å
23	D	80.3	Confident	86.6	Confident	147 Å²	147	49.8 Å²	49.8	79%	0.786	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	-121	-176.2	-48.7	-40.8	0	0	0	112.2	N25	D23-N25 VanDerWaalsContact C-N 3.26Å; D23-N25 PolarHBondContact O-N 3.47Å
24	E	83.3	Confident	86.3	Confident	161 Å²	161	52.5 Å²	52.5	75%	0.752	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.9	176.8	-60.2	-171.9	172.6	0	0	113.8	V22 I41	V22-E24 PolarHBondContact O-N 3.31Å; E24-I41 WeakPolarHBondContact O-CB 3.21Å; E24-I41 WeakPolarHBondContact O-CG2 3.31Å; E24-I41 PolarHBondContact O-N 3.09Å
25	N	87.3	Confident	85.9	Confident	53 Å²	53	56.5 Å²	56.5	28%	0.283	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	155.6	-175.9	-70.2	-28.8	0	0	0	112.3	V22 D23 Q38 P40	V22-N25 CarbonylContact C-O 3.32Å; V22-N25 PolarHBondContact N-O 3.36Å; V22-N25 CarbonylContact O-C 3.59Å; V22-N25 WeakPolarHBondContact O-CA 3.48Å; V22-N25 WeakPolarHBondContact O-CB 3.38Å; V22-N25 PolarHBondContact O-N 2.55Å; V22-N25 VanDerWaalsContact O-O 3.07Å; D23-N25 VanDerWaalsContact C-N 3.26Å; D23-N25 PolarHBondContact O-N 3.47Å; N25-Q38 HydrophobicContact CB-CG 3.72Å; N25-Q38 PolarHBondContact ND2-NE2 2.87Å; N25-P40 VanDerWaalsContact OD1-CA 3.31Å; N25-P40 WeakPolarHBondContact OD1-CA 3.47Å
26	V	87.8	Confident	85.8	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.2	179.1	-179.9	0	0	0	0	108.7	L18 V28 Q38 V39 I41 V44	L18-V26 HydrophobicContact CD1-CG1 3.39Å; V26-V28 HydrophobicContact CB-CG1 4.26Å; V26-V28 HydrophobicContact CG1-CG1 3.68Å; V26-Q38 CarbonylContact O-C 3.49Å; V26-Q38 WeakPolarHBondContact O-CA 3.41Å; V26-V39 PolarHBondContact N-O 3.19Å; V26-V39 PolarHBondContact O-N 2.88Å; V26-I41 HydrophobicContact CG2-CB 3.83Å; V26-I41 HydrophobicContact CG2-CD1 4.29Å; V26-I41 HydrophobicContact CG2-CG1 3.66Å; V26-V44 HydrophobicContact CB-CG2 4.47Å
27	I	89.4	Confident	85.6	Confident	38 Å²	38	57.6 Å²	57.6	20%	0.195	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	112.2	166	-51.7	-174.7	0	0	0	107.6	R19 N20 V22 E36 E37	R19-I27 PolarHBondContact N-O 3.31Å; N20-I27 HydrophobicContact CB-CB 3.96Å; N20-I27 HydrophobicContact CB-CD1 4.01Å; N20-I27 HydrophobicContact CB-CG1 4.07Å; N20-I27 PolarHBondContact N-O 2.83Å; N20-I27 PolarHBondContact O-N 2.95Å; V22-I27 HydrophobicContact CG2-CD1 4.12Å; V22-I27 HydrophobicContact CG2-CG1 4.3Å; I27-E36 HydrophobicContact CG2-CB 4.33Å; I27-E36 WeakPolarHBondContact CG2-OE2 3.4Å; I27-E37 WeakPolarHBondContact CA-O 3.46Å
28	V	90.5	Very high	85.6	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	152.1	179.1	-52.4	0	0	0	0	109.5	I4 V6 A16 V17 V26 Y30 E36 E37 V39 V44	I4-V28 HydrophobicContact CD1-CB 3.95Å; I4-V28 HydrophobicContact CD1-CG1 3.46Å; I4-V28 VanDerWaalsContact CD1-CG1 3.46Å; V6-V28 HydrophobicContact CG2-CB 4.16Å; V6-V28 HydrophobicContact CG2-CG1 3.91Å; V6-V28 HydrophobicContact CG2-CG2 4.14Å; A16-V28 HydrophobicContact CB-CB 4.26Å; V17-V28 CarbonylContact O-C 3.59Å; V17-V28 WeakPolarHBondContact O-CA 3.44Å; V26-V28 HydrophobicContact CB-CG1 4.26Å; V26-V28 HydrophobicContact CG1-CG1 3.68Å; V28-Y30 HydrophobicContact CG2-CE2 3.97Å; V28-E36 CarbonylContact O-C 3.53Å; V28-E36 VanDerWaalsContact O-CA 3.28Å; V28-E36 WeakPolarHBondContact O-CA 3.43Å; V28-E37 HydrophobicContact CG2-CB 3.93Å; V28-E37 WeakPolarHBondContact CG2-O 3.42Å; V28-E37 PolarHBondContact N-O 2.88Å; V28-E37 PolarHBondContact O-N 2.8Å; V28-V39 HydrophobicContact CG1-CG2 4.5Å; V28-V39 HydrophobicContact CG2-CG2 3.78Å; V28-V44 HydrophobicContact CG1-CG2 4.39Å
29	F	88.8	Confident	85.6	Confident	11 Å²	11	62.4 Å²	62.4	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.6	176.5	170.9	-106	0	0	0	110.2	A16 V17 R19 P31 N34 E35 E36	A16-F29 CarbonylContact C-O 3.53Å; A16-F29 WeakPolarHBondContact CA-O 3.46Å; A16-F29 WeakPolarHBondContact CB-O 3.31Å; V17-F29 HydrophobicContact CB-CD1 4.42Å; V17-F29 PolarHBondContact N-O 2.8Å; V17-F29 PolarHBondContact O-N 2.8Å; R19-F29 HydrophobicContact CG-CB 3.88Å; R19-F29 VanDerWaalsContact NE-CB 3.28Å; R19-F29 VanDerWaalsContact NE-CG 3.3Å; F29-P31 HydrophobicContact CD1-CG 4.24Å; F29-P31 HydrophobicContact CE1-CB 4.22Å; F29-P31 HydrophobicContact CE1-CG 4.2Å; F29-P31 WeakPolarHBondContact O-CD 3.36Å; F29-N34 WeakPolarHBondContact CE2-OD1 3.23Å; F29-N34 VanDerWaalsContact CZ-OD1 3.29Å; F29-N34 WeakPolarHBondContact CZ-OD1 3.23Å; F29-E35 WeakPolarHBondContact CA-O 3.38Å; F29-E35 VanDerWaalsContact CD2-O 3.24Å; F29-E35 WeakPolarHBondContact CD2-O 3.34Å; F29-E36 HydrophobicContact CB-CG 4.29Å; F29-E36 HydrophobicContact CD2-CG 3.9Å
30	Y	88.7	Confident	85.7	Confident	3 Å²	3	60.2 Å²	60.2	1%	0.012	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	104.5	179.8	-62	-70	0	0	0	109.9	V6 I14 A16 V28 E32 K33 N34 E35 E37 Y105	V6-Y30 HydrophobicContact CB-CE1 4.31Å; V6-Y30 WeakPolarHBondContact CG1-OH 3.12Å; V6-Y30 HydrophobicContact CG2-CE1 4.29Å; I14-Y30 HydrophobicContact CB-CE1 4.08Å; I14-Y30 HydrophobicContact CG2-CD1 3.67Å; I14-Y30 HydrophobicContact CG2-CE1 3.53Å; A16-Y30 HydrophobicContact CB-CD1 3.73Å; A16-Y30 HydrophobicContact CB-CE1 3.77Å; V28-Y30 HydrophobicContact CG2-CE2 3.97Å; Y30-E32 PolarHBondContact O-N 2.72Å; Y30-K33 PolarHBondContact O-N 3Å; Y30-N34 PolarHBondContact O-N 3.29Å; Y30-E35 PolarHBondContact N-O 2.81Å; Y30-E37 HydrophobicContact CE2-CB 3.8Å; Y30-E37 VanDerWaalsContact CE2-OE2 3.32Å; Y30-E37 WeakPolarHBondContact CE2-OE2 3.46Å; Y30-E37 PolarHBondContact OH-OE2 3.36Å; Y30-Y105 HydrophobicContact CD2-CE1 4.06Å; Y30-Y105 HydrophobicContact CE2-CD1 4.44Å; Y30-Y105 AromaticContact CE2-CE1 3.81Å; Y30-Y105 HydrophobicContact CE2-CE1 3.81Å
31	P	83.1	Confident	85.7	Confident	65 Å²	65	60 Å²	60	42%	0.422	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.1	-171.9	-22.7	35.2	0	0	0	114.7	V17 F29	V17-P31 HydrophobicContact CG2-CG 4.08Å; F29-P31 HydrophobicContact CD1-CG 4.24Å; F29-P31 HydrophobicContact CE1-CB 4.22Å; F29-P31 HydrophobicContact CE1-CG 4.2Å; F29-P31 WeakPolarHBondContact O-CD 3.36Å
32	E	81.4	Confident	85.7	Confident	121 Å²	121	66.1 Å²	66.1	57%	0.565	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-26.8	-178.3	-60	-172.4	-158.3	0	0	113.2	Y30 P109	Y30-E32 PolarHBondContact O-N 2.72Å; E32-P109 WeakPolarHBondContact OE2-CD 3.25Å
33	K	79.6	Confident	85.9	Confident	64 Å²	64	66.5 Å²	66.5	28%	0.278	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-19.1	172.8	-76.4	-161.6	176.1	-173.1	0	113.8	Y30 E35 N104 Y105 I108	Y30-K33 PolarHBondContact O-N 3Å; K33-E35 HydrophobicContact CB-CB 4.07Å; K33-E35 HydrophobicContact CB-CG 3.96Å; K33-E35 HydrophobicContact CD-CG 4.29Å; K33-E35 WeakPolarHBondContact CD-OE2 3.5Å; K33-E35 IonicContact NZ-OE1 3.09Å; K33-E35 IonicContact NZ-OE2 2.75Å; K33-E35 PolarHBondContact NZ-OE2 2.86Å; K33-E35 PolarHBondContact O-N 3.3Å; K33-N104 WeakPolarHBondContact CE-O 3.19Å; K33-N104 PolarHBondContact NZ-O 3.49Å; K33-N104 VanDerWaalsContact NZ-O 3.13Å; K33-Y105 HydrophobicContact CD-CD1 4.31Å; K33-Y105 HydrophobicContact CD-CE1 4.35Å; K33-I108 HydrophobicContact CD-CD1 4.15Å; K33-I108 HydrophobicContact CG-CD1 4Å; K33-I108 HydrophobicContact CG-CG1 4.46Å
34	N	82.8	Confident	86.3	Confident	100 Å²	100	59.5 Å²	59.5	54%	0.535	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	26.6	-167	-159.7	48.1	0	0	0	113.5	F29 Y30 Y775	F29-N34 WeakPolarHBondContact CE2-OD1 3.23Å; F29-N34 VanDerWaalsContact CZ-OD1 3.29Å; F29-N34 WeakPolarHBondContact CZ-OD1 3.23Å; Y30-N34 PolarHBondContact O-N 3.29Å; N34-Y775 PolarHBondContact OD1-OH 3.21Å
35	E	83.2	Confident	86.5	Confident	84 Å²	84	52.2 Å²	52.2	39%	0.393	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.7	179.8	-75.5	173.1	-172.5	0	0	112	F29 Y30 K33	F29-E35 WeakPolarHBondContact CA-O 3.38Å; F29-E35 VanDerWaalsContact CD2-O 3.24Å; F29-E35 WeakPolarHBondContact CD2-O 3.34Å; Y30-E35 PolarHBondContact N-O 2.81Å; K33-E35 HydrophobicContact CB-CB 4.07Å; K33-E35 HydrophobicContact CB-CG 3.96Å; K33-E35 HydrophobicContact CD-CG 4.29Å; K33-E35 WeakPolarHBondContact CD-OE2 3.5Å; K33-E35 IonicContact NZ-OE1 3.09Å; K33-E35 IonicContact NZ-OE2 2.75Å; K33-E35 PolarHBondContact NZ-OE2 2.86Å; K33-E35 PolarHBondContact O-N 3.3Å
36	E	86.7	Confident	86.5	Confident	104 Å²	104	52.1 Å²	52.1	49%	0.486	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	143	166.2	-69.5	-169.9	-149.7	0	0	110.9	R19 I27 V28 F29	R19-E36 WeakPolarHBondContact CD-OE1 3.45Å; R19-E36 IonicContact CZ-OE1 3.76Å; R19-E36 IonicContact NE-OE1 3.34Å; R19-E36 PolarHBondContact NE-OE1 2.79Å; R19-E36 IonicContact NH1-OE1 2.98Å; R19-E36 PolarHBondContact NH1-OE1 3.35Å; I27-E36 HydrophobicContact CG2-CB 4.33Å; I27-E36 WeakPolarHBondContact CG2-OE2 3.4Å; V28-E36 CarbonylContact O-C 3.53Å; V28-E36 VanDerWaalsContact O-CA 3.28Å; V28-E36 WeakPolarHBondContact O-CA 3.43Å; F29-E36 HydrophobicContact CB-CG 4.29Å; F29-E36 HydrophobicContact CD2-CG 3.9Å
37	E	87	Confident	86.3	Confident	57 Å²	57	54.5 Å²	54.5	27%	0.266	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.8	177.6	-174.9	179.6	-130.7	0	0	110.3	I27 V28 Y30 V39 Y105	I27-E37 WeakPolarHBondContact CA-O 3.46Å; V28-E37 HydrophobicContact CG2-CB 3.93Å; V28-E37 WeakPolarHBondContact CG2-O 3.42Å; V28-E37 PolarHBondContact N-O 2.88Å; V28-E37 PolarHBondContact O-N 2.8Å; Y30-E37 HydrophobicContact CE2-CB 3.8Å; Y30-E37 VanDerWaalsContact CE2-OE2 3.32Å; Y30-E37 WeakPolarHBondContact CE2-OE2 3.46Å; Y30-E37 PolarHBondContact OH-OE2 3.36Å; E37-V39 HydrophobicContact CB-CG2 4.19Å; E37-V39 HydrophobicContact CG-CG2 3.64Å; E37-V39 WeakPolarHBondContact OE2-CG2 3.5Å; E37-Y105 VanDerWaalsContact OE1-CE2 3.27Å; E37-Y105 WeakPolarHBondContact OE1-CE2 3.45Å; E37-Y105 VanDerWaalsContact OE1-CZ 3.3Å; E37-Y105 PolarHBondContact OE1-OH 3.2Å
38	Q	89.4	Confident	85.9	Confident	109 Å²	109	54.4 Å²	54.4	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	112.3	171.2	-172.7	176.6	19.2	0	0	110.1	N25 V26	N25-Q38 HydrophobicContact CB-CG 3.72Å; N25-Q38 PolarHBondContact ND2-NE2 2.87Å; V26-Q38 CarbonylContact O-C 3.49Å; V26-Q38 WeakPolarHBondContact O-CA 3.41Å
39	V	88.1	Confident	84.8	Confident	9 Å²	9	61.3 Å²	61.3	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.8	-172	-175.2	0	0	0	0	110.8	V6 V26 V28 E37 I41 N43 V44	V6-V39 HydrophobicContact CG1-CB 4.47Å; V6-V39 HydrophobicContact CG1-CG1 3.91Å; V6-V39 HydrophobicContact CG1-CG2 4.15Å; V26-V39 PolarHBondContact N-O 3.19Å; V26-V39 PolarHBondContact O-N 2.88Å; V28-V39 HydrophobicContact CG1-CG2 4.5Å; V28-V39 HydrophobicContact CG2-CG2 3.78Å; E37-V39 HydrophobicContact CB-CG2 4.19Å; E37-V39 HydrophobicContact CG-CG2 3.64Å; E37-V39 WeakPolarHBondContact OE2-CG2 3.5Å; V39-I41 PolarHBondContact O-N 2.67Å; V39-N43 HydrophobicContact CG1-CB 3.8Å; V39-V44 HydrophobicContact CG1-CG2 4.24Å
40	P	88.3	Confident	83.6	Confident	45 Å²	45	63.5 Å²	63.5	29%	0.292	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	134.5	173.9	-27.1	36.3	0	0	0	112.6	N25 K42 N43	N25-P40 VanDerWaalsContact OD1-CA 3.31Å; N25-P40 WeakPolarHBondContact OD1-CA 3.47Å; P40-K42 HydrophobicContact CB-CD 4.42Å; P40-K42 HydrophobicContact CB-CG 3.92Å; P40-K42 PolarHBondContact O-N 2.91Å; P40-N43 WeakPolarHBondContact O-CB 3.35Å; P40-N43 PolarHBondContact O-N 2.86Å
41	I	86.2	Confident	82.5	Confident	22 Å²	22	73.2 Å²	73.2	11%	0.113	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-56.5	-32.8	-172.8	-162.1	175.1	0	0	0	113.1	E24 V26 V39 N43 V44 L169 I174	E24-I41 WeakPolarHBondContact O-CB 3.21Å; E24-I41 WeakPolarHBondContact O-CG2 3.31Å; E24-I41 PolarHBondContact O-N 3.09Å; V26-I41 HydrophobicContact CG2-CB 3.83Å; V26-I41 HydrophobicContact CG2-CD1 4.29Å; V26-I41 HydrophobicContact CG2-CG1 3.66Å; V39-I41 PolarHBondContact O-N 2.67Å; I41-N43 PolarHBondContact O-N 3.43Å; I41-N43 VanDerWaalsContact O-N 3.13Å; I41-V44 PolarHBondContact O-N 3.21Å; I41-L169 HydrophobicContact CD1-CB 4.12Å; I41-L169 HydrophobicContact CG1-CB 3.79Å; I41-L169 WeakPolarHBondContact CG1-O 3.43Å; I41-I174 HydrophobicContact CD1-CD1 4.18Å
42	K	85.3	Confident	81.9	Confident	147 Å²	147	76.3 Å²	76.3	64%	0.639	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20.6	173.7	65.6	-178.2	-178.6	-173.1	0	115.3	P40 C168	P40-K42 HydrophobicContact CB-CD 4.42Å; P40-K42 HydrophobicContact CB-CG 3.92Å; P40-K42 PolarHBondContact O-N 2.91Å; K42-C168 PolarHBondContact O-SG 3.12Å
43	N	86.7	Confident	81.6	Confident	56 Å²	56	74.3 Å²	74.3	30%	0.299	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-93.9	1.1	176.6	-71	3.1	0	0	0	112.3	K7 V39 P40 I41	K7-N43 HydrophobicContact CB-CB 4.22Å; K7-N43 VanDerWaalsContact CB-O 3.24Å; K7-N43 WeakPolarHBondContact CB-O 3.32Å; K7-N43 PolarHBondContact N-O 2.78Å; V39-N43 HydrophobicContact CG1-CB 3.8Å; P40-N43 WeakPolarHBondContact O-CB 3.35Å; P40-N43 PolarHBondContact O-N 2.86Å; I41-N43 PolarHBondContact O-N 3.43Å; I41-N43 VanDerWaalsContact O-N 3.13Å
44	V	88.3	Confident	81.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.2	-176.4	-168.4	0	0	0	0	110	I4 E5 V6 V26 V28 V39 I41 C168 L169	I4-V44 HydrophobicContact CB-CG1 3.77Å; I4-V44 HydrophobicContact CD1-CG1 3.71Å; I4-V44 HydrophobicContact CG1-CG1 4.26Å; I4-V44 HydrophobicContact CG2-CG1 4.11Å; E5-V44 WeakPolarHBondContact O-CA 3.17Å; V6-V44 HydrophobicContact CG2-CG1 4.48Å; V6-V44 HydrophobicContact CG2-CG2 4.41Å; V26-V44 HydrophobicContact CB-CG2 4.47Å; V28-V44 HydrophobicContact CG1-CG2 4.39Å; V39-V44 HydrophobicContact CG1-CG2 4.24Å; I41-V44 PolarHBondContact O-N 3.21Å; V44-C168 CarbonylContact O-C 3.48Å; V44-C168 WeakPolarHBondContact O-CA 3.35Å; V44-L169 HydrophobicContact CB-CD1 4.07Å; V44-L169 HydrophobicContact CG1-CD1 3.61Å; V44-L169 HydrophobicContact CG1-CG 4.49Å; V44-L169 PolarHBondContact O-N 2.79Å
45	R	88.8	Confident	81.8	Confident	8 Å²	8	71.9 Å²	71.9	3%	0.03	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	165.8	172.4	67.7	177.6	-171.6	-168.7	1.8	111	E5 Y13 E61	E5-R45 HydrophobicContact CB-CG 3.97Å; E5-R45 PolarHBondContact N-O 3.2Å; E5-R45 PolarHBondContact O-N 3.05Å; E5-R45 IonicContact OE2-CZ 3.07Å; E5-R45 IonicContact OE2-NE 2.94Å; E5-R45 PolarHBondContact OE2-NE 2.85Å; E5-R45 IonicContact OE2-NH2 2.72Å; E5-R45 PolarHBondContact OE2-NH2 3.06Å; Y13-R45 HydrophobicContact CD1-CG 4.17Å; Y13-R45 HydrophobicContact CE1-CG 4.01Å; R45-E61 IonicContact CZ-OE1 3.76Å; R45-E61 IonicContact CZ-OE2 3.99Å; R45-E61 IonicContact NH1-OE1 2.91Å; R45-E61 PolarHBondContact NH1-OE1 3.12Å; R45-E61 VanDerWaalsContact NH2-CD 3.29Å; R45-E61 IonicContact NH2-OE1 2.77Å; R45-E61 PolarHBondContact NH2-OE1 3.17Å; R45-E61 VanDerWaalsContact NH2-OE1 3.09Å; R45-E61 IonicContact NH2-OE2 3.81Å; R45-E61 PolarHBondContact NH2-OE2 3.06Å
46	L	85.7	Confident	82.1	Confident	51 Å²	51	71.4 Å²	71.4	27%	0.267	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-75.8	152.8	164.5	-66.9	174.5	0	0	0	109.7	I2 I4 C166 L169 T222	I2-L46 HydrophobicContact CG2-CD2 4.38Å; I4-L46 HydrophobicContact CG2-CD2 4.45Å; L46-C166 PolarHBondContact O-SG 2.7Å; L46-C166 VanDerWaalsContact O-SG 3.35Å; L46-L169 HydrophobicContact CD1-CD2 4.4Å; L46-L169 HydrophobicContact CD2-CD2 4Å; L46-L169 HydrophobicContact CG-CD2 3.82Å; L46-T222 HydrophobicContact CD2-CG2 4.5Å
47	P	84.4	Confident	82.2	Confident	50 Å²	50	68.4 Å²	68.4	33%	0.325	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-62.1	142.9	168.2	-17.1	30.4	0	0	0	110.2	G3 E5 T49	G3-P47 WeakPolarHBondContact O-CD 3.25Å; E5-P47 HydrophobicContact CG-CB 4.4Å; E5-P47 HydrophobicContact CG-CG 4.22Å; P47-T49 PolarHBondContact O-N 2.97Å
48	P	80.5	Confident	82.3	Confident	36 Å²	36	69.3 Å²	69.3	23%	0.234	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-59.1	134.3	175.8	25.5	-35.4	0	0	0	111.3	S163	P48-S163 WeakPolarHBondContact CG-OG 3.28Å
49	T	69	Low	82.3	Confident	146 Å²	146	67.2 Å²	67.2	90%	0.896	37%	0.365	S	S	*	.			trans	-86.8	-8.9	-179.5	50.9	0	0	0	0	113.8	P47	P47-T49 PolarHBondContact O-N 2.97Å
50	S	61.8	Low	82.3	Confident	57 Å²	57	66.9 Å²	66.9	40%	0.399	36%	0.364	S	S	.	.			trans	-109.4	109.6	-170.5	52.3	0	0	0	0	112.2	R52	S50-R52 PolarHBondContact O-N 2.79Å
51	E	65.7	Low	82.4	Confident	207 Å²	207	65.3 Å²	65.3	97%	0.967	35%	0.353	S	S	*	.			trans	-74.2	58.6	169.5	-63.1	-168.3	166.8	0	0	111
52	R	70.5	Confident	82.6	Confident	129 Å²	129	64.2 Å²	64.2	49%	0.487	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-73.6	126.5	171.4	-69.5	-177.3	-174.4	147.3	5.5	109.5	S50 Q161 D165	S50-R52 PolarHBondContact O-N 2.79Å; R52-Q161 VanDerWaalsContact CB-CD 3.42Å; R52-Q161 HydrophobicContact CB-CG 4.03Å; R52-D165 IonicContact CZ-OD2 3.74Å; R52-D165 IonicContact NH1-OD2 3.46Å; R52-D165 PolarHBondContact NH1-OD2 3.05Å; R52-D165 IonicContact NH2-OD2 3.81Å; R52-D165 PolarHBondContact NH2-OD2 2.89Å; R52-D165 VanDerWaalsContact NH2-OD2 3.07Å
53	D	74.9	Confident	82.8	Confident	80 Å²	80	60.1 Å²	60.1	43%	0.428	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-58.3	143.2	173.6	-112.8	-33.4	0	0	0	111.8	R156 Q161	D53-R156 IonicContact OD1-CZ 3.54Å; D53-R156 IonicContact OD1-NE 3.03Å; D53-R156 PolarHBondContact OD1-NE 3.23Å; D53-R156 VanDerWaalsContact OD1-NE 3.1Å; D53-R156 IonicContact OD1-NH2 3.02Å; D53-R156 PolarHBondContact OD1-NH2 3.07Å; D53-R156 IonicContact OD2-CZ 3.43Å; D53-R156 IonicContact OD2-NH2 3.79Å; D53-R156 PolarHBondContact OD2-NH2 3.11Å; D53-Q161 PolarHBondContact O-NE2 3.21Å
54	V	82.4	Confident	82.7	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.036	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-100.2	144.3	171.7	-161.1	0	0	0	0	109	Q58 V116 I119 L159 R160 Q161	V54-Q58 HydrophobicContact CG1-CB 3.99Å; V54-V116 HydrophobicContact CB-CG2 4.34Å; V54-V116 HydrophobicContact CG1-CG2 3.58Å; V54-I119 WeakPolarHBondContact O-CD1 3.36Å; V54-L159 HydrophobicContact CB-CD2 4.31Å; V54-L159 HydrophobicContact CB-CG 4.35Å; V54-L159 HydrophobicContact CG2-CD1 4.32Å; V54-L159 HydrophobicContact CG2-CD2 4.48Å; V54-L159 HydrophobicContact CG2-CG 3.99Å; V54-R160 WeakPolarHBondContact CG2-O 3.3Å; V54-Q161 HydrophobicContact CG2-CG 3.93Å
55	H	85.5	Confident	82.3	Confident	106 Å²	106	61.4 Å²	61.4	49%	0.491	34%	0.342	S	S	.	.			trans	-112.1	155.4	176.9	-62.3	-35.4	0	0	0	112.3	G57 Q58	H55-G57 PolarHBondContact O-N 3.17Å; H55-Q58 HydrophobicContact CB-CG 4.32Å; H55-Q58 WeakPolarHBondContact O-CB 3.41Å; H55-Q58 PolarHBondContact O-N 2.92Å; H55-Q58 VanDerWaalsContact O-N 3.12Å
56	P	88.7	Confident	81.5	Confident	74 Å²	74	61.2 Å²	61.2	48%	0.481	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	137.3	173.7	-24.3	34.4	0	0	0	112.1	Q58 I119	P56-Q58 VanDerWaalsContact C-N 3.31Å; P56-I119 HydrophobicContact CG-CB 4.31Å; P56-I119 HydrophobicContact CG-CG1 4.18Å
57	G	88.1	Confident	80.4	Confident	42 Å²	42	61.6 Å²	61.6	43%	0.433	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-10.9	-176.2	0	0	0	0	0	115.2	H55 R115 V116	H55-G57 PolarHBondContact O-N 3.17Å; G57-R115 PolarHBondContact O-NH1 2.69Å; G57-V116 PolarHBondContact N-O 3.05Å
58	Q	89.7	Confident	78.8	Confident	76 Å²	76	60.7 Å²	60.7	36%	0.355	35%	0.346	S	S	.	.	S	Bend	trans	-82.4	160.3	172.7	-63.8	179.9	-26	0	0	112.1	V54 H55 P56 V116	V54-Q58 HydrophobicContact CG1-CB 3.99Å; H55-Q58 HydrophobicContact CB-CG 4.32Å; H55-Q58 WeakPolarHBondContact O-CB 3.41Å; H55-Q58 PolarHBondContact O-N 2.92Å; H55-Q58 VanDerWaalsContact O-N 3.12Å; P56-Q58 VanDerWaalsContact C-N 3.31Å; Q58-V116 PolarHBondContact O-N 2.71Å
59	S	89.4	Confident	77.2	Confident	64 Å²	64	63.3 Å²	63.3	45%	0.448	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	151.3	162.3	-56.7	0	0	0	0	109.9	C114 P162	S59-C114 CarbonylContact C-O 3.59Å; S59-C114 WeakPolarHBondContact CA-O 3.45Å; S59-P162 WeakPolarHBondContact O-CD 3.45Å
60	G	88.5	Confident	75.8	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	172.8	174.6	0	0	0	0	0	111.1	C114 R160	G60-C114 VanDerWaalsContact C-SG 3.54Å; G60-C114 PolarHBondContact N-O 3.05Å; G60-C114 PolarHBondContact O-N 3.42Å; G60-C114 VanDerWaalsContact O-O 3.14Å; G60-C114 PolarHBondContact O-SG 3.45Å; G60-R160 CarbonylContact C-O 3.51Å; G60-R160 VanDerWaalsContact CA-O 3.24Å; G60-R160 WeakPolarHBondContact CA-O 3.4Å
61	E	90.9	Very high	74.5	Confident	12 Å²	12	63.9 Å²	63.9	6%	0.056	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.1	165.2	-71.6	173.9	-159.6	0	0	108.7	R45 W111 W112 L159 R160 S163	R45-E61 IonicContact CZ-OE1 3.76Å; R45-E61 IonicContact CZ-OE2 3.99Å; R45-E61 IonicContact NH1-OE1 2.91Å; R45-E61 PolarHBondContact NH1-OE1 3.12Å; R45-E61 VanDerWaalsContact NH2-CD 3.29Å; R45-E61 IonicContact NH2-OE1 2.77Å; R45-E61 PolarHBondContact NH2-OE1 3.17Å; R45-E61 VanDerWaalsContact NH2-OE1 3.09Å; R45-E61 IonicContact NH2-OE2 3.81Å; R45-E61 PolarHBondContact NH2-OE2 3.06Å; E61-W111 HydrophobicContact CB-CB 4.31Å; E61-W111 HydrophobicContact CB-CE3 4.24Å; E61-W112 CarbonylContact C-O 3.48Å; E61-W112 WeakPolarHBondContact CA-O 3.39Å; E61-L159 WeakPolarHBondContact O-CA 3.43Å; E61-R160 HydrophobicContact CB-CG 3.92Å; E61-R160 PolarHBondContact N-O 2.93Å; E61-R160 PolarHBondContact O-N 3.07Å; E61-R160 IonicContact OE2-CZ 2.69Å; E61-R160 VanDerWaalsContact OE2-CZ 3.26Å; E61-R160 IonicContact OE2-NE 3.38Å; E61-R160 PolarHBondContact OE2-NE 3.27Å; E61-R160 IonicContact OE2-NH2 2.66Å; E61-R160 PolarHBondContact OE2-NH2 3.29Å; E61-S163 PolarHBondContact OE1-N 2.9Å; E61-S163 VanDerWaalsContact OE1-N 3.08Å; E61-S163 PolarHBondContact OE1-OG 3.04Å
62	A	90.5	Very high	73.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134	179.1	0	0	0	0	0	110.9	F64 W112 C114 V126 S158	A62-F64 PolarHBondContact O-N 3.31Å; A62-W112 PolarHBondContact N-O 3.09Å; A62-W112 PolarHBondContact O-N 3.43Å; A62-C114 HydrophobicContact CB-CB 4.25Å; A62-V126 HydrophobicContact CB-CG2 4.2Å; A62-S158 CarbonylContact C-O 3.56Å; A62-S158 WeakPolarHBondContact CA-O 3.5Å
63	L	89.1	Confident	71.7	Confident	61 Å²	61	60.2 Å²	60.2	32%	0.319	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	113.9	176.1	-174.6	68.5	0	0	0	109.5	P109 S110 W111 S158	L63-P109 HydrophobicContact CD1-CB 4.03Å; L63-P109 HydrophobicContact CG-CB 4.32Å; L63-S110 WeakPolarHBondContact CA-O 3.23Å; L63-W111 HydrophobicContact CB-CD2 4.21Å; L63-W111 HydrophobicContact CB-CE3 3.95Å; L63-W111 HydrophobicContact CB-CH2 4.05Å; L63-W111 HydrophobicContact CB-CZ2 4.3Å; L63-W111 HydrophobicContact CB-CZ3 3.87Å; L63-W111 HydrophobicContact CD1-CD2 4.22Å; L63-W111 HydrophobicContact CD1-CG 4.44Å; L63-W111 HydrophobicContact CD1-CZ2 4.46Å; L63-S158 PolarHBondContact N-O 3.06Å
64	F	84.3	Confident	70	Confident	24 Å²	24	58.5 Å²	58.5	11%	0.105	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	146	-175	179.7	-96.5	0	0	0	111.1	A62 I66 P82 S110 W112 L128 V150 E152	A62-F64 PolarHBondContact O-N 3.31Å; F64-I66 HydrophobicContact CD1-CG1 4.33Å; F64-I66 HydrophobicContact CE1-CG1 3.87Å; F64-P82 HydrophobicContact CZ-CG 4.23Å; F64-S110 PolarHBondContact N-O 2.97Å; F64-S110 PolarHBondContact O-N 2.97Å; F64-W112 VanDerWaalsContact O-CD1 3.31Å; F64-W112 PolarHBondContact O-NE1 3.15Å; F64-L128 HydrophobicContact CD1-CD1 4.07Å; F64-L128 HydrophobicContact CE1-CD1 4.06Å; F64-V150 HydrophobicContact CZ-CG1 4.39Å; F64-E152 HydrophobicContact CD2-CG 3.99Å; F64-E152 HydrophobicContact CE2-CB 4.43Å; F64-E152 HydrophobicContact CE2-CG 3.9Å
65	S	79.5	Confident	68	Low	58 Å²	58	64.8 Å²	64.8	41%	0.406	40%	0.401	S	S	.	.			trans	-126.2	132.8	-177.4	51.6	0	0	0	0	109.8
66	I	73.4	Confident	65.9	Low	4 Å²	4	62 Å²	62	2%	0.021	39%	0.393	C	S	.	.			trans	-89.6	114.5	179.8	-67.7	163.6	0	0	0	108.6	F64 I79 L81 L106 P107 W112 L147	F64-I66 HydrophobicContact CD1-CG1 4.33Å; F64-I66 HydrophobicContact CE1-CG1 3.87Å; I66-I79 HydrophobicContact CG2-CG2 3.39Å; I66-L81 HydrophobicContact CG2-CD2 4.08Å; I66-L106 HydrophobicContact CB-CB 4.3Å; I66-L106 HydrophobicContact CD1-CB 4.23Å; I66-L106 HydrophobicContact CD1-CD1 4.44Å; I66-L106 HydrophobicContact CD1-CD2 4.04Å; I66-L106 HydrophobicContact CD1-CG 4.47Å; I66-L106 PolarHBondContact N-O 2.96Å; I66-P107 WeakPolarHBondContact O-CA 3.49Å; I66-W112 HydrophobicContact CD1-CH2 3.76Å; I66-W112 HydrophobicContact CD1-CZ2 3.54Å; I66-W112 HydrophobicContact CG1-CZ2 4.35Å; I66-L147 HydrophobicContact CD1-CD1 4.01Å; I66-L147 HydrophobicContact CD1-CD2 3.8Å; I66-L147 HydrophobicContact CG1-CD2 4.21Å
67	A	61.9	Low	63.9	Low	59 Å²	59	61.6 Å²	61.6	49%	0.488	39%	0.387	S	S	.	.			trans	-68.3	140.4	179.2	0	0	0	0	0	111.5	T80	A67-T80 PolarHBondContact O-N 3.43Å
68	T	50.6	Low	61.8	Low	31 Å²	31	61 Å²	61	19%	0.19	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-125.6	110.3	176.2	-55.7	0	0	0	0	107.8	Q70 N77 T78 L99	T68-Q70 PolarHBondContact O-N 3.4Å; T68-Q70 VanDerWaalsContact O-N 3.09Å; T68-N77 HydrophobicContact CG2-CB 3.96Å; T68-T78 CarbonylContact C-O 3.54Å; T68-T78 VanDerWaalsContact CA-O 3.3Å; T68-T78 WeakPolarHBondContact CA-O 3.38Å; T68-T78 VanDerWaalsContact CG2-O 3.27Å; T68-T78 WeakPolarHBondContact CG2-O 3.37Å; T68-L99 HydrophobicContact CG2-CD1 3.93Å
69	D	46.2	Very low	59.9	Low	91 Å²	91	58 Å²	58	49%	0.487	36%	0.361	S	S	.	.			trans	-81.2	89	-178.5	-80.7	-53.4	0	0	0	110.2	T71 T78 T80	D69-T71 VanDerWaalsContact C-N 3.31Å; D69-T71 PolarHBondContact O-N 3.44Å; D69-T78 PolarHBondContact N-O 2.92Å; D69-T80 VanDerWaalsContact OD2-CB 3.25Å; D69-T80 WeakPolarHBondContact OD2-CB 3.39Å; D69-T80 PolarHBondContact OD2-OG1 3.05Å
70	Q	40	Very low	58	Low	145 Å²	145	57.6 Å²	57.6	68%	0.678	36%	0.356	S	S	*	.			trans	-71.7	85.7	167.8	-70.5	-173.7	4.6	0	0	110.2	T68 N77	T68-Q70 PolarHBondContact O-N 3.4Å; T68-Q70 VanDerWaalsContact O-N 3.09Å; Q70-N77 PolarHBondContact NE2-OD1 3.21Å
71	T	34.7	Very low	56.3	Low	70 Å²	70	59.7 Å²	59.7	43%	0.429	37%	0.367	S	S	.	.			trans	-68.9	136.4	166	84.2	0	0	0	0	109	D69 S73 S74	D69-T71 VanDerWaalsContact C-N 3.31Å; D69-T71 PolarHBondContact O-N 3.44Å; T71-S73 PolarHBondContact O-N 3.41Å; T71-S73 PolarHBondContact OG1-OG 2.8Å; T71-S74 PolarHBondContact O-N 2.94Å; T71-S74 PolarHBondContact O-OG 3.3Å; T71-S74 VanDerWaalsContact O-OG 3.13Å; T71-S74 PolarHBondContact OG1-OG 3.05Å
72	P	39.5	Very low	54.2	Low	145 Å²	145	62.2 Å²	62.2	94%	0.942	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	19.2	-174	30	-36.6	0	0	0	114.6
73	S	37.7	Very low	51.7	Low	114 Å²	114	65 Å²	65	80%	0.797	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.9	-5.6	-179.7	46.8	0	0	0	0	114.1	T71	T71-S73 PolarHBondContact O-N 3.41Å; T71-S73 PolarHBondContact OG1-OG 2.8Å
74	S	39.6	Very low	49.3	Very low	44 Å²	44	70.9 Å²	70.9	31%	0.308	43%	0.431	S	S	.	.			trans	-107.8	117.1	179.9	50.6	0	0	0	0	110.9	T71 S76	T71-S74 PolarHBondContact O-N 2.94Å; T71-S74 PolarHBondContact O-OG 3.3Å; T71-S74 VanDerWaalsContact O-OG 3.13Å; T71-S74 PolarHBondContact OG1-OG 3.05Å; S74-S76 PolarHBondContact O-N 2.7Å
75	S	40.7	Very low	46.8	Very low	138 Å²	138	82.1 Å²	82.1	97%	0.965	47%	0.473	S	S	*	.	S	Bend	trans	-77.5	27.5	178	63.6	0	0	0	0	113.8
76	S	40.2	Very low	44.6	Very low	48 Å²	48	81.8 Å²	81.8	34%	0.336	48%	0.478	S	S	.	.	S	Bend	trans	-141.6	128.4	-176	50.8	0	0	0	0	108.3	S74 T78	S74-S76 PolarHBondContact O-N 2.7Å; S76-T78 PolarHBondContact O-N 3.08Å
77	N	46.8	Very low	42.7	Very low	66 Å²	66	86.7 Å²	86.7	35%	0.353	51%	0.505	S	S	.	.			trans	-76.1	102.2	176.8	-67.2	-41.7	0	0	0	109.2	T68 Q70 L99	T68-N77 HydrophobicContact CG2-CB 3.96Å; Q70-N77 PolarHBondContact NE2-OD1 3.21Å; N77-L99 HydrophobicContact CB-CB 4.22Å; N77-L99 HydrophobicContact CB-CD1 3.53Å; N77-L99 HydrophobicContact CB-CG 4.39Å
78	T	44.6	Very low	41.5	Very low	29 Å²	29	93.7 Å²	93.7	18%	0.178	53%	0.527	C	S	.	.			trans	-91.4	125.7	-177.1	-60.2	0	0	0	0	111.6	T68 D69 S76 E96	T68-T78 CarbonylContact C-O 3.54Å; T68-T78 VanDerWaalsContact CA-O 3.3Å; T68-T78 WeakPolarHBondContact CA-O 3.38Å; T68-T78 VanDerWaalsContact CG2-O 3.27Å; T68-T78 WeakPolarHBondContact CG2-O 3.37Å; D69-T78 PolarHBondContact N-O 2.92Å; S76-T78 PolarHBondContact O-N 3.08Å; T78-E96 HydrophobicContact CG2-CG 4.19Å
79	I	50.4	Low	41	Very low	12 Å²	12	97.7 Å²	97.7	6%	0.062	55%	0.552	C	S	.	*	B	Isolated β-bridge	trans	-80.7	129.9	176.1	-66.1	171.7	0	0	0	110.4	I66 L81 L97 L99 L106	I66-I79 HydrophobicContact CG2-CG2 3.39Å; I79-L81 HydrophobicContact CG2-CD2 4.09Å; I79-L81 HydrophobicContact CG2-CG 4.13Å; I79-L97 HydrophobicContact CD1-CB 4.49Å; I79-L99 HydrophobicContact CD1-CD1 4.39Å; I79-L99 HydrophobicContact CD1-CD2 3.83Å; I79-L99 HydrophobicContact CD1-CG 4.05Å; I79-L99 HydrophobicContact CG1-CD1 4.02Å; I79-L99 HydrophobicContact CG1-CD2 4.36Å; I79-L99 HydrophobicContact CG1-CG 4.16Å; I79-L106 HydrophobicContact CD1-CD1 3.87Å
80	T	49.3	Very low	40.6	Very low	56 Å²	56	100.5 Å²	100.5	34%	0.344	57%	0.567	S	S	.	*			trans	-110.1	97	175.7	-55.4	0	0	0	0	110.3	A67 D69	A67-T80 PolarHBondContact O-N 3.43Å; D69-T80 VanDerWaalsContact OD2-CB 3.25Å; D69-T80 WeakPolarHBondContact OD2-CB 3.39Å; D69-T80 PolarHBondContact OD2-OG1 3.05Å
81	L	51.4	Low	40.6	Very low	47 Å²	47	98.3 Å²	98.3	25%	0.246	57%	0.567	C	S	.	*			trans	-76.7	137.2	173.5	-66	-179.3	0	0	0	111.3	I66 I79 G83 Q146 L147	I66-L81 HydrophobicContact CG2-CD2 4.08Å; I79-L81 HydrophobicContact CG2-CD2 4.09Å; I79-L81 HydrophobicContact CG2-CG 4.13Å; L81-G83 PolarHBondContact O-N 3.28Å; L81-G83 VanDerWaalsContact O-N 3.1Å; L81-Q146 HydrophobicContact CD1-CB 4.05Å; L81-L147 HydrophobicContact CD2-CD2 3.73Å
82	P	47.6	Very low	40.8	Very low	64 Å²	64	102.8 Å²	102.8	42%	0.416	58%	0.581	S	S	.	*			trans	-67.2	110.4	177.6	26.2	-32.9	0	0	0	111.1	F64 V150	F64-P82 HydrophobicContact CZ-CG 4.23Å; P82-V150 HydrophobicContact CG-CG1 4.17Å
83	G	37.7	Very low	40.7	Very low	58 Å²	58	101.3 Å²	101.3	60%	0.598	57%	0.571	S	S	*	*			trans	-72.5	146.9	-176.3	0	0	0	0	0	114.5	L81 W85	L81-G83 PolarHBondContact O-N 3.28Å; L81-G83 VanDerWaalsContact O-N 3.1Å; G83-W85 PolarHBondContact O-N 3.32Å
84	R	39.2	Very low	40.7	Very low	186 Å²	186	103.4 Å²	103.4	70%	0.702	57%	0.568	S	S	*	*			trans	-38	120	175.6	174.5	-177.6	172.9	-130.7	-3.5	114	G86 D87	R84-G86 PolarHBondContact NH2-O 2.87Å; R84-G86 PolarHBondContact O-N 2.91Å; R84-D87 IonicContact CZ-OD2 3.14Å; R84-D87 IonicContact NH1-OD2 2.71Å; R84-D87 PolarHBondContact NH1-OD2 3.12Å; R84-D87 IonicContact NH2-OD2 2.72Å; R84-D87 PolarHBondContact NH2-OD2 3.45Å
85	W	31.1	Very low	41	Very low	260 Å²	260	104 Å²	104	99%	0.985	57%	0.57	S	S	*	*	S	Bend	trans	-68.7	117.9	160.8	-73.8	77.4	0	0	0	109.8	G83	G83-W85 PolarHBondContact O-N 3.32Å
86	G	34.4	Very low	41.1	Very low	51 Å²	51	104.5 Å²	104.5	53%	0.526	56%	0.557	S	S	.	*	S	Bend	trans	113.2	67.6	167.9	0	0	0	0	0	116.4	R84	R84-G86 PolarHBondContact NH2-O 2.87Å; R84-G86 PolarHBondContact O-N 2.91Å
87	D	33.9	Very low	41.4	Very low	107 Å²	107	103.9 Å²	103.9	57%	0.572	55%	0.55	S	S	*	.			trans	-168.3	116.6	137.6	-95.2	-40.2	0	0	0	107.7	R84 T89	R84-D87 IonicContact CZ-OD2 3.14Å; R84-D87 IonicContact NH1-OD2 2.71Å; R84-D87 PolarHBondContact NH1-OD2 3.12Å; R84-D87 IonicContact NH2-OD2 2.72Å; R84-D87 PolarHBondContact NH2-OD2 3.45Å; D87-T89 PolarHBondContact O-N 3.02Å; D87-T89 VanDerWaalsContact O-N 3.16Å
88	E	36.8	Very low	41.4	Very low	206 Å²	206	107.5 Å²	107.5	96%	0.963	57%	0.568	S	S	*	*	S	Bend	trans	-80.3	13.4	-176.6	-63.8	-169.7	126	0	0	113.7
89	T	39.8	Very low	41.7	Very low	114 Å²	114	107.2 Å²	107.2	70%	0.699	57%	0.565	S	S	*	*	S	Bend	trans	-129.9	32.9	-165.4	62	0	0	0	0	114.5	D87	D87-T89 PolarHBondContact O-N 3.02Å; D87-T89 VanDerWaalsContact O-N 3.16Å
90	N	37	Very low	41.8	Very low	151 Å²	151	111.7 Å²	111.7	81%	0.807	59%	0.589	S	S	*	*	S	Bend	trans	-158.6	162.2	153.1	-119.1	-35.8	0	0	0	112.9
91	S	39.5	Very low	42.1	Very low	98 Å²	98	115.1 Å²	115.1	69%	0.685	61%	0.605	S	S	*	*			trans	-55.9	144.2	176.1	51.7	0	0	0	0	112.4
92	K	39.6	Very low	42.4	Very low	165 Å²	165	119.2 Å²	119.2	72%	0.717	62%	0.623	S	S	*	*			trans	-50.7	130.9	166.4	-71.2	-178.5	179.2	178.6	0	109.4	E94	K92-E94 VanDerWaalsContact C-N 3.26Å; K92-E94 HydrophobicContact CB-CG 4.28Å; K92-E94 PolarHBondContact O-N 2.94Å
93	P	37.6	Very low	43.1	Very low	113 Å²	113	116.9 Å²	116.9	73%	0.734	61%	0.607	S	S	*	*			trans	-75.8	84.8	166.5	31.1	-32	0	0	0	108.6	V95	P93-V95 PolarHBondContact O-N 2.91Å
94	E	38.4	Very low	44.5	Very low	159 Å²	159	116.4 Å²	116.4	74%	0.743	59%	0.591	S	S	*	*			trans	-70.4	118.9	167.6	-74	166.8	-174.7	0	0	108	K92	K92-E94 VanDerWaalsContact C-N 3.26Å; K92-E94 HydrophobicContact CB-CG 4.28Å; K92-E94 PolarHBondContact O-N 2.94Å
95	V	45.2	Very low	46.1	Very low	55 Å²	55	109.4 Å²	109.4	33%	0.333	57%	0.565	S	S	.	*			trans	-112.9	91.1	-179.3	-173.4	0	0	0	0	107.8	P93 L97	P93-V95 PolarHBondContact O-N 2.91Å; V95-L97 HydrophobicContact CG1-CD2 3.89Å; V95-L97 HydrophobicContact CG1-CG 3.95Å; V95-L97 PolarHBondContact O-N 3.11Å; V95-L97 VanDerWaalsContact O-N 3.08Å
96	E	42.9	Very low	48.2	Very low	149 Å²	149	97 Å²	97	70%	0.696	52%	0.518	S	S	*	.			trans	-65.1	109.1	171.7	-63.4	-169.7	130.1	0	0	109.6	T78	T78-E96 HydrophobicContact CG2-CG 4.19Å
97	L	46.2	Very low	50.2	Low	36 Å²	36	97.4 Å²	97.4	19%	0.188	51%	0.511	C	S	.	.			trans	-110	117.4	169.9	-62.7	-179.2	0	0	0	108.2	I79 V95 L99 L143	I79-L97 HydrophobicContact CD1-CB 4.49Å; V95-L97 HydrophobicContact CG1-CD2 3.89Å; V95-L97 HydrophobicContact CG1-CG 3.95Å; V95-L97 PolarHBondContact O-N 3.11Å; V95-L97 VanDerWaalsContact O-N 3.08Å; L97-L99 PolarHBondContact O-N 2.87Å; L97-L143 HydrophobicContact CD1-CB 3.97Å; L97-L143 HydrophobicContact CD1-CD1 3.8Å; L97-L143 HydrophobicContact CD1-CG 3.68Å
98	I	47.2	Very low	52.5	Low	142 Å²	142	92.7 Å²	92.7	73%	0.728	49%	0.485	S	S	*	.			trans	-64.6	118.7	171.5	-60	173.3	0	0	0	107.3	D100	I98-D100 PolarHBondContact O-N 2.79Å; I98-D100 VanDerWaalsContact O-N 3.15Å
99	L	50.2	Low	54.8	Low	23 Å²	23	84.9 Å²	84.9	12%	0.12	45%	0.453	C	S	.	.			trans	-72	101.4	176.5	-85.7	164.9	0	0	0	110.4	T68 N77 I79 L97 L103 L106	T68-L99 HydrophobicContact CG2-CD1 3.93Å; N77-L99 HydrophobicContact CB-CB 4.22Å; N77-L99 HydrophobicContact CB-CD1 3.53Å; N77-L99 HydrophobicContact CB-CG 4.39Å; I79-L99 HydrophobicContact CD1-CD1 4.39Å; I79-L99 HydrophobicContact CD1-CD2 3.83Å; I79-L99 HydrophobicContact CD1-CG 4.05Å; I79-L99 HydrophobicContact CG1-CD1 4.02Å; I79-L99 HydrophobicContact CG1-CD2 4.36Å; I79-L99 HydrophobicContact CG1-CG 4.16Å; L97-L99 PolarHBondContact O-N 2.87Å; L99-L103 HydrophobicContact CD2-CB 3.33Å; L99-L103 HydrophobicContact CD2-CD1 4.45Å; L99-L103 WeakPolarHBondContact CD2-O 3.46Å; L99-L106 HydrophobicContact CD2-CD1 4.23Å
100	D	53.5	Low	57.1	Low	105 Å²	105	79.5 Å²	79.5	56%	0.561	42%	0.42	S	S	*	.			trans	-62.6	153.2	159.7	-76.1	-38.1	0	0	0	110.4	I98 Q102 L103	I98-D100 PolarHBondContact O-N 2.79Å; I98-D100 VanDerWaalsContact O-N 3.15Å; D100-Q102 PolarHBondContact O-N 2.89Å; D100-L103 WeakPolarHBondContact O-CB 3.46Å; D100-L103 PolarHBondContact O-N 2.95Å
101	D	55.6	Low	59.7	Low	129 Å²	129	74 Å²	74	69%	0.69	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-54.8	-31	-175.3	-85.3	-33.3	0	0	0	114.4	L103 N104	D101-L103 PolarHBondContact O-N 2.81Å; D101-N104 WeakPolarHBondContact CA-ND2 3.41Å; D101-N104 VanDerWaalsContact O-CB 3.3Å; D101-N104 WeakPolarHBondContact O-CB 3.4Å; D101-N104 PolarHBondContact O-N 2.82Å; D101-N104 PolarHBondContact O-ND2 2.88Å; D101-N104 PolarHBondContact OD1-ND2 2.88Å
102	Q	56.8	Low	62.2	Low	133 Å²	133	69.4 Å²	69.4	62%	0.621	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-68.5	-12.9	178	-58.5	-170.5	20.7	0	0	113.8	D100	D100-Q102 PolarHBondContact O-N 2.89Å
103	L	62.8	Low	64.6	Low	14 Å²	14	63.2 Å²	63.2	7%	0.073	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-104	-1.4	178.1	-58.4	172.5	0	0	0	112.4	L10 L99 D100 D101 Y105 L106 L143	L10-L103 HydrophobicContact CD1-CD2 4.43Å; L10-L103 HydrophobicContact CD2-CD2 4.34Å; L10-L103 HydrophobicContact CG-CD2 4.38Å; L99-L103 HydrophobicContact CD2-CB 3.33Å; L99-L103 HydrophobicContact CD2-CD1 4.45Å; L99-L103 WeakPolarHBondContact CD2-O 3.46Å; D100-L103 WeakPolarHBondContact O-CB 3.46Å; D100-L103 PolarHBondContact O-N 2.95Å; D101-L103 PolarHBondContact O-N 2.81Å; L103-Y105 PolarHBondContact O-N 3.33Å; L103-L106 HydrophobicContact CB-CD1 4.06Å; L103-L106 HydrophobicContact CB-CG 4.32Å; L103-L106 HydrophobicContact CD2-CD1 4.18Å; L103-L106 WeakPolarHBondContact O-CG 3.5Å; L103-L106 PolarHBondContact O-N 2.9Å; L103-L143 HydrophobicContact CD1-CD1 4.4Å
104	N	67.1	Low	67.2	Low	49 Å²	49	58 Å²	58	26%	0.262	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-5.7	178.2	-74.3	-18.1	0	0	0	114.9	K33 D101	K33-N104 WeakPolarHBondContact CE-O 3.19Å; K33-N104 PolarHBondContact NZ-O 3.49Å; K33-N104 VanDerWaalsContact NZ-O 3.13Å; D101-N104 WeakPolarHBondContact CA-ND2 3.41Å; D101-N104 VanDerWaalsContact O-CB 3.3Å; D101-N104 WeakPolarHBondContact O-CB 3.4Å; D101-N104 PolarHBondContact O-N 2.82Å; D101-N104 PolarHBondContact O-ND2 2.88Å; D101-N104 PolarHBondContact OD1-ND2 2.88Å
105	Y	73.5	Confident	69.7	Low	39 Å²	39	56.4 Å²	56.4	15%	0.153	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-6.4	177.1	-55	-67.9	0	0	0	114.4	I14 Y30 K33 E37 L103 P107 I108	I14-Y105 HydrophobicContact CD1-CG 4.22Å; Y30-Y105 HydrophobicContact CD2-CE1 4.06Å; Y30-Y105 HydrophobicContact CE2-CD1 4.44Å; Y30-Y105 AromaticContact CE2-CE1 3.81Å; Y30-Y105 HydrophobicContact CE2-CE1 3.81Å; K33-Y105 HydrophobicContact CD-CD1 4.31Å; K33-Y105 HydrophobicContact CD-CE1 4.35Å; E37-Y105 VanDerWaalsContact OE1-CE2 3.27Å; E37-Y105 WeakPolarHBondContact OE1-CE2 3.45Å; E37-Y105 VanDerWaalsContact OE1-CZ 3.3Å; E37-Y105 PolarHBondContact OE1-OH 3.2Å; L103-Y105 PolarHBondContact O-N 3.33Å; Y105-P107 VanDerWaalsContact C-N 3.31Å; Y105-I108 HydrophobicContact CD1-CD1 3.88Å; Y105-I108 WeakPolarHBondContact O-CB 3.27Å; Y105-I108 PolarHBondContact O-N 2.72Å; Y105-I108 VanDerWaalsContact O-N 3.09Å
106	L	73.6	Confident	72	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-31	177.7	-64.6	-178.2	0	0	0	115.2	L10 I66 I79 L99 L103 I108 W112 L143	L10-L106 HydrophobicContact CD1-CD2 3.76Å; L10-L106 HydrophobicContact CG-CD2 4.38Å; I66-L106 HydrophobicContact CB-CB 4.3Å; I66-L106 HydrophobicContact CD1-CB 4.23Å; I66-L106 HydrophobicContact CD1-CD1 4.44Å; I66-L106 HydrophobicContact CD1-CD2 4.04Å; I66-L106 HydrophobicContact CD1-CG 4.47Å; I66-L106 PolarHBondContact N-O 2.96Å; I79-L106 HydrophobicContact CD1-CD1 3.87Å; L99-L106 HydrophobicContact CD2-CD1 4.23Å; L103-L106 HydrophobicContact CB-CD1 4.06Å; L103-L106 HydrophobicContact CB-CG 4.32Å; L103-L106 HydrophobicContact CD2-CD1 4.18Å; L103-L106 WeakPolarHBondContact O-CG 3.5Å; L103-L106 PolarHBondContact O-N 2.9Å; L106-I108 VanDerWaalsContact C-N 3.26Å; L106-I108 PolarHBondContact O-N 3.32Å; L106-W112 HydrophobicContact CD2-CH2 3.79Å; L106-W112 HydrophobicContact CD2-CZ2 4.13Å; L106-L143 HydrophobicContact CD1-CD1 4.28Å
107	P	76.5	Confident	74.3	Confident	58 Å²	58	50.8 Å²	50.8	38%	0.377	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.9	174.9	-23.8	36	0	0	0	114.8	I66 Y105	I66-P107 WeakPolarHBondContact O-CA 3.49Å; Y105-P107 VanDerWaalsContact C-N 3.31Å
108	I	82	Confident	76.5	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.041	28%	0.28	C	S	.	.	S	Bend	trans	-72.8	128	-178	-53.4	177.8	0	0	0	109.1	I14 K33 Y105 L106 S110	I14-I108 HydrophobicContact CG2-CB 4.31Å; I14-I108 HydrophobicContact CG2-CD1 4.12Å; I14-I108 HydrophobicContact CG2-CG2 3.84Å; K33-I108 HydrophobicContact CD-CD1 4.15Å; K33-I108 HydrophobicContact CG-CD1 4Å; K33-I108 HydrophobicContact CG-CG1 4.46Å; Y105-I108 HydrophobicContact CD1-CD1 3.88Å; Y105-I108 WeakPolarHBondContact O-CB 3.27Å; Y105-I108 PolarHBondContact O-N 2.72Å; Y105-I108 VanDerWaalsContact O-N 3.09Å; L106-I108 VanDerWaalsContact C-N 3.26Å; L106-I108 PolarHBondContact O-N 3.32Å; I108-S110 PolarHBondContact O-N 2.83Å; I108-S110 PolarHBondContact O-OG 2.86Å
109	P	85.3	Confident	78.6	Confident	43 Å²	43	50.3 Å²	50.3	28%	0.279	25%	0.254	S	S	.	.			trans	-54	108.9	172.6	-21.7	33.5	0	0	0	110.8	E32 L63	E32-P109 WeakPolarHBondContact OE2-CD 3.25Å; L63-P109 HydrophobicContact CD1-CB 4.03Å; L63-P109 HydrophobicContact CG-CB 4.32Å
110	S	89.2	Confident	80.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.5	-172.5	-61.2	0	0	0	0	109.8	Y13 I14 L63 F64 I108 W112	Y13-S110 WeakPolarHBondContact O-CA 3.31Å; I14-S110 WeakPolarHBondContact CG1-OG 3.13Å; L63-S110 WeakPolarHBondContact CA-O 3.23Å; F64-S110 PolarHBondContact N-O 2.97Å; F64-S110 PolarHBondContact O-N 2.97Å; I108-S110 PolarHBondContact O-N 2.83Å; I108-S110 PolarHBondContact O-OG 2.86Å; S110-W112 PolarHBondContact O-N 3.12Å
111	W	91.1	Very high	82	Confident	37 Å²	37	58.2 Å²	58.2	14%	0.14	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	112.6	172.2	-65	99.3	0	0	0	109.5	Y13 E61 L63 R160	Y13-W111 PolarHBondContact N-O 2.61Å; Y13-W111 PolarHBondContact O-N 3.16Å; E61-W111 HydrophobicContact CB-CB 4.31Å; E61-W111 HydrophobicContact CB-CE3 4.24Å; L63-W111 HydrophobicContact CB-CD2 4.21Å; L63-W111 HydrophobicContact CB-CE3 3.95Å; L63-W111 HydrophobicContact CB-CH2 4.05Å; L63-W111 HydrophobicContact CB-CZ2 4.3Å; L63-W111 HydrophobicContact CB-CZ3 3.87Å; L63-W111 HydrophobicContact CD1-CD2 4.22Å; L63-W111 HydrophobicContact CD1-CG 4.44Å; L63-W111 HydrophobicContact CD1-CZ2 4.46Å; W111-R160 VanDerWaalsContact CD1-NH2 3.32Å; W111-R160 VanDerWaalsContact CD2-CZ 3.42Å; W111-R160 HydrophobicContact CE3-CG 3.98Å; W111-R160 HydrophobicContact CH2-CG 4.39Å; W111-R160 HydrophobicContact CZ3-CB 4.47Å; W111-R160 HydrophobicContact CZ3-CG 3.8Å
112	W	91.1	Very high	83.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	139.4	-179.2	-66.7	85.2	0	0	0	111.2	L10 Q12 E61 A62 F64 I66 L106 S110 C114 L128 V130 L147	L10-W112 HydrophobicContact CB-CH2 4.22Å; L10-W112 HydrophobicContact CB-CZ3 3.98Å; L10-W112 HydrophobicContact CD1-CH2 4.22Å; L10-W112 HydrophobicContact CD1-CZ3 4.45Å; Q12-W112 HydrophobicContact CB-CD2 3.63Å; Q12-W112 HydrophobicContact CB-CE3 3.69Å; Q12-W112 HydrophobicContact CB-CG 4.28Å; Q12-W112 HydrophobicContact CB-CH2 3.82Å; Q12-W112 HydrophobicContact CB-CZ2 3.77Å; Q12-W112 HydrophobicContact CB-CZ3 3.78Å; Q12-W112 HydrophobicContact CG-CH2 3.92Å; Q12-W112 HydrophobicContact CG-CZ2 3.77Å; Q12-W112 HydrophobicContact CG-CZ3 4.37Å; E61-W112 CarbonylContact C-O 3.48Å; E61-W112 WeakPolarHBondContact CA-O 3.39Å; A62-W112 PolarHBondContact N-O 3.09Å; A62-W112 PolarHBondContact O-N 3.43Å; F64-W112 VanDerWaalsContact O-CD1 3.31Å; F64-W112 PolarHBondContact O-NE1 3.15Å; I66-W112 HydrophobicContact CD1-CH2 3.76Å; I66-W112 HydrophobicContact CD1-CZ2 3.54Å; I66-W112 HydrophobicContact CG1-CZ2 4.35Å; L106-W112 HydrophobicContact CD2-CH2 3.79Å; L106-W112 HydrophobicContact CD2-CZ2 4.13Å; S110-W112 PolarHBondContact O-N 3.12Å; W112-C114 PolarHBondContact O-N 3.21Å; W112-L128 HydrophobicContact CB-CD2 3.98Å; W112-V130 HydrophobicContact CE3-CG1 4.39Å; W112-V130 HydrophobicContact CE3-CG2 3.83Å; W112-V130 HydrophobicContact CZ3-CG1 4.13Å; W112-V130 HydrophobicContact CZ3-CG2 4.23Å; W112-L147 HydrophobicContact CE3-CD1 4.4Å; W112-L147 HydrophobicContact CH2-CD1 3.92Å; W112-L147 HydrophobicContact CZ3-CD1 3.67Å
113	P	91.2	Very high	85.2	Confident	36 Å²	36	54.9 Å²	54.9	23%	0.234	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	132.2	171.2	27	-34.3	0	0	0	110.5	N129	P113-N129 WeakPolarHBondContact CG-O 3.3Å; P113-N129 PolarHBondContact O-N 3.43Å
114	C	91.6	Very high	86.5	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	166.4	-177.5	76.9	0	0	0	0	112.1	S59 G60 A62 W112 V126 K127 L128	S59-C114 CarbonylContact C-O 3.59Å; S59-C114 WeakPolarHBondContact CA-O 3.45Å; G60-C114 VanDerWaalsContact C-SG 3.54Å; G60-C114 PolarHBondContact N-O 3.05Å; G60-C114 PolarHBondContact O-N 3.42Å; G60-C114 VanDerWaalsContact O-O 3.14Å; G60-C114 PolarHBondContact O-SG 3.45Å; A62-C114 HydrophobicContact CB-CB 4.25Å; W112-C114 PolarHBondContact O-N 3.21Å; C114-V126 HydrophobicContact CB-CB 4.28Å; C114-K127 CarbonylContact C-O 3.54Å; C114-K127 VanDerWaalsContact CA-O 3.23Å; C114-K127 WeakPolarHBondContact CA-O 3.47Å; C114-K127 VanDerWaalsContact CB-O 3.32Å; C114-K127 WeakPolarHBondContact CB-O 3.34Å; C114-L128 HydrophobicContact CB-CD2 4.28Å
115	R	92.1	Very high	87.7	Confident	124 Å²	124	54.3 Å²	54.3	47%	0.468	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.1	168	171.7	171.1	-78.5	-79.4	-8.2	108.6	G57 V117 K127	G57-R115 PolarHBondContact O-NH1 2.69Å; R115-V117 PolarHBondContact O-N 3.38Å; R115-K127 PolarHBondContact N-O 2.81Å; R115-K127 PolarHBondContact O-N 3.01Å
116	V	92	Very high	88.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	118.9	177.8	-174.3	0	0	0	0	108.9	V54 G57 Q58 I119 V126 L159	V54-V116 HydrophobicContact CB-CG2 4.34Å; V54-V116 HydrophobicContact CG1-CG2 3.58Å; G57-V116 PolarHBondContact N-O 3.05Å; Q58-V116 PolarHBondContact O-N 2.71Å; V116-I119 HydrophobicContact CG1-CD1 4.03Å; V116-I119 HydrophobicContact CG1-CG1 3.64Å; V116-V126 HydrophobicContact CG2-CG1 4.37Å; V116-L159 HydrophobicContact CG1-CD2 4.48Å; V116-L159 HydrophobicContact CG2-CD1 3.98Å; V116-L159 HydrophobicContact CG2-CD2 3.85Å
117	V	92.5	Very high	89.5	Confident	85 Å²	85	56.7 Å²	56.7	52%	0.515	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-46.3	-179.7	-176.8	0	0	0	0	110.3	R115 V125 K127	R115-V117 PolarHBondContact O-N 3.38Å; V117-V125 HydrophobicContact CB-CB 4.41Å; V117-V125 HydrophobicContact CB-CG1 4.21Å; V117-V125 WeakPolarHBondContact CB-O 3.23Å; V117-V125 PolarHBondContact N-O 3.03Å; V117-K127 HydrophobicContact CG2-CB 4.05Å
118	K	91.9	Very high	90.2	Very high	133 Å²	133	54.1 Å²	54.1	58%	0.578	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.6	141.9	-178.6	-172.5	172.2	-176.6	174.4	0	110.3	A124 V125	K118-A124 CarbonylContact O-C 3.57Å; K118-A124 WeakPolarHBondContact O-CA 3.27Å; K118-V125 HydrophobicContact CB-CB 4.39Å; K118-V125 PolarHBondContact N-O 2.96Å; K118-V125 PolarHBondContact O-N 3.34Å
119	I	90.5	Very high	90.6	Very high	36 Å²	36	57.8 Å²	57.8	19%	0.185	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.2	168.4	-58.4	179.8	0	0	0	107.8	V54 P56 V116 A124	V54-I119 WeakPolarHBondContact O-CD1 3.36Å; P56-I119 HydrophobicContact CG-CB 4.31Å; P56-I119 HydrophobicContact CG-CG1 4.18Å; V116-I119 HydrophobicContact CG1-CD1 4.03Å; V116-I119 HydrophobicContact CG1-CG1 3.64Å; I119-A124 HydrophobicContact CG1-CB 4.09Å
120	R	89.1	Confident	90.7	Very high	175 Å²	175	55.9 Å²	55.9	66%	0.66	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	119.2	172.4	174.1	173.1	-175	170.7	8.9	108.5	D122 V123	R120-D122 PolarHBondContact O-N 3.29Å; R120-V123 PolarHBondContact N-O 2.89Å; R120-V123 VanDerWaalsContact O-CG2 3.23Å; R120-V123 WeakPolarHBondContact O-CG2 3.28Å; R120-V123 PolarHBondContact O-N 3.42Å
121	D	86	Confident	90.5	Very high	118 Å²	118	60.2 Å²	60.2	63%	0.631	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	-119.6	175.5	-46.3	-43.2	0	0	0	110.5
122	D	89.4	Confident	90.2	Very high	127 Å²	127	60.8 Å²	60.8	68%	0.679	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	3.9	178.1	-74.6	-43.3	0	0	0	115	R120 R156	R120-D122 PolarHBondContact O-N 3.29Å; D122-R156 WeakPolarHBondContact O-CB 3.25Å; D122-R156 PolarHBondContact O-N 2.93Å
123	V	91.3	Very high	89.9	Confident	65 Å²	65	62 Å²	62	39%	0.394	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.9	-176.5	-65.7	0	0	0	0	113.8	R120 I153 V154	R120-V123 PolarHBondContact N-O 2.89Å; R120-V123 VanDerWaalsContact O-CG2 3.23Å; R120-V123 WeakPolarHBondContact O-CG2 3.28Å; R120-V123 PolarHBondContact O-N 3.42Å; V123-I153 HydrophobicContact CB-CG2 4.11Å; V123-I153 HydrophobicContact CG1-CG2 4.46Å; V123-V154 WeakPolarHBondContact CA-O 3.44Å
124	A	90	Very high	89.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.2	176.1	0	0	0	0	0	110.7	K118 I119 V126 V154 L159	K118-A124 CarbonylContact O-C 3.57Å; K118-A124 WeakPolarHBondContact O-CA 3.27Å; I119-A124 HydrophobicContact CG1-CB 4.09Å; A124-V126 HydrophobicContact CB-CG1 4.23Å; A124-V154 HydrophobicContact CB-CG2 4.19Å; A124-V154 PolarHBondContact N-O 2.77Å; A124-V154 PolarHBondContact O-N 3.15Å; A124-L159 HydrophobicContact CB-CD2 3.57Å
125	V	92.7	Very high	89.1	Confident	51 Å²	51	71.5 Å²	71.5	31%	0.309	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	114.9	165.6	-175.1	0	0	0	0	107	V117 K118 E152 I153	V117-V125 HydrophobicContact CB-CB 4.41Å; V117-V125 HydrophobicContact CB-CG1 4.21Å; V117-V125 WeakPolarHBondContact CB-O 3.23Å; V117-V125 PolarHBondContact N-O 3.03Å; K118-V125 HydrophobicContact CB-CB 4.39Å; K118-V125 PolarHBondContact N-O 2.96Å; K118-V125 PolarHBondContact O-N 3.34Å; V125-E152 WeakPolarHBondContact CA-O 3.46Å; V125-I153 HydrophobicContact CG2-CG1 4.48Å
126	V	92	Very high	88.6	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	147.5	-179.7	-63.4	0	0	0	0	110	A62 C114 V116 A124 T151 E152 V154 L159	A62-V126 HydrophobicContact CB-CG2 4.2Å; C114-V126 HydrophobicContact CB-CB 4.28Å; V116-V126 HydrophobicContact CG2-CG1 4.37Å; A124-V126 HydrophobicContact CB-CG1 4.23Å; V126-T151 CarbonylContact O-C 3.59Å; V126-T151 VanDerWaalsContact O-CA 3.32Å; V126-T151 WeakPolarHBondContact O-CA 3.41Å; V126-E152 HydrophobicContact CG2-CB 4.28Å; V126-E152 PolarHBondContact N-O 3.39Å; V126-E152 PolarHBondContact O-N 3.28Å; V126-V154 HydrophobicContact CB-CG2 4.48Å; V126-V154 HydrophobicContact CG1-CG2 3.79Å; V126-V154 HydrophobicContact CG2-CB 4.47Å; V126-V154 HydrophobicContact CG2-CG1 3.83Å; V126-V154 HydrophobicContact CG2-CG2 3.83Å; V126-L159 HydrophobicContact CG1-CD1 4.26Å; V126-L159 HydrophobicContact CG1-CD2 4.36Å
127	K	92.8	Very high	88.3	Confident	88 Å²	88	69.2 Å²	69.2	38%	0.383	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.1	168.1	-175.4	176.8	174.5	-177.9	0	108.5	C114 R115 V117 S148 V150 T151	C114-K127 CarbonylContact C-O 3.54Å; C114-K127 VanDerWaalsContact CA-O 3.23Å; C114-K127 WeakPolarHBondContact CA-O 3.47Å; C114-K127 VanDerWaalsContact CB-O 3.32Å; C114-K127 WeakPolarHBondContact CB-O 3.34Å; R115-K127 PolarHBondContact N-O 2.81Å; R115-K127 PolarHBondContact O-N 3.01Å; V117-K127 HydrophobicContact CG2-CB 4.05Å; K127-S148 WeakPolarHBondContact CE-O 3.24Å; K127-S148 PolarHBondContact NZ-O 2.91Å; K127-V150 WeakPolarHBondContact CA-O 3.49Å; K127-T151 HydrophobicContact CB-CG2 4.05Å; K127-T151 HydrophobicContact CD-CG2 4.2Å; K127-T151 HydrophobicContact CG-CG2 3.9Å
128	L	90.5	Very high	87.8	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.021	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	149.8	176.6	-57.6	-176.2	0	0	0	110.6	F64 W112 C114 V130 L147 V150	F64-L128 HydrophobicContact CD1-CD1 4.07Å; F64-L128 HydrophobicContact CE1-CD1 4.06Å; W112-L128 HydrophobicContact CB-CD2 3.98Å; C114-L128 HydrophobicContact CB-CD2 4.28Å; L128-V130 HydrophobicContact CB-CG2 4.19Å; L128-L147 WeakPolarHBondContact CB-O 3.06Å; L128-L147 HydrophobicContact CD1-CD2 4.29Å; L128-V150 HydrophobicContact CD1-CB 4.2Å; L128-V150 HydrophobicContact CD1-CG1 4.41Å; L128-V150 HydrophobicContact CG-CB 4.45Å; L128-V150 PolarHBondContact N-O 3.01Å; L128-V150 VanDerWaalsContact N-O 3.09Å
129	N	90	Very high	87.1	Confident	85 Å²	85	67.1 Å²	67.1	46%	0.455	38%	0.383	S	S	.	.			trans	-139.4	69.6	-174.6	-173.5	90.4	0	0	0	109	P113	P113-N129 WeakPolarHBondContact CG-O 3.3Å; P113-N129 PolarHBondContact O-N 3.43Å
130	V	87.6	Confident	86.7	Confident	4 Å²	4	66 Å²	66	2%	0.024	38%	0.377	C	S	.	.			trans	-94.7	100.9	-169.1	-171.6	0	0	0	0	110.2	L10 W112 L128 C144 L147 S148	L10-V130 HydrophobicContact CB-CG1 4.4Å; L10-V130 WeakPolarHBondContact O-CG1 3.12Å; W112-V130 HydrophobicContact CE3-CG1 4.39Å; W112-V130 HydrophobicContact CE3-CG2 3.83Å; W112-V130 HydrophobicContact CZ3-CG1 4.13Å; W112-V130 HydrophobicContact CZ3-CG2 4.23Å; L128-V130 HydrophobicContact CB-CG2 4.19Å; V130-C144 HydrophobicContact CG1-CB 4.2Å; V130-L147 HydrophobicContact CB-CB 4.33Å; V130-L147 HydrophobicContact CG2-CB 3.86Å; V130-L147 HydrophobicContact CG2-CD1 4.33Å; V130-S148 PolarHBondContact N-OG 2.82Å; V130-S148 PolarHBondContact O-OG 3.44Å
131	T	86.1	Confident	86.4	Confident	91 Å²	91	61.3 Å²	61.3	56%	0.558	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-74.3	129.2	171.7	-47.2	0	0	0	0	109.7	N11	N11-T131 PolarHBondContact ND2-O 2.97Å
132	P	84.5	Confident	86.3	Confident	49 Å²	49	58.3 Å²	58.3	32%	0.318	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-66	151.2	173	27.7	-34	0	0	0	111.5	A136 I141 C144	P132-A136 HydrophobicContact CB-CB 3.96Å; P132-I141 HydrophobicContact CB-CG1 4.23Å; P132-C144 HydrophobicContact CB-CB 4.09Å
133	P	83.2	Confident	85.9	Confident	24 Å²	24	52.5 Å²	52.5	16%	0.156	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-64.1	159.8	170.3	27.8	-33.6	0	0	0	111.4	D135 A136	P133-D135 VanDerWaalsContact C-N 3.28Å; P133-D135 PolarHBondContact O-N 3.07Å; P133-A136 HydrophobicContact CG-CB 3.91Å; P133-A136 WeakPolarHBondContact O-CB 3.41Å; P133-A136 PolarHBondContact O-N 3.01Å
134	A	82.9	Confident	85.6	Confident	107 Å²	107	49.4 Å²	49.4	88%	0.884	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-39.5	179.4	0	0	0	0	0	112.3	A136	A134-A136 VanDerWaalsContact C-N 3.26Å; A134-A136 PolarHBondContact O-N 3.03Å
135	D	84.5	Confident	85.4	Confident	134 Å²	134	53.5 Å²	53.5	72%	0.717	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	32.5	179.4	-41.2	-65.3	0	0	0	112.2	R9 P133	R9-D135 PolarHBondContact NH2-O 3.47Å; P133-D135 VanDerWaalsContact C-N 3.28Å; P133-D135 PolarHBondContact O-N 3.07Å
136	A	81.7	Confident	85	Confident	19 Å²	19	53 Å²	53	16%	0.157	32%	0.323	C	S	.	.			trans	-72.4	135.8	-177.7	0	0	0	0	0	112.7	P132 P133 A134 E140 I141	P132-A136 HydrophobicContact CB-CB 3.96Å; P133-A136 HydrophobicContact CG-CB 3.91Å; P133-A136 WeakPolarHBondContact O-CB 3.41Å; P133-A136 PolarHBondContact O-N 3.01Å; A134-A136 VanDerWaalsContact C-N 3.26Å; A134-A136 PolarHBondContact O-N 3.03Å; A136-E140 HydrophobicContact CB-CB 4.28Å; A136-I141 HydrophobicContact CB-CD1 4.15Å; A136-I141 HydrophobicContact CB-CG1 3.59Å
137	T	84.4	Confident	84.7	Confident	58 Å²	58	53 Å²	53	36%	0.356	32%	0.322	S	S	.	.			trans	-69.8	158	167.3	59	0	0	0	0	111.2	S139 E140 I141	T137-S139 PolarHBondContact O-N 2.71Å; T137-S139 PolarHBondContact OG1-OG 3.15Å; T137-S139 VanDerWaalsContact OG1-OG 3.07Å; T137-E140 WeakPolarHBondContact CB-OE2 3.46Å; T137-E140 WeakPolarHBondContact CG2-OE2 3.45Å; T137-E140 PolarHBondContact N-OE2 3.34Å; T137-E140 PolarHBondContact O-N 3.41Å; T137-E140 VanDerWaalsContact O-N 3.08Å; T137-E140 VanDerWaalsContact OG1-CD 3.26Å; T137-E140 WeakPolarHBondContact OG1-CG 3.35Å; T137-E140 PolarHBondContact OG1-N 2.85Å; T137-E140 PolarHBondContact OG1-OE2 3.39Å; T137-I141 WeakPolarHBondContact O-CG1 3.14Å; T137-I141 PolarHBondContact O-N 2.97Å
138	P	82.6	Confident	84.4	Confident	112 Å²	112	50.2 Å²	50.2	73%	0.727	31%	0.314	S	S	*	.	H	α-helix	trans	-58.1	-32.4	177.8	-26.5	36	0	0	0	114.1	S142	P138-S142 PolarHBondContact O-N 2.88Å
139	S	76.9	Confident	84.2	Confident	61 Å²	61	54.6 Å²	54.6	43%	0.427	34%	0.341	S	S	.	.	H	α-helix	trans	-64.9	-47.1	172.6	33.4	0	0	0	0	111.8	T137 I141 S142 L143	T137-S139 PolarHBondContact O-N 2.71Å; T137-S139 PolarHBondContact OG1-OG 3.15Å; T137-S139 VanDerWaalsContact OG1-OG 3.07Å; S139-I141 PolarHBondContact O-N 3.26Å; S139-S142 WeakPolarHBondContact O-CB 3.34Å; S139-S142 PolarHBondContact O-N 3.43Å; S139-L143 WeakPolarHBondContact O-CB 3.33Å; S139-L143 PolarHBondContact O-N 3.38Å
140	E	81.6	Confident	83.9	Confident	12 Å²	12	51 Å²	51	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-36.1	176	-69.5	168	119.8	0	0	112.9	R9 L10 A136 T137 S142 L143 C144	R9-E140 WeakPolarHBondContact CG-OE1 3.43Å; R9-E140 IonicContact CZ-OE1 3.37Å; R9-E140 IonicContact CZ-OE2 3.69Å; R9-E140 IonicContact NE-OE1 2.67Å; R9-E140 PolarHBondContact NE-OE1 2.76Å; R9-E140 IonicContact NE-OE2 3.77Å; R9-E140 IonicContact NH2-OE1 3.22Å; R9-E140 PolarHBondContact NH2-OE1 3.22Å; R9-E140 IonicContact NH2-OE2 2.76Å; R9-E140 PolarHBondContact NH2-OE2 3.04Å; L10-E140 HydrophobicContact CD2-CB 4.37Å; L10-E140 HydrophobicContact CD2-CG 4.3Å; A136-E140 HydrophobicContact CB-CB 4.28Å; T137-E140 WeakPolarHBondContact CB-OE2 3.46Å; T137-E140 WeakPolarHBondContact CG2-OE2 3.45Å; T137-E140 PolarHBondContact N-OE2 3.34Å; T137-E140 PolarHBondContact O-N 3.41Å; T137-E140 VanDerWaalsContact O-N 3.08Å; T137-E140 VanDerWaalsContact OG1-CD 3.26Å; T137-E140 WeakPolarHBondContact OG1-CG 3.35Å; T137-E140 PolarHBondContact OG1-N 2.85Å; T137-E140 PolarHBondContact OG1-OE2 3.39Å; E140-S142 VanDerWaalsContact C-N 3.33Å; E140-L143 PolarHBondContact O-N 2.99Å; E140-C144 WeakPolarHBondContact O-CB 3.4Å; E140-C144 PolarHBondContact O-N 3.44Å; E140-C144 PolarHBondContact O-SG 2.96Å
141	I	84.2	Confident	84	Confident	77 Å²	77	55.1 Å²	55.1	40%	0.395	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-42.5	173.5	-64.1	169.4	0	0	0	110	P132 A136 T137 S139 T145	P132-I141 HydrophobicContact CB-CG1 4.23Å; A136-I141 HydrophobicContact CB-CD1 4.15Å; A136-I141 HydrophobicContact CB-CG1 3.59Å; T137-I141 WeakPolarHBondContact O-CG1 3.14Å; T137-I141 PolarHBondContact O-N 2.97Å; S139-I141 PolarHBondContact O-N 3.26Å; I141-T145 WeakPolarHBondContact O-CB 3.27Å; I141-T145 PolarHBondContact O-N 3Å; I141-T145 PolarHBondContact O-OG1 2.98Å
142	S	83.4	Confident	84	Confident	55 Å²	55	53.5 Å²	53.5	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-46.4	175.5	-162.3	0	0	0	0	111.7	P138 S139 E140 T145 Q146	P138-S142 PolarHBondContact O-N 2.88Å; S139-S142 WeakPolarHBondContact O-CB 3.34Å; S139-S142 PolarHBondContact O-N 3.43Å; E140-S142 VanDerWaalsContact C-N 3.33Å; S142-T145 WeakPolarHBondContact O-CB 3.44Å; S142-T145 PolarHBondContact O-N 3.41Å; S142-Q146 VanDerWaalsContact O-CG 3.29Å; S142-Q146 WeakPolarHBondContact O-CG 3.34Å; S142-Q146 PolarHBondContact O-N 2.96Å; S142-Q146 PolarHBondContact OG-NE2 3.11Å
143	L	81.1	Confident	84.3	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-49.5	178	-164.2	176.7	0	0	0	111.4	L10 L97 L103 L106 S139 E140 T145 Q146 L147	L10-L143 HydrophobicContact CD1-CD1 4.18Å; L10-L143 HydrophobicContact CD1-CD2 3.56Å; L10-L143 HydrophobicContact CD1-CG 4.48Å; L97-L143 HydrophobicContact CD1-CB 3.97Å; L97-L143 HydrophobicContact CD1-CD1 3.8Å; L97-L143 HydrophobicContact CD1-CG 3.68Å; L103-L143 HydrophobicContact CD1-CD1 4.4Å; L106-L143 HydrophobicContact CD1-CD1 4.28Å; S139-L143 WeakPolarHBondContact O-CB 3.33Å; S139-L143 PolarHBondContact O-N 3.38Å; E140-L143 PolarHBondContact O-N 2.99Å; L143-T145 VanDerWaalsContact C-N 3.28Å; L143-T145 PolarHBondContact O-N 3.36Å; L143-Q146 PolarHBondContact O-N 3.44Å; L143-Q146 VanDerWaalsContact O-N 3.16Å; L143-L147 HydrophobicContact CD2-CD1 3.39Å; L143-L147 HydrophobicContact CD2-CG 3.79Å; L143-L147 PolarHBondContact O-N 3.11Å
144	C	85.3	Confident	84.6	Confident	1 Å²	1	56 Å²	56	1%	0.007	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-37.3	174	-72.7	0	0	0	0	112.8	V130 P132 E140 S148	V130-C144 HydrophobicContact CG1-CB 4.2Å; P132-C144 HydrophobicContact CB-CB 4.09Å; E140-C144 WeakPolarHBondContact O-CB 3.4Å; E140-C144 PolarHBondContact O-N 3.44Å; E140-C144 PolarHBondContact O-SG 2.96Å; C144-S148 VanDerWaalsContact O-CB 3.28Å; C144-S148 WeakPolarHBondContact O-CB 3.48Å; C144-S148 PolarHBondContact O-N 2.87Å; C144-S148 PolarHBondContact O-OG 3.37Å
145	T	86.2	Confident	84.9	Confident	85 Å²	85	53.1 Å²	53.1	52%	0.521	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-45.5	174.8	-55.6	0	0	0	0	111.1	I141 S142 L143 S148 T149	I141-T145 WeakPolarHBondContact O-CB 3.27Å; I141-T145 PolarHBondContact O-N 3Å; I141-T145 PolarHBondContact O-OG1 2.98Å; S142-T145 WeakPolarHBondContact O-CB 3.44Å; S142-T145 PolarHBondContact O-N 3.41Å; L143-T145 VanDerWaalsContact C-N 3.28Å; L143-T145 PolarHBondContact O-N 3.36Å; T145-S148 CarbonylContact O-C 3.56Å; T145-S148 PolarHBondContact O-N 3.33Å; T145-T149 PolarHBondContact O-N 2.74Å
146	Q	83.2	Confident	84.9	Confident	42 Å²	42	51.5 Å²	51.5	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-48.6	178.1	-69.6	169	18.2	0	0	111.8	L81 S142 L143 S148 T149	L81-Q146 HydrophobicContact CD1-CB 4.05Å; S142-Q146 VanDerWaalsContact O-CG 3.29Å; S142-Q146 WeakPolarHBondContact O-CG 3.34Å; S142-Q146 PolarHBondContact O-N 2.96Å; S142-Q146 PolarHBondContact OG-NE2 3.11Å; L143-Q146 PolarHBondContact O-N 3.44Å; L143-Q146 VanDerWaalsContact O-N 3.16Å; Q146-S148 VanDerWaalsContact C-N 3.25Å; Q146-S148 PolarHBondContact O-N 3.09Å; Q146-T149 WeakPolarHBondContact O-CB 3.16Å; Q146-T149 PolarHBondContact O-N 3.28Å; Q146-T149 PolarHBondContact O-OG1 3.43Å
147	L	85.2	Confident	85.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-55.2	-42.7	173.3	-74.5	175.3	0	0	0	111.3	L10 I66 L81 W112 L128 V130 L143 T149 V150	L10-L147 HydrophobicContact CD1-CD1 4.25Å; I66-L147 HydrophobicContact CD1-CD1 4.01Å; I66-L147 HydrophobicContact CD1-CD2 3.8Å; I66-L147 HydrophobicContact CG1-CD2 4.21Å; L81-L147 HydrophobicContact CD2-CD2 3.73Å; W112-L147 HydrophobicContact CE3-CD1 4.4Å; W112-L147 HydrophobicContact CH2-CD1 3.92Å; W112-L147 HydrophobicContact CZ3-CD1 3.67Å; L128-L147 WeakPolarHBondContact CB-O 3.06Å; L128-L147 HydrophobicContact CD1-CD2 4.29Å; V130-L147 HydrophobicContact CB-CB 4.33Å; V130-L147 HydrophobicContact CG2-CB 3.86Å; V130-L147 HydrophobicContact CG2-CD1 4.33Å; L143-L147 HydrophobicContact CD2-CD1 3.39Å; L143-L147 HydrophobicContact CD2-CG 3.79Å; L143-L147 PolarHBondContact O-N 3.11Å; L147-T149 PolarHBondContact O-N 3.33Å; L147-V150 WeakPolarHBondContact O-CB 3.36Å; L147-V150 PolarHBondContact O-N 3.31Å
148	S	87	Confident	85.3	Confident	30 Å²	30	58.4 Å²	58.4	21%	0.21	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	3.1	176.1	-58.4	0	0	0	0	114.9	K127 V130 C144 T145 Q146	K127-S148 WeakPolarHBondContact CE-O 3.24Å; K127-S148 PolarHBondContact NZ-O 2.91Å; V130-S148 PolarHBondContact N-OG 2.82Å; V130-S148 PolarHBondContact O-OG 3.44Å; C144-S148 VanDerWaalsContact O-CB 3.28Å; C144-S148 WeakPolarHBondContact O-CB 3.48Å; C144-S148 PolarHBondContact O-N 2.87Å; C144-S148 PolarHBondContact O-OG 3.37Å; T145-S148 CarbonylContact O-C 3.56Å; T145-S148 PolarHBondContact O-N 3.33Å; Q146-S148 VanDerWaalsContact C-N 3.25Å; Q146-S148 PolarHBondContact O-N 3.09Å
149	T	86	Confident	85.6	Confident	96 Å²	96	53.8 Å²	53.8	59%	0.589	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-20	163.8	69.2	0	0	0	0	113.5	T145 Q146 L147 T151	T145-T149 PolarHBondContact O-N 2.74Å; Q146-T149 WeakPolarHBondContact O-CB 3.16Å; Q146-T149 PolarHBondContact O-N 3.28Å; Q146-T149 PolarHBondContact O-OG1 3.43Å; L147-T149 PolarHBondContact O-N 3.33Å; T149-T151 PolarHBondContact O-N 3.08Å
150	V	85.1	Confident	86.2	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	28%	0.28	C	S	.	.			trans	-65.6	129.1	-176	-179.8	0	0	0	0	111.1	F64 P82 K127 L128 L147	F64-V150 HydrophobicContact CZ-CG1 4.39Å; P82-V150 HydrophobicContact CG-CG1 4.17Å; K127-V150 WeakPolarHBondContact CA-O 3.49Å; L128-V150 HydrophobicContact CD1-CB 4.2Å; L128-V150 HydrophobicContact CD1-CG1 4.41Å; L128-V150 HydrophobicContact CG-CB 4.45Å; L128-V150 PolarHBondContact N-O 3.01Å; L128-V150 VanDerWaalsContact N-O 3.09Å; L147-V150 WeakPolarHBondContact O-CB 3.36Å; L147-V150 PolarHBondContact O-N 3.31Å
151	T	88.3	Confident	86.3	Confident	90 Å²	90	54.7 Å²	54.7	55%	0.552	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.8	172.4	55.7	0	0	0	0	109.2	V126 K127 T149	V126-T151 CarbonylContact O-C 3.59Å; V126-T151 VanDerWaalsContact O-CA 3.32Å; V126-T151 WeakPolarHBondContact O-CA 3.41Å; K127-T151 HydrophobicContact CB-CG2 4.05Å; K127-T151 HydrophobicContact CD-CG2 4.2Å; K127-T151 HydrophobicContact CG-CG2 3.9Å; T149-T151 PolarHBondContact O-N 3.08Å
152	E	87.5	Confident	85.8	Confident	57 Å²	57	53.1 Å²	53.1	27%	0.266	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155.5	-170.2	-168.3	51.6	-107.2	0	0	111.4	F64 V125 V126 V154	F64-E152 HydrophobicContact CD2-CG 3.99Å; F64-E152 HydrophobicContact CE2-CB 4.43Å; F64-E152 HydrophobicContact CE2-CG 3.9Å; V125-E152 WeakPolarHBondContact CA-O 3.46Å; V126-E152 HydrophobicContact CG2-CB 4.28Å; V126-E152 PolarHBondContact N-O 3.39Å; V126-E152 PolarHBondContact O-N 3.28Å; E152-V154 HydrophobicContact CB-CG1 4.46Å; E152-V154 HydrophobicContact CG-CG1 4.07Å
153	I	89.7	Confident	84.9	Confident	113 Å²	113	50.9 Å²	50.9	58%	0.579	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	95.4	174.8	-53.4	-178	0	0	0	108.8	V123 V125	V123-I153 HydrophobicContact CB-CG2 4.11Å; V123-I153 HydrophobicContact CG1-CG2 4.46Å; V125-I153 HydrophobicContact CG2-CG1 4.48Å
154	V	88.6	Confident	83.8	Confident	12 Å²	12	57.8 Å²	57.8	7%	0.073	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	154.7	-179	-59	0	0	0	0	111.6	V123 A124 V126 E152 L159	V123-V154 WeakPolarHBondContact CA-O 3.44Å; A124-V154 HydrophobicContact CB-CG2 4.19Å; A124-V154 PolarHBondContact N-O 2.77Å; A124-V154 PolarHBondContact O-N 3.15Å; V126-V154 HydrophobicContact CB-CG2 4.48Å; V126-V154 HydrophobicContact CG1-CG2 3.79Å; V126-V154 HydrophobicContact CG2-CB 4.47Å; V126-V154 HydrophobicContact CG2-CG1 3.83Å; V126-V154 HydrophobicContact CG2-CG2 3.83Å; E152-V154 HydrophobicContact CB-CG1 4.46Å; E152-V154 HydrophobicContact CG-CG1 4.07Å; V154-L159 HydrophobicContact CG2-CB 4.37Å
155	S	89.7	Confident	82.3	Confident	46 Å²	46	63.3 Å²	63.3	32%	0.322	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	152	168.9	90.6	0	0	0	0	110.4	K157 S158	S155-K157 PolarHBondContact O-N 3.28Å; S155-K157 PolarHBondContact OG-N 3.33Å; S155-S158 WeakPolarHBondContact O-CA 3.5Å; S155-S158 VanDerWaalsContact O-CB 3.29Å; S155-S158 WeakPolarHBondContact O-CB 3.38Å; S155-S158 PolarHBondContact O-N 3.41Å; S155-S158 PolarHBondContact OG-N 3.43Å; S155-S158 PolarHBondContact OG-OG 3.18Å
156	R	85.5	Confident	81	Confident	100 Å²	100	60.7 Å²	60.7	38%	0.377	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.4	174.8	-170.3	170.5	176.4	179.9	-6.6	113	D53 D122 S158	D53-R156 IonicContact OD1-CZ 3.54Å; D53-R156 IonicContact OD1-NE 3.03Å; D53-R156 PolarHBondContact OD1-NE 3.23Å; D53-R156 VanDerWaalsContact OD1-NE 3.1Å; D53-R156 IonicContact OD1-NH2 3.02Å; D53-R156 PolarHBondContact OD1-NH2 3.07Å; D53-R156 IonicContact OD2-CZ 3.43Å; D53-R156 IonicContact OD2-NH2 3.79Å; D53-R156 PolarHBondContact OD2-NH2 3.11Å; D122-R156 WeakPolarHBondContact O-CB 3.25Å; D122-R156 PolarHBondContact O-N 2.93Å; R156-S158 VanDerWaalsContact C-N 3.29Å
157	K	86.6	Confident	80	Confident	192 Å²	192	63.3 Å²	63.3	84%	0.835	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-79.2	-11.6	171.6	-59.7	176.6	-176.7	172.9	0	113.2	S155	S155-K157 PolarHBondContact O-N 3.28Å; S155-K157 PolarHBondContact OG-N 3.33Å
158	S	87.8	Confident	79.1	Confident	30 Å²	30	66.3 Å²	66.3	21%	0.21	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-101.6	14.7	177.5	-51.6	0	0	0	0	111.7	A62 L63 S155 R156	A62-S158 CarbonylContact C-O 3.56Å; A62-S158 WeakPolarHBondContact CA-O 3.5Å; L63-S158 PolarHBondContact N-O 3.06Å; S155-S158 WeakPolarHBondContact O-CA 3.5Å; S155-S158 VanDerWaalsContact O-CB 3.29Å; S155-S158 WeakPolarHBondContact O-CB 3.38Å; S155-S158 PolarHBondContact O-N 3.41Å; S155-S158 PolarHBondContact OG-N 3.43Å; S155-S158 PolarHBondContact OG-OG 3.18Å; R156-S158 VanDerWaalsContact C-N 3.29Å
159	L	88.4	Confident	78.4	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.6	-175.3	174	62.6	0	0	0	109.7	V54 E61 V116 A124 V126 V154	V54-L159 HydrophobicContact CB-CD2 4.31Å; V54-L159 HydrophobicContact CB-CG 4.35Å; V54-L159 HydrophobicContact CG2-CD1 4.32Å; V54-L159 HydrophobicContact CG2-CD2 4.48Å; V54-L159 HydrophobicContact CG2-CG 3.99Å; E61-L159 WeakPolarHBondContact O-CA 3.43Å; V116-L159 HydrophobicContact CG1-CD2 4.48Å; V116-L159 HydrophobicContact CG2-CD1 3.98Å; V116-L159 HydrophobicContact CG2-CD2 3.85Å; A124-L159 HydrophobicContact CB-CD2 3.57Å; V126-L159 HydrophobicContact CG1-CD1 4.26Å; V126-L159 HydrophobicContact CG1-CD2 4.36Å; V154-L159 HydrophobicContact CG2-CB 4.37Å
160	R	89	Confident	77.8	Confident	36 Å²	36	62.4 Å²	62.4	14%	0.136	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	166.8	177.7	64.9	-174.4	-171.9	-172.1	2.6	111.7	E5 V54 G60 E61 W111	E5-R160 IonicContact OE1-CZ 3.23Å; E5-R160 VanDerWaalsContact OE1-CZ 3.27Å; E5-R160 IonicContact OE1-NH1 3.95Å; E5-R160 PolarHBondContact OE1-NH1 2.89Å; E5-R160 IonicContact OE1-NH2 2.69Å; E5-R160 PolarHBondContact OE1-NH2 3.23Å; E5-R160 IonicContact OE2-CZ 3.44Å; E5-R160 IonicContact OE2-NH1 3.89Å; E5-R160 IonicContact OE2-NH2 2.6Å; E5-R160 PolarHBondContact OE2-NH2 2.69Å; V54-R160 WeakPolarHBondContact CG2-O 3.3Å; G60-R160 CarbonylContact C-O 3.51Å; G60-R160 VanDerWaalsContact CA-O 3.24Å; G60-R160 WeakPolarHBondContact CA-O 3.4Å; E61-R160 HydrophobicContact CB-CG 3.92Å; E61-R160 PolarHBondContact N-O 2.93Å; E61-R160 PolarHBondContact O-N 3.07Å; E61-R160 IonicContact OE2-CZ 2.69Å; E61-R160 VanDerWaalsContact OE2-CZ 3.26Å; E61-R160 IonicContact OE2-NE 3.38Å; E61-R160 PolarHBondContact OE2-NE 3.27Å; E61-R160 IonicContact OE2-NH2 2.66Å; E61-R160 PolarHBondContact OE2-NH2 3.29Å; W111-R160 VanDerWaalsContact CD1-NH2 3.32Å; W111-R160 VanDerWaalsContact CD2-CZ 3.42Å; W111-R160 HydrophobicContact CE3-CG 3.98Å; W111-R160 HydrophobicContact CH2-CG 4.39Å; W111-R160 HydrophobicContact CZ3-CB 4.47Å; W111-R160 HydrophobicContact CZ3-CG 3.8Å
161	Q	84.1	Confident	77.4	Confident	56 Å²	56	65.7 Å²	65.7	26%	0.262	36%	0.359	S	S	.	.			trans	-66.4	152.1	171	-71.2	-169.9	-0	0	0	111.1	R52 D53 V54	R52-Q161 VanDerWaalsContact CB-CD 3.42Å; R52-Q161 HydrophobicContact CB-CG 4.03Å; D53-Q161 PolarHBondContact O-NE2 3.21Å; V54-Q161 HydrophobicContact CG2-CG 3.93Å
162	P	74.6	Confident	76.9	Confident	43 Å²	43	67.5 Å²	67.5	28%	0.279	37%	0.365	S	S	.	.			trans	-63.5	139.4	175.2	-15.7	31.4	0	0	0	110.4	S59 D164	S59-P162 WeakPolarHBondContact O-CD 3.45Å; P162-D164 PolarHBondContact O-N 3.18Å
163	S	63.3	Low	76.6	Confident	9 Å²	9	68 Å²	68	6%	0.063	37%	0.368	C	S	.	.			trans	-86.6	45.6	-171.9	-40.3	0	0	0	0	113	P48 E61 D165 C166	P48-S163 WeakPolarHBondContact CG-OG 3.28Å; E61-S163 PolarHBondContact OE1-N 2.9Å; E61-S163 VanDerWaalsContact OE1-N 3.08Å; E61-S163 PolarHBondContact OE1-OG 3.04Å; S163-D165 PolarHBondContact O-N 3.23Å; S163-C166 WeakPolarHBondContact O-CB 3.44Å; S163-C166 PolarHBondContact O-N 2.9Å
164	D	58.6	Low	76.3	Confident	150 Å²	150	63.3 Å²	63.3	80%	0.802	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.1	177	-63.1	-33	0	0	0	111.5	P162 C166	P162-D164 PolarHBondContact O-N 3.18Å; D164-C166 PolarHBondContact O-N 2.99Å
165	D	53.8	Low	76.2	Confident	116 Å²	116	65.8 Å²	65.8	62%	0.62	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-7.7	172.3	-76.3	-12.6	0	0	0	113.6	R52 S163 P167	R52-D165 IonicContact CZ-OD2 3.74Å; R52-D165 IonicContact NH1-OD2 3.46Å; R52-D165 PolarHBondContact NH1-OD2 3.05Å; R52-D165 IonicContact NH2-OD2 3.81Å; R52-D165 PolarHBondContact NH2-OD2 2.89Å; R52-D165 VanDerWaalsContact NH2-OD2 3.07Å; S163-D165 PolarHBondContact O-N 3.23Å; D165-P167 WeakPolarHBondContact O-CD 3.42Å
166	C	59.3	Low	76.2	Confident	31 Å²	31	68.2 Å²	68.2	21%	0.209	36%	0.357	C	S	.	.	S	Bend	trans	-111.9	100.6	-174.3	-167.2	0	0	0	0	111.9	L46 S163 D164	L46-C166 PolarHBondContact O-SG 2.7Å; L46-C166 VanDerWaalsContact O-SG 3.35Å; S163-C166 WeakPolarHBondContact O-CB 3.44Å; S163-C166 PolarHBondContact O-N 2.9Å; D164-C166 PolarHBondContact O-N 2.99Å
167	P	61.3	Low	76.4	Confident	97 Å²	97	65.7 Å²	65.7	63%	0.63	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-63.9	153.4	178.3	27.4	-34.6	0	0	0	111.7	D165	D165-P167 WeakPolarHBondContact O-CD 3.42Å
168	C	66.8	Low	76.6	Confident	62 Å²	62	63.1 Å²	63.1	42%	0.419	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-57.4	152.1	167.2	-55.1	0	0	0	0	110.1	K42 V44 S170	K42-C168 PolarHBondContact O-SG 3.12Å; V44-C168 CarbonylContact O-C 3.48Å; V44-C168 WeakPolarHBondContact O-CA 3.35Å; C168-S170 PolarHBondContact O-N 2.86Å
169	L	73	Confident	76.8	Confident	9 Å²	9	61.9 Å²	61.9	5%	0.047	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-56.2	125.9	178	-72.6	173.9	0	0	0	110.2	I4 I41 V44 L46 I174	I4-L169 HydrophobicContact CG2-CD1 4.08Å; I41-L169 HydrophobicContact CD1-CB 4.12Å; I41-L169 HydrophobicContact CG1-CB 3.79Å; I41-L169 WeakPolarHBondContact CG1-O 3.43Å; V44-L169 HydrophobicContact CB-CD1 4.07Å; V44-L169 HydrophobicContact CG1-CD1 3.61Å; V44-L169 HydrophobicContact CG1-CG 4.49Å; V44-L169 PolarHBondContact O-N 2.79Å; L46-L169 HydrophobicContact CD1-CD2 4.4Å; L46-L169 HydrophobicContact CD2-CD2 4Å; L46-L169 HydrophobicContact CG-CD2 3.82Å; L169-I174 HydrophobicContact CD1-CD1 4.3Å
170	S	72.4	Confident	77	Confident	35 Å²	35	68.8 Å²	68.8	25%	0.245	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-93.4	152.7	162.2	87.2	0	0	0	0	109.2	C168 D172 I173	C168-S170 PolarHBondContact O-N 2.86Å; S170-D172 PolarHBondContact O-N 3.28Å; S170-D172 PolarHBondContact OG-N 2.75Å; S170-D172 PolarHBondContact OG-OD2 2.79Å; S170-I173 PolarHBondContact O-N 3.46Å
171	P	76.7	Confident	77.1	Confident	80 Å²	80	67.5 Å²	67.5	52%	0.519	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-60.6	-29.4	175.7	25.3	-34.2	0	0	0	112.2	I173 I174	P171-I173 VanDerWaalsContact C-N 3.27Å; P171-I173 PolarHBondContact O-N 3.19Å; P171-I174 PolarHBondContact O-N 3.5Å; P171-I174 VanDerWaalsContact O-N 3.08Å
172	D	77.4	Confident	77.3	Confident	127 Å²	127	67 Å²	67	68%	0.679	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-65.3	-28.3	-177.3	-39.4	-72.9	0	0	0	113.4	S170 I174	S170-D172 PolarHBondContact O-N 3.28Å; S170-D172 PolarHBondContact OG-N 2.75Å; S170-D172 PolarHBondContact OG-OD2 2.79Å; D172-I174 VanDerWaalsContact C-N 3.31Å
173	I	81.3	Confident	77.7	Confident	67 Å²	67	72.8 Å²	72.8	34%	0.344	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-74.5	-23.3	177.2	-64.5	166.4	0	0	0	111.1	S170 P171 H175 T222	S170-I173 PolarHBondContact O-N 3.46Å; P171-I173 VanDerWaalsContact C-N 3.27Å; P171-I173 PolarHBondContact O-N 3.19Å; I173-H175 PolarHBondContact O-N 2.76Å; I173-T222 HydrophobicContact CG2-CG2 4.29Å
174	I	84.5	Confident	78.7	Confident	16 Å²	16	79.4 Å²	79.4	8%	0.082	41%	0.406	C	S	.	.			trans	-97.8	95.2	-173.5	-51.6	177.5	0	0	0	110.1	L18 V21 I41 L169 P171 D172 R176 L220	L18-I174 HydrophobicContact CD2-CD1 4.31Å; L18-I174 HydrophobicContact CD2-CG2 4.48Å; V21-I174 HydrophobicContact CG2-CD1 3.89Å; V21-I174 HydrophobicContact CG2-CG2 4.13Å; I41-I174 HydrophobicContact CD1-CD1 4.18Å; L169-I174 HydrophobicContact CD1-CD1 4.3Å; P171-I174 PolarHBondContact O-N 3.5Å; P171-I174 VanDerWaalsContact O-N 3.08Å; D172-I174 VanDerWaalsContact C-N 3.31Å; I174-R176 PolarHBondContact O-N 3.05Å; I174-L220 HydrophobicContact CG2-CB 4.45Å; I174-L220 HydrophobicContact CG2-CD2 4.27Å
175	H	85.9	Confident	80.1	Confident	63 Å²	63	72.4 Å²	72.4	29%	0.292	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.5	175.9	-54	-33.2	0	0	0	110.7	I173 L220 T221 A227	I173-H175 PolarHBondContact O-N 2.76Å; H175-L220 WeakPolarHBondContact O-CA 3.14Å; H175-T221 HydrophobicContact CB-CG2 4.05Å; H175-T221 PolarHBondContact N-O 3.25Å; H175-T221 PolarHBondContact O-N 2.85Å; H175-A227 HydrophobicContact CB-CB 3.96Å
176	R	89.3	Confident	81.6	Confident	97 Å²	97	67.4 Å²	67.4	37%	0.366	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	108.1	177.8	-178.8	172.5	-176.6	174.3	2.4	111.1	V21 I174 Y209 V218 L220	V21-R176 PolarHBondContact O-NH1 3.06Å; V21-R176 VanDerWaalsContact O-NH1 3.14Å; I174-R176 PolarHBondContact O-N 3.05Å; R176-Y209 PolarHBondContact NH2-OH 3.15Å; R176-V218 HydrophobicContact CG-CG1 3.81Å; R176-L220 HydrophobicContact CB-CD2 3.64Å; R176-L220 HydrophobicContact CG-CD2 3.63Å
177	H	90.2	Very high	82.8	Confident	48 Å²	48	72.2 Å²	72.2	22%	0.222	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	141.5	170.6	-161.5	80.6	0	0	0	110.1	V219 V230 E234	H177-V219 HydrophobicContact CB-CB 4.41Å; H177-V219 PolarHBondContact N-O 3.47Å; H177-V219 PolarHBondContact O-N 3.14Å; H177-V230 HydrophobicContact CB-CG1 3.86Å; H177-E234 IonicContact CD2-OE2 3.8Å; H177-E234 IonicContact CE1-OE2 2.72Å; H177-E234 PolarHBondContact CE1-OE2 2.8Å; H177-E234 IonicContact NE2-OE2 3.21Å; H177-E234 PolarHBondContact NE2-OE2 3.14Å
178	R	91.7	Very high	83.9	Confident	137 Å²	137	68.3 Å²	68.3	52%	0.517	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.3	177.4	-59.1	-170.9	-172.1	-160.8	4.3	109.4	L217 V218	R178-L217 WeakPolarHBondContact CA-O 3.32Å; R178-V218 HydrophobicContact CG-CG2 4.49Å
179	I	91.7	Very high	84.8	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.4	177.7	-51.5	175.6	0	0	0	108.3	I181 F198 C216 L217 V230 E234 L238	I179-I181 PolarHBondContact O-N 3.28Å; I179-F198 HydrophobicContact CD1-CE1 4.26Å; I179-F198 HydrophobicContact CD1-CZ 3.74Å; I179-C216 WeakPolarHBondContact O-CA 3.3Å; I179-L217 HydrophobicContact CB-CB 4.23Å; I179-L217 HydrophobicContact CD1-CD2 4.38Å; I179-L217 PolarHBondContact N-O 2.66Å; I179-L217 PolarHBondContact O-N 3.21Å; I179-V230 HydrophobicContact CD1-CG1 4.44Å; I179-E234 HydrophobicContact CD1-CB 3.71Å; I179-E234 HydrophobicContact CG1-CB 4.1Å; I179-E234 HydrophobicContact CG2-CB 4.35Å; I179-L238 HydrophobicContact CG2-CD1 3.8Å; I179-L238 HydrophobicContact CG2-CD2 4.04Å; I179-L238 HydrophobicContact CG2-CG 3.91Å
180	E	91.6	Very high	85.4	Confident	160 Å²	160	67.7 Å²	67.7	75%	0.748	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	122.7	176.4	-65	179.9	-174	0	0	110.7
181	I	90.8	Very high	85.8	Confident	9 Å²	9	69.2 Å²	69.2	5%	0.046	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-101.4	124.3	176.9	-70.5	161.7	0	0	0	109.4	I179 K183 L185 A189 Y210 S215 L217 L238	I179-I181 PolarHBondContact O-N 3.28Å; I181-K183 PolarHBondContact O-N 3.41Å; I181-L185 HydrophobicContact CG2-CB 3.88Å; I181-A189 HydrophobicContact CD1-CB 3.53Å; I181-A189 HydrophobicContact CG1-CB 4.36Å; I181-A189 HydrophobicContact CG2-CB 4.13Å; I181-Y210 HydrophobicContact CB-CE2 4.18Å; I181-Y210 HydrophobicContact CD1-CD2 3.69Å; I181-Y210 HydrophobicContact CD1-CE2 3.48Å; I181-Y210 VanDerWaalsContact CD1-CE2 3.48Å; I181-Y210 HydrophobicContact CG1-CE2 4.4Å; I181-S215 WeakPolarHBondContact CB-O 3.43Å; I181-S215 PolarHBondContact N-O 2.76Å; I181-L217 HydrophobicContact CD1-CB 3.71Å; I181-L217 HydrophobicContact CD1-CD1 4.42Å; I181-L217 HydrophobicContact CG1-CB 4.49Å; I181-L238 HydrophobicContact CG1-CD2 4.38Å
182	P	88.3	Confident	86.1	Confident	45 Å²	45	69.4 Å²	69.4	29%	0.292	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-56.2	129.9	170.8	-23.9	32.5	0	0	0	111.3	E184 L185	P182-E184 PolarHBondContact O-N 3.12Å; P182-L185 HydrophobicContact CG-CD1 4.39Å; P182-L185 WeakPolarHBondContact O-CB 3.49Å; P182-L185 PolarHBondContact O-N 2.82Å
183	K	84.6	Confident	86.2	Confident	166 Å²	166	67 Å²	67	72%	0.722	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-52.1	-30	-171.8	-61.6	-164.8	173.7	-161	0	115.1	I181 L185 A186	I181-K183 PolarHBondContact O-N 3.41Å; K183-L185 PolarHBondContact O-N 3.4Å; K183-L185 VanDerWaalsContact O-N 3.1Å; K183-A186 WeakPolarHBondContact O-CB 3.43Å; K183-A186 PolarHBondContact O-N 3.12Å
184	E	84.3	Confident	86.4	Confident	148 Å²	148	64.5 Å²	64.5	69%	0.692	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-57.7	-20.7	174.1	-61.9	177.7	-169.9	0	0	114.3	P182 W245	P182-E184 PolarHBondContact O-N 3.12Å; E184-W245 HydrophobicContact CB-CZ2 4.39Å; E184-W245 WeakPolarHBondContact O-CZ2 3.43Å; E184-W245 PolarHBondContact O-NE1 3.09Å
185	L	86.7	Confident	86.6	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-106.8	-2.4	-177.3	-50.5	177.3	0	0	0	113.4	I181 P182 K183 D187 F188 A189 L241 R242 W245	I181-L185 HydrophobicContact CG2-CB 3.88Å; P182-L185 HydrophobicContact CG-CD1 4.39Å; P182-L185 WeakPolarHBondContact O-CB 3.49Å; P182-L185 PolarHBondContact O-N 2.82Å; K183-L185 PolarHBondContact O-N 3.4Å; K183-L185 VanDerWaalsContact O-N 3.1Å; L185-D187 PolarHBondContact O-N 3.4Å; L185-F188 PolarHBondContact O-N 3.38Å; L185-A189 PolarHBondContact O-N 2.6Å; L185-L241 HydrophobicContact CD1-CB 4.41Å; L185-R242 HydrophobicContact CD1-CG 3.68Å; L185-R242 HydrophobicContact CD2-CG 4.35Å; L185-W245 HydrophobicContact CD2-CB 3.74Å; L185-W245 HydrophobicContact CD2-CD2 3.65Å; L185-W245 HydrophobicContact CD2-CE3 4.11Å; L185-W245 HydrophobicContact CD2-CG 3.5Å
186	A	86.6	Confident	86.5	Confident	11 Å²	11	65.8 Å²	65.8	9%	0.091	33%	0.33	C	S	.	.	H	α-helix	trans	-54.7	-52.6	-172.8	0	0	0	0	0	112.4	K183 F188 A189 S190 Y210	K183-A186 WeakPolarHBondContact O-CB 3.43Å; K183-A186 PolarHBondContact O-N 3.12Å; A186-F188 PolarHBondContact O-N 3.22Å; A186-A189 PolarHBondContact O-N 2.69Å; A186-A189 VanDerWaalsContact O-N 3.15Å; A186-S190 WeakPolarHBondContact O-CB 3.44Å; A186-S190 PolarHBondContact O-N 2.69Å; A186-S190 PolarHBondContact O-OG 3.48Å; A186-Y210 HydrophobicContact CB-CE1 4.33Å; A186-Y210 VanDerWaalsContact CB-OH 3.27Å; A186-Y210 WeakPolarHBondContact CB-OH 3.29Å
187	D	83.1	Confident	86.3	Confident	131 Å²	131	62.3 Å²	62.3	70%	0.701	32%	0.319	S	S	*	.	H	α-helix	trans	-61.5	-2.6	178.2	-38.2	-16.9	0	0	0	115	L185	L185-D187 PolarHBondContact O-N 3.4Å
188	F	84.9	Confident	86.3	Confident	15 Å²	15	60.1 Å²	60.1	7%	0.066	31%	0.308	C	S	.	.	H	α-helix	trans	-124.9	-18.3	-179.5	-177.5	-106.2	0	0	0	113.2	L185 A186 V194 L241 K244 W245 T248	L185-F188 PolarHBondContact O-N 3.38Å; A186-F188 PolarHBondContact O-N 3.22Å; F188-V194 HydrophobicContact CD1-CG1 4.25Å; F188-V194 HydrophobicContact CD2-CG2 4.39Å; F188-V194 HydrophobicContact CE1-CG1 3.61Å; F188-V194 HydrophobicContact CE1-CG2 4.42Å; F188-V194 HydrophobicContact CE2-CG2 3.91Å; F188-V194 HydrophobicContact CZ-CG1 3.76Å; F188-V194 HydrophobicContact CZ-CG2 3.92Å; F188-V194 WeakPolarHBondContact O-CG2 3.48Å; F188-L241 HydrophobicContact CE1-CD2 4.39Å; F188-K244 HydrophobicContact CE1-CB 3.74Å; F188-K244 HydrophobicContact CZ-CB 3.82Å; F188-W245 HydrophobicContact CD1-CB 3.76Å; F188-W245 HydrophobicContact CD1-CG 4.44Å; F188-W245 HydrophobicContact CE1-CB 4.14Å; F188-W245 HydrophobicContact CG-CB 4.31Å; F188-W245 AromaticContact CG-CD1 4Å; F188-T248 HydrophobicContact CD2-CG2 4.15Å; F188-T248 HydrophobicContact CE2-CG2 3.79Å; F188-T248 WeakPolarHBondContact CE2-OG1 3.4Å
189	A	86.8	Confident	86.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-104.5	2.6	173.6	0	0	0	0	0	112.9	I181 L185 A186 H195 L241	I181-A189 HydrophobicContact CD1-CB 3.53Å; I181-A189 HydrophobicContact CG1-CB 4.36Å; I181-A189 HydrophobicContact CG2-CB 4.13Å; L185-A189 PolarHBondContact O-N 2.6Å; A186-A189 PolarHBondContact O-N 2.69Å; A186-A189 VanDerWaalsContact O-N 3.15Å; A189-H195 WeakPolarHBondContact CA-NE2 3.31Å; A189-H195 PolarHBondContact O-NE2 2.87Å; A189-H195 VanDerWaalsContact O-NE2 3.09Å; A189-L241 HydrophobicContact CB-CD1 4.4Å
190	S	85.4	Confident	85.8	Confident	57 Å²	57	60.7 Å²	60.7	40%	0.399	31%	0.313	S	S	.	.	S	Bend	trans	-76.3	-31.3	166.1	37.1	0	0	0	0	112.4	A186 P192	A186-S190 WeakPolarHBondContact O-CB 3.44Å; A186-S190 PolarHBondContact O-N 2.69Å; A186-S190 PolarHBondContact O-OG 3.48Å; S190-P192 WeakPolarHBondContact O-CD 3.41Å
191	D	80.9	Confident	85.6	Confident	68 Å²	68	53.9 Å²	53.9	36%	0.364	28%	0.282	S	S	.	.	S	Bend	trans	-72.4	114.6	174.4	171.1	13.8	0	0	0	110.8	S193 V194 H195	D191-S193 VanDerWaalsContact CG-OG 3.25Å; D191-S193 PolarHBondContact O-N 3.38Å; D191-S193 VanDerWaalsContact O-N 3.16Å; D191-S193 WeakPolarHBondContact OD1-CB 3.45Å; D191-S193 PolarHBondContact OD1-N 2.66Å; D191-S193 PolarHBondContact OD1-OG 3.17Å; D191-S193 PolarHBondContact OD2-OG 3.17Å; D191-V194 HydrophobicContact CB-CG2 4.2Å; D191-V194 PolarHBondContact O-N 3.32Å; D191-H195 PolarHBondContact O-CD2 2.98Å; D191-H195 VanDerWaalsContact O-CD2 3.31Å
192	P	81.2	Confident	85.5	Confident	84 Å²	84	53.5 Å²	53.5	55%	0.545	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-63.4	-20.9	179.5	27.9	-35.5	0	0	0	113.4	S190 V194 H195 L208	S190-P192 WeakPolarHBondContact O-CD 3.41Å; P192-V194 VanDerWaalsContact C-N 3.28Å; P192-V194 PolarHBondContact O-N 2.83Å; P192-H195 PolarHBondContact O-N 3.14Å; P192-L208 HydrophobicContact CB-CD2 4.17Å
193	S	80.9	Confident	85.3	Confident	76 Å²	76	52.8 Å²	52.8	53%	0.531	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-61.4	-36.3	179.2	95.1	0	0	0	0	112.2	D191 H195 H196	D191-S193 VanDerWaalsContact CG-OG 3.25Å; D191-S193 PolarHBondContact O-N 3.38Å; D191-S193 VanDerWaalsContact O-N 3.16Å; D191-S193 WeakPolarHBondContact OD1-CB 3.45Å; D191-S193 PolarHBondContact OD1-N 2.66Å; D191-S193 PolarHBondContact OD1-OG 3.17Å; D191-S193 PolarHBondContact OD2-OG 3.17Å; S193-H195 PolarHBondContact O-N 2.94Å; S193-H195 VanDerWaalsContact O-N 3.17Å; S193-H196 VanDerWaalsContact O-CB 3.31Å; S193-H196 WeakPolarHBondContact O-CB 3.49Å; S193-H196 PolarHBondContact O-N 3.39Å; S193-H196 VanDerWaalsContact O-N 3.17Å
194	V	84.7	Confident	84.9	Confident	15 Å²	15	47.3 Å²	47.3	9%	0.091	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-64.9	-21.3	-179.7	179.8	0	0	0	0	112.2	F188 D191 P192 L241	F188-V194 HydrophobicContact CD1-CG1 4.25Å; F188-V194 HydrophobicContact CD2-CG2 4.39Å; F188-V194 HydrophobicContact CE1-CG1 3.61Å; F188-V194 HydrophobicContact CE1-CG2 4.42Å; F188-V194 HydrophobicContact CE2-CG2 3.91Å; F188-V194 HydrophobicContact CZ-CG1 3.76Å; F188-V194 HydrophobicContact CZ-CG2 3.92Å; F188-V194 WeakPolarHBondContact O-CG2 3.48Å; D191-V194 HydrophobicContact CB-CG2 4.2Å; D191-V194 PolarHBondContact O-N 3.32Å; P192-V194 VanDerWaalsContact C-N 3.28Å; P192-V194 PolarHBondContact O-N 2.83Å; V194-L241 HydrophobicContact CG1-CD2 3.52Å
195	H	88.4	Confident	84.7	Confident	1 Å²	1	43 Å²	43	1%	0.005	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-96.2	-4.4	-178.5	-58.5	-96.6	0	0	0	113.7	A189 D191 P192 S193 D197 F198 L199 L208 L217 H237	A189-H195 WeakPolarHBondContact CA-NE2 3.31Å; A189-H195 PolarHBondContact O-NE2 2.87Å; A189-H195 VanDerWaalsContact O-NE2 3.09Å; D191-H195 PolarHBondContact O-CD2 2.98Å; D191-H195 VanDerWaalsContact O-CD2 3.31Å; P192-H195 PolarHBondContact O-N 3.14Å; S193-H195 PolarHBondContact O-N 2.94Å; S193-H195 VanDerWaalsContact O-N 3.17Å; H195-D197 VanDerWaalsContact C-N 3.31Å; H195-D197 PolarHBondContact O-N 3.31Å; H195-F198 WeakPolarHBondContact O-CB 3.36Å; H195-F198 PolarHBondContact O-N 3.12Å; H195-F198 VanDerWaalsContact O-N 3.15Å; H195-L199 WeakPolarHBondContact O-CG 3.48Å; H195-L199 PolarHBondContact O-N 3.29Å; H195-L208 HydrophobicContact CB-CD1 3.69Å; H195-L208 HydrophobicContact CB-CD2 4.33Å; H195-L217 VanDerWaalsContact CE1-CD1 3.48Å; H195-L217 WeakPolarHBondContact CE1-CD1 3.43Å; H195-L217 VanDerWaalsContact CE1-CD2 3.48Å; H195-L217 WeakPolarHBondContact CE1-CD2 2.98Å; H195-L217 WeakPolarHBondContact ND1-CD2 3.39Å; H195-H237 AromaticContact CE1-NE2 3.58Å; H195-H237 AromaticContact CG-NE2 3.95Å; H195-H237 AromaticContact ND1-CD2 3.95Å; H195-H237 AromaticContact ND1-NE2 3.05Å; H195-H237 PolarHBondContact ND1-NE2 3.42Å
196	H	84.5	Confident	84.7	Confident	105 Å²	105	43.2 Å²	43.2	49%	0.486	26%	0.257	S	S	.	.	H	α-helix	trans	-50.4	-46.8	-174.7	175.4	-92	0	0	0	113.2	S193 L199 R200	S193-H196 VanDerWaalsContact O-CB 3.31Å; S193-H196 WeakPolarHBondContact O-CB 3.49Å; S193-H196 PolarHBondContact O-N 3.39Å; S193-H196 VanDerWaalsContact O-N 3.17Å; H196-L199 PolarHBondContact O-N 3.45Å; H196-R200 WeakPolarHBondContact O-CB 3.39Å; H196-R200 PolarHBondContact O-N 2.92Å
197	D	84.2	Confident	84.6	Confident	24 Å²	24	43 Å²	43	13%	0.128	26%	0.255	C	S	.	.	H	α-helix	trans	-83.4	-19.9	-173.2	-47.7	-62.6	0	0	0	113.1	H195 R200 H201	H195-D197 VanDerWaalsContact C-N 3.31Å; H195-D197 PolarHBondContact O-N 3.31Å; D197-R200 IonicContact OD1-CZ 3.35Å; D197-R200 VanDerWaalsContact OD1-CZ 3.27Å; D197-R200 IonicContact OD1-NE 2.63Å; D197-R200 PolarHBondContact OD1-NE 2.91Å; D197-R200 IonicContact OD1-NH2 2.86Å; D197-R200 PolarHBondContact OD1-NH2 3.18Å; D197-H201 PolarHBondContact O-N 2.88Å; D197-H201 PolarHBondContact O-ND1 3.34Å
198	F	90.2	Very high	84.8	Confident	1 Å²	1	38.1 Å²	38.1	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-50.9	164.7	168.7	-108.8	0	0	0	110	I179 H195 R200 H201 C202 L217 V219 V230 L233 H237 F479	I179-F198 HydrophobicContact CD1-CE1 4.26Å; I179-F198 HydrophobicContact CD1-CZ 3.74Å; H195-F198 WeakPolarHBondContact O-CB 3.36Å; H195-F198 PolarHBondContact O-N 3.12Å; H195-F198 VanDerWaalsContact O-N 3.15Å; F198-R200 VanDerWaalsContact C-N 3.32Å; F198-R200 PolarHBondContact O-N 3.03Å; F198-H201 PolarHBondContact O-N 3.44Å; F198-H201 VanDerWaalsContact O-N 3.14Å; F198-C202 PolarHBondContact O-N 3.38Å; F198-C202 PolarHBondContact O-SG 2.92Å; F198-L217 HydrophobicContact CE1-CD2 4.42Å; F198-V219 HydrophobicContact CE1-CG2 4.34Å; F198-V230 HydrophobicContact CZ-CG1 4.04Å; F198-L233 HydrophobicContact CD2-CB 4.04Å; F198-L233 HydrophobicContact CE2-CB 3.71Å; F198-H237 HydrophobicContact CD2-CB 3.68Å; F198-H237 AromaticContact CD2-CG 3.68Å; F198-H237 HydrophobicContact CE2-CB 3.9Å; F198-H237 HydrophobicContact CG-CB 4.33Å; F198-H237 AromaticContact CG-CD2 3.84Å; F198-H237 AromaticContact CG-CG 3.82Å; F198-F479 HydrophobicContact CB-CE2 4.04Å; F198-F479 HydrophobicContact CB-CZ 3.92Å; F198-F479 HydrophobicContact CD2-CE1 4.38Å; F198-F479 AromaticContact CD2-CZ 3.79Å; F198-F479 HydrophobicContact CD2-CZ 3.79Å; F198-F479 HydrophobicContact CG-CZ 4.36Å
199	L	88.1	Confident	84.9	Confident	43 Å²	43	39.7 Å²	39.7	23%	0.225	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-43.2	174.5	-64.7	-175.3	0	0	0	112.1	H195 H196 H201 C202 G203 V206 L208	H195-L199 WeakPolarHBondContact O-CG 3.48Å; H195-L199 PolarHBondContact O-N 3.29Å; H196-L199 PolarHBondContact O-N 3.45Å; L199-H201 PolarHBondContact O-N 3.48Å; L199-C202 PolarHBondContact O-N 2.84Å; L199-C202 VanDerWaalsContact O-N 3.17Å; L199-G203 PolarHBondContact O-N 3.28Å; L199-G203 VanDerWaalsContact O-N 3.1Å; L199-V206 HydrophobicContact CD2-CB 4.1Å; L199-V206 HydrophobicContact CD2-CG1 3.51Å; L199-L208 HydrophobicContact CD1-CB 4.18Å; L199-L208 HydrophobicContact CD1-CD1 4.11Å; L199-L208 HydrophobicContact CD2-CB 4.41Å; L199-L208 HydrophobicContact CD2-CD1 3.8Å; L199-L208 HydrophobicContact CG-CD1 4.1Å
200	R	86.3	Confident	85	Confident	112 Å²	112	41.3 Å²	41.3	42%	0.423	24%	0.241	S	C	.	.	H	α-helix	trans	-55.6	-37.9	176.3	-162.8	-154.6	-60.7	-159	0.1	112.6	H196 D197 F198 D482	H196-R200 WeakPolarHBondContact O-CB 3.39Å; H196-R200 PolarHBondContact O-N 2.92Å; D197-R200 IonicContact OD1-CZ 3.35Å; D197-R200 VanDerWaalsContact OD1-CZ 3.27Å; D197-R200 IonicContact OD1-NE 2.63Å; D197-R200 PolarHBondContact OD1-NE 2.91Å; D197-R200 IonicContact OD1-NH2 2.86Å; D197-R200 PolarHBondContact OD1-NH2 3.18Å; F198-R200 VanDerWaalsContact C-N 3.32Å; F198-R200 PolarHBondContact O-N 3.03Å; R200-D482 IonicContact NH1-OD2 2.78Å
201	H	86.8	Confident	85	Confident	17 Å²	17	40.4 Å²	40.4	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-85.8	-24.8	178.9	-76.8	83.5	0	0	0	113.7	D197 F198 L199 G203 L233 L475 N478 F479 D482	D197-H201 PolarHBondContact O-N 2.88Å; D197-H201 PolarHBondContact O-ND1 3.34Å; F198-H201 PolarHBondContact O-N 3.44Å; F198-H201 VanDerWaalsContact O-N 3.14Å; L199-H201 PolarHBondContact O-N 3.48Å; H201-G203 VanDerWaalsContact C-N 3.35Å; H201-L233 HydrophobicContact CB-CD1 3.75Å; H201-L475 HydrophobicContact CB-CD1 4.23Å; H201-L475 WeakPolarHBondContact O-CD1 3.47Å; H201-N478 PolarHBondContact NE2-ND2 2.93Å; H201-F479 HydrophobicContact CB-CB 4.39Å; H201-F479 HydrophobicContact CB-CD2 3.91Å; H201-F479 HydrophobicContact CB-CG 4.33Å; H201-F479 AromaticContact CG-CD2 3.64Å; H201-F479 AromaticContact ND1-CD2 3.56Å; H201-F479 WeakPolarHBondContact NE2-CA 3.49Å; H201-F479 PolarHBondContact NE2-N 3.04Å; H201-D482 IonicContact CE1-OD2 3.83Å; H201-D482 PolarHBondContact CE1-OD2 2.88Å; H201-D482 IonicContact NE2-OD2 3.48Å
202	C	88.9	Confident	85.2	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-38.7	171.1	-66	0	0	0	0	111.8	F198 L199 T226 N229 V230	F198-C202 PolarHBondContact O-N 3.38Å; F198-C202 PolarHBondContact O-SG 2.92Å; L199-C202 PolarHBondContact O-N 2.84Å; L199-C202 VanDerWaalsContact O-N 3.17Å; C202-T226 HydrophobicContact CB-CG2 4.17Å; C202-N229 HydrophobicContact CB-CB 4.44Å; C202-N229 PolarHBondContact O-ND2 3.14Å; C202-V230 HydrophobicContact CB-CG2 3.87Å; C202-V230 VanDerWaalsContact SG-CG2 3.53Å
203	G	83.5	Confident	85.4	Confident	30 Å²	30	47.9 Å²	47.9	31%	0.309	26%	0.261	S	S	.	.			trans	86.4	-172.9	-175	0	0	0	0	0	112.9	L199 H201 V206 T226	L199-G203 PolarHBondContact O-N 3.28Å; L199-G203 VanDerWaalsContact O-N 3.1Å; H201-G203 VanDerWaalsContact C-N 3.35Å; G203-V206 VanDerWaalsContact O-CG2 3.31Å; G203-V206 WeakPolarHBondContact O-CG2 3.48Å; G203-T226 VanDerWaalsContact C-OG1 3.27Å; G203-T226 WeakPolarHBondContact O-CG2 3.45Å; G203-T226 PolarHBondContact O-OG1 3.48Å
204	G	77.4	Confident	85.5	Confident	51 Å²	51	46.7 Å²	46.7	53%	0.526	25%	0.253	S	S	.	.	S	Bend	trans	66.1	176.9	169.3	0	0	0	0	0	117.4	V206 T226	G204-V206 PolarHBondContact O-N 2.92Å; G204-T226 WeakPolarHBondContact CA-OG1 3.33Å; G204-T226 PolarHBondContact N-OG1 3.2Å
205	P	80	Confident	85.6	Confident	56 Å²	56	46.8 Å²	46.8	36%	0.364	25%	0.254	S	S	.	.	S	Bend	trans	-77.3	102.2	168.8	32.5	-32	0	0	0	109.3	I2 T221	I2-P205 HydrophobicContact CG1-CB 4.13Å; I2-P205 WeakPolarHBondContact CG1-O 3.2Å; P205-T221 PolarHBondContact O-OG1 2.94Å
206	V	85.3	Confident	85.7	Confident	8 Å²	8	47.3 Å²	47.3	5%	0.048	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	139.2	178.3	-177.9	0	0	0	0	111.1	M1 L199 G203 G204 V219 L220 T226	M1-V206 CarbonylContact C-O 3.42Å; M1-V206 WeakPolarHBondContact CA-O 3.44Å; M1-V206 PolarHBondContact N-O 2.95Å; L199-V206 HydrophobicContact CD2-CB 4.1Å; L199-V206 HydrophobicContact CD2-CG1 3.51Å; G203-V206 VanDerWaalsContact O-CG2 3.31Å; G203-V206 WeakPolarHBondContact O-CG2 3.48Å; G204-V206 PolarHBondContact O-N 2.92Å; V206-V219 HydrophobicContact CG1-CG1 3.41Å; V206-V219 VanDerWaalsContact CG1-CG1 3.41Å; V206-L220 CarbonylContact C-O 3.59Å; V206-L220 WeakPolarHBondContact CA-O 3.26Å; V206-L220 WeakPolarHBondContact CG1-O 3.32Å; V206-T226 HydrophobicContact CG2-CG2 3.42Å; V206-T226 VanDerWaalsContact CG2-CG2 3.42Å
207	S	84.5	Confident	86	Confident	6 Å²	6	42.3 Å²	42.3	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	145.1	159.3	-143.8	0	0	0	0	110.2	L18 L220	L18-S207 VanDerWaalsContact O-CB 3.23Å; L18-S207 WeakPolarHBondContact O-CB 3.47Å; L18-S207 PolarHBondContact O-OG 3.3Å; S207-L220 PolarHBondContact N-O 3.4Å; S207-L220 PolarHBondContact O-N 2.94Å
208	L	88.4	Confident	86.3	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.157	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	133.9	-173	171.2	150	0	0	0	109	P192 H195 L199 L217 V218 V219	P192-L208 HydrophobicContact CB-CD2 4.17Å; H195-L208 HydrophobicContact CB-CD1 3.69Å; H195-L208 HydrophobicContact CB-CD2 4.33Å; L199-L208 HydrophobicContact CD1-CB 4.18Å; L199-L208 HydrophobicContact CD1-CD1 4.11Å; L199-L208 HydrophobicContact CD2-CB 4.41Å; L199-L208 HydrophobicContact CD2-CD1 3.8Å; L199-L208 HydrophobicContact CG-CD1 4.1Å; L208-L217 HydrophobicContact CD1-CD1 4.02Å; L208-L217 HydrophobicContact CD1-CD2 3.94Å; L208-L217 HydrophobicContact CD1-CG 4.09Å; L208-L217 HydrophobicContact CD2-CD1 4.03Å; L208-L217 HydrophobicContact CG-CD1 3.98Å; L208-L217 HydrophobicContact CG-CG 4.31Å; L208-V218 WeakPolarHBondContact CA-O 3.45Å; L208-V219 HydrophobicContact CD1-CG2 4.49Å
209	Y	87.2	Confident	86.3	Confident	47 Å²	47	41.2 Å²	41.2	18%	0.184	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	159	170	69.3	-93.1	0	0	0	110.4	R19 N20 R176 D211 V218 L220	R19-Y209 WeakPolarHBondContact O-CD1 3.22Å; N20-Y209 HydrophobicContact CB-CD1 4.41Å; N20-Y209 HydrophobicContact CB-CE1 3.87Å; N20-Y209 VanDerWaalsContact CG-CE1 3.47Å; N20-Y209 VanDerWaalsContact CG-CZ 3.44Å; N20-Y209 VanDerWaalsContact CG-OH 3.22Å; N20-Y209 PolarHBondContact ND2-OH 3.43Å; N20-Y209 WeakPolarHBondContact OD1-CE1 3.36Å; N20-Y209 PolarHBondContact OD1-OH 3.45Å; R176-Y209 PolarHBondContact NH2-OH 3.15Å; Y209-D211 HydrophobicContact CE2-CB 4.11Å; Y209-V218 HydrophobicContact CD1-CB 4.12Å; Y209-V218 HydrophobicContact CD1-CG1 4.44Å; Y209-V218 HydrophobicContact CD2-CB 4.28Å; Y209-V218 HydrophobicContact CD2-CG2 4.45Å; Y209-V218 HydrophobicContact CE1-CB 3.65Å; Y209-V218 HydrophobicContact CE1-CG1 3.64Å; Y209-V218 HydrophobicContact CE1-CG2 4.36Å; Y209-V218 HydrophobicContact CE2-CB 3.81Å; Y209-V218 HydrophobicContact CE2-CG1 4.48Å; Y209-V218 HydrophobicContact CE2-CG2 3.71Å; Y209-V218 HydrophobicContact CG-CB 4.42Å; Y209-V218 VanDerWaalsContact CZ-CB 3.47Å; Y209-V218 PolarHBondContact N-O 3.35Å; Y209-V218 VanDerWaalsContact N-O 3.15Å; Y209-V218 PolarHBondContact O-N 2.87Å; Y209-L220 HydrophobicContact CE1-CD1 4.46Å
210	Y	88	Confident	86.4	Confident	36 Å²	36	39.1 Å²	39.1	14%	0.141	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.9	171.7	-177.1	-114.1	0	0	0	109.8	I181 A186 N212 S215 C216	I181-Y210 HydrophobicContact CB-CE2 4.18Å; I181-Y210 HydrophobicContact CD1-CD2 3.69Å; I181-Y210 HydrophobicContact CD1-CE2 3.48Å; I181-Y210 VanDerWaalsContact CD1-CE2 3.48Å; I181-Y210 HydrophobicContact CG1-CE2 4.4Å; A186-Y210 HydrophobicContact CB-CE1 4.33Å; A186-Y210 VanDerWaalsContact CB-OH 3.27Å; A186-Y210 WeakPolarHBondContact CB-OH 3.29Å; Y210-N212 HydrophobicContact CD1-CB 4.48Å; Y210-N212 HydrophobicContact CE1-CB 4.28Å; Y210-S215 WeakPolarHBondContact OH-CA 3.42Å; Y210-C216 WeakPolarHBondContact CD2-O 3.5Å
211	D	86.8	Confident	86.6	Confident	37 Å²	37	33.9 Å²	33.9	20%	0.198	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	108.3	170.1	178.3	-10.1	0	0	0	108.4	Y209 E213 S214 S215 C216 V218	Y209-D211 HydrophobicContact CE2-CB 4.11Å; D211-E213 PolarHBondContact OD1-N 3.5Å; D211-S214 PolarHBondContact OD1-N 3.07Å; D211-S214 WeakPolarHBondContact OD2-CB 3.35Å; D211-S214 PolarHBondContact OD2-OG 3.03Å; D211-S215 CarbonylContact O-C 3.57Å; D211-S215 WeakPolarHBondContact O-CA 3.48Å; D211-S215 PolarHBondContact O-N 3.35Å; D211-C216 PolarHBondContact N-O 3.17Å; D211-C216 PolarHBondContact O-N 3.43Å; D211-V218 HydrophobicContact CB-CG2 4.38Å
212	N	84.8	Confident	86.6	Confident	121 Å²	121	34.7 Å²	34.7	65%	0.647	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-32.2	-178.2	-162.3	24.7	0	0	0	112.2	Y210 S215	Y210-N212 HydrophobicContact CD1-CB 4.48Å; Y210-N212 HydrophobicContact CE1-CB 4.28Å; N212-S215 PolarHBondContact O-N 3.41Å
213	E	83.7	Confident	86.5	Confident	189 Å²	189	36.6 Å²	36.6	88%	0.883	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-49.3	-177.8	-62.1	-169.6	171.9	0	0	111.2	D211 S215	D211-E213 PolarHBondContact OD1-N 3.5Å; E213-S215 VanDerWaalsContact C-N 3.26Å; E213-S215 PolarHBondContact O-N 2.94Å
214	S	84.4	Confident	86.7	Confident	51 Å²	51	38.1 Å²	38.1	36%	0.357	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.2	174.4	75.2	0	0	0	0	113.6	D211 C216	D211-S214 PolarHBondContact OD1-N 3.07Å; D211-S214 WeakPolarHBondContact OD2-CB 3.35Å; D211-S214 PolarHBondContact OD2-OG 3.03Å; S214-C216 PolarHBondContact O-N 3.02Å; S214-C216 PolarHBondContact O-SG 3.5Å; S214-C216 WeakPolarHBondContact OG-CB 3.4Å
215	S	87	Confident	87.2	Confident	17 Å²	17	39.8 Å²	39.8	12%	0.119	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	33.8	-174.4	-55.3	0	0	0	0	113.2	I181 Y210 D211 N212 E213	I181-S215 WeakPolarHBondContact CB-O 3.43Å; I181-S215 PolarHBondContact N-O 2.76Å; Y210-S215 WeakPolarHBondContact OH-CA 3.42Å; D211-S215 CarbonylContact O-C 3.57Å; D211-S215 WeakPolarHBondContact O-CA 3.48Å; D211-S215 PolarHBondContact O-N 3.35Å; N212-S215 PolarHBondContact O-N 3.41Å; E213-S215 VanDerWaalsContact C-N 3.26Å; E213-S215 PolarHBondContact O-N 2.94Å
216	C	90	Very high	87.7	Confident	11 Å²	11	37.2 Å²	37.2	7%	0.074	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	139.7	-173.7	-71.8	0	0	0	0	112.6	I179 Y210 D211 S214	I179-C216 WeakPolarHBondContact O-CA 3.3Å; Y210-C216 WeakPolarHBondContact CD2-O 3.5Å; D211-C216 PolarHBondContact N-O 3.17Å; D211-C216 PolarHBondContact O-N 3.43Å; S214-C216 PolarHBondContact O-N 3.02Å; S214-C216 PolarHBondContact O-SG 3.5Å; S214-C216 WeakPolarHBondContact OG-CB 3.4Å
217	L	90.7	Very high	87.9	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.5	160.8	-163.1	70.9	0	0	0	108.4	R178 I179 I181 H195 F198 L208 V219	R178-L217 WeakPolarHBondContact CA-O 3.32Å; I179-L217 HydrophobicContact CB-CB 4.23Å; I179-L217 HydrophobicContact CD1-CD2 4.38Å; I179-L217 PolarHBondContact N-O 2.66Å; I179-L217 PolarHBondContact O-N 3.21Å; I181-L217 HydrophobicContact CD1-CB 3.71Å; I181-L217 HydrophobicContact CD1-CD1 4.42Å; I181-L217 HydrophobicContact CG1-CB 4.49Å; H195-L217 VanDerWaalsContact CE1-CD1 3.48Å; H195-L217 WeakPolarHBondContact CE1-CD1 3.43Å; H195-L217 VanDerWaalsContact CE1-CD2 3.48Å; H195-L217 WeakPolarHBondContact CE1-CD2 2.98Å; H195-L217 WeakPolarHBondContact ND1-CD2 3.39Å; F198-L217 HydrophobicContact CE1-CD2 4.42Å; L208-L217 HydrophobicContact CD1-CD1 4.02Å; L208-L217 HydrophobicContact CD1-CD2 3.94Å; L208-L217 HydrophobicContact CD1-CG 4.09Å; L208-L217 HydrophobicContact CD2-CD1 4.03Å; L208-L217 HydrophobicContact CG-CD1 3.98Å; L208-L217 HydrophobicContact CG-CG 4.31Å; L217-V219 HydrophobicContact CD2-CG2 4.35Å; L217-V219 HydrophobicContact CG-CG2 4.43Å
218	V	90.4	Very high	88.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127	175.8	-175.2	0	0	0	0	109	R176 R178 L208 Y209 D211 L220	R176-V218 HydrophobicContact CG-CG1 3.81Å; R178-V218 HydrophobicContact CG-CG2 4.49Å; L208-V218 WeakPolarHBondContact CA-O 3.45Å; Y209-V218 HydrophobicContact CD1-CB 4.12Å; Y209-V218 HydrophobicContact CD1-CG1 4.44Å; Y209-V218 HydrophobicContact CD2-CB 4.28Å; Y209-V218 HydrophobicContact CD2-CG2 4.45Å; Y209-V218 HydrophobicContact CE1-CB 3.65Å; Y209-V218 HydrophobicContact CE1-CG1 3.64Å; Y209-V218 HydrophobicContact CE1-CG2 4.36Å; Y209-V218 HydrophobicContact CE2-CB 3.81Å; Y209-V218 HydrophobicContact CE2-CG1 4.48Å; Y209-V218 HydrophobicContact CE2-CG2 3.71Å; Y209-V218 HydrophobicContact CG-CB 4.42Å; Y209-V218 VanDerWaalsContact CZ-CB 3.47Å; Y209-V218 PolarHBondContact N-O 3.35Å; Y209-V218 VanDerWaalsContact N-O 3.15Å; Y209-V218 PolarHBondContact O-N 2.87Å; D211-V218 HydrophobicContact CB-CG2 4.38Å; V218-L220 HydrophobicContact CG1-CD2 4.23Å
219	V	90.5	Very high	88.4	Confident	1 Å²	1	45 Å²	45	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.2	-178.7	-168.9	0	0	0	0	108.3	H177 F198 V206 L208 L217 V230	H177-V219 HydrophobicContact CB-CB 4.41Å; H177-V219 PolarHBondContact N-O 3.47Å; H177-V219 PolarHBondContact O-N 3.14Å; F198-V219 HydrophobicContact CE1-CG2 4.34Å; V206-V219 HydrophobicContact CG1-CG1 3.41Å; V206-V219 VanDerWaalsContact CG1-CG1 3.41Å; L208-V219 HydrophobicContact CD1-CG2 4.49Å; L217-V219 HydrophobicContact CD2-CG2 4.35Å; L217-V219 HydrophobicContact CG-CG2 4.43Å; V219-V230 HydrophobicContact CB-CG1 4.17Å; V219-V230 HydrophobicContact CG1-CG1 4.2Å; V219-V230 HydrophobicContact CG1-CG2 3.87Å; V219-V230 HydrophobicContact CG2-CG1 4.19Å
220	L	90.6	Very high	88.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132	177.7	-59.5	-179.7	0	0	0	109.4	I2 L18 V21 I174 H175 R176 V206 S207 Y209 V218	I2-L220 HydrophobicContact CD1-CB 4.32Å; I2-L220 WeakPolarHBondContact CD1-O 3.27Å; L18-L220 HydrophobicContact CD1-CD1 4.39Å; L18-L220 HydrophobicContact CG-CD1 4.42Å; V21-L220 HydrophobicContact CG2-CD1 4.33Å; I174-L220 HydrophobicContact CG2-CB 4.45Å; I174-L220 HydrophobicContact CG2-CD2 4.27Å; H175-L220 WeakPolarHBondContact O-CA 3.14Å; R176-L220 HydrophobicContact CB-CD2 3.64Å; R176-L220 HydrophobicContact CG-CD2 3.63Å; V206-L220 CarbonylContact C-O 3.59Å; V206-L220 WeakPolarHBondContact CA-O 3.26Å; V206-L220 WeakPolarHBondContact CG1-O 3.32Å; S207-L220 PolarHBondContact N-O 3.4Å; S207-L220 PolarHBondContact O-N 2.94Å; Y209-L220 HydrophobicContact CE1-CD1 4.46Å; V218-L220 HydrophobicContact CG1-CD2 4.23Å
221	T	90.1	Very high	88.9	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.7	174.4	-177.1	0	0	0	0	111.1	H175 P205 D223 T226 A227	H175-T221 HydrophobicContact CB-CG2 4.05Å; H175-T221 PolarHBondContact N-O 3.25Å; H175-T221 PolarHBondContact O-N 2.85Å; P205-T221 PolarHBondContact O-OG1 2.94Å; T221-D223 WeakPolarHBondContact CG2-O 3.47Å; T221-D223 PolarHBondContact OG1-N 2.77Å; T221-D223 VanDerWaalsContact OG1-N 3.08Å; T221-T226 HydrophobicContact CG2-CG2 4.12Å; T221-A227 HydrophobicContact CG2-CB 3.8Å
222	T	86.9	Confident	89.1	Confident	33 Å²	33	42.4 Å²	42.4	20%	0.202	24%	0.236	C	C	.	.	S	Bend	trans	-93.7	3.8	169.8	61.8	0	0	0	0	112.7	I2 L46 I173	I2-T222 HydrophobicContact CD1-CG2 4.4Å; I2-T222 HydrophobicContact CG2-CG2 4.29Å; L46-T222 HydrophobicContact CD2-CG2 4.5Å; I173-T222 HydrophobicContact CG2-CG2 4.29Å
223	D	86.8	Confident	89.4	Confident	42 Å²	42	36.7 Å²	36.7	23%	0.225	21%	0.205	C	C	.	.			trans	-111.3	118.7	178.8	167.7	31.9	0	0	0	111.9	T221 V225 T226 A227	T221-D223 WeakPolarHBondContact CG2-O 3.47Å; T221-D223 PolarHBondContact OG1-N 2.77Å; T221-D223 VanDerWaalsContact OG1-N 3.08Å; D223-V225 VanDerWaalsContact C-N 3.26Å; D223-V225 PolarHBondContact O-N 2.75Å; D223-V225 WeakPolarHBondContact OD1-CB 3.45Å; D223-V225 PolarHBondContact OD1-N 2.75Å; D223-T226 PolarHBondContact O-N 2.83Å; D223-T226 WeakPolarHBondContact OD2-CB 3.35Å; D223-T226 PolarHBondContact OD2-N 3.39Å; D223-T226 PolarHBondContact OD2-OG1 3.16Å; D223-A227 PolarHBondContact O-N 3.24Å
224	P	87.9	Confident	89.8	Confident	62 Å²	62	30.6 Å²	30.6	40%	0.403	18%	0.177	S	C	.	.	H	α-helix	trans	-67.3	-18.9	176.9	26.7	-34.6	0	0	0	114.3	K228	P224-K228 VanDerWaalsContact O-CD 3.28Å; P224-K228 WeakPolarHBondContact O-CD 3.49Å; P224-K228 VanDerWaalsContact O-CG 3.28Å; P224-K228 WeakPolarHBondContact O-CG 3.33Å; P224-K228 PolarHBondContact O-N 3.18Å
225	V	88	Confident	90.1	Very high	86 Å²	86	32.3 Å²	32.3	52%	0.521	18%	0.182	S	C	.	.	H	α-helix	trans	-74.6	-50.2	173.5	-176.9	0	0	0	0	109.5	D223 A227 K228 N229	D223-V225 VanDerWaalsContact C-N 3.26Å; D223-V225 PolarHBondContact O-N 2.75Å; D223-V225 WeakPolarHBondContact OD1-CB 3.45Å; D223-V225 PolarHBondContact OD1-N 2.75Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.2Å; V225-K228 WeakPolarHBondContact O-CB 3.46Å; V225-K228 PolarHBondContact O-N 2.86Å; V225-K228 VanDerWaalsContact O-N 3.09Å; V225-N229 PolarHBondContact O-N 3.26Å
226	T	89.8	Confident	90.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-54.4	-43.6	172.4	-66.1	0	0	0	0	111.8	C202 G203 G204 V206 T221 D223 K228 N229 V230	C202-T226 HydrophobicContact CB-CG2 4.17Å; G203-T226 VanDerWaalsContact C-OG1 3.27Å; G203-T226 WeakPolarHBondContact O-CG2 3.45Å; G203-T226 PolarHBondContact O-OG1 3.48Å; G204-T226 WeakPolarHBondContact CA-OG1 3.33Å; G204-T226 PolarHBondContact N-OG1 3.2Å; V206-T226 HydrophobicContact CG2-CG2 3.42Å; V206-T226 VanDerWaalsContact CG2-CG2 3.42Å; T221-T226 HydrophobicContact CG2-CG2 4.12Å; D223-T226 PolarHBondContact O-N 2.83Å; D223-T226 WeakPolarHBondContact OD2-CB 3.35Å; D223-T226 PolarHBondContact OD2-N 3.39Å; D223-T226 PolarHBondContact OD2-OG1 3.16Å; T226-K228 VanDerWaalsContact C-N 3.32Å; T226-K228 PolarHBondContact O-N 2.84Å; T226-N229 WeakPolarHBondContact O-CB 3.26Å; T226-N229 PolarHBondContact O-N 3.39Å; T226-N229 VanDerWaalsContact O-N 3.1Å; T226-V230 HydrophobicContact CG2-CG2 4.45Å; T226-V230 WeakPolarHBondContact O-CG2 3.27Å; T226-V230 PolarHBondContact O-N 2.94Å
227	A	90.6	Very high	90.2	Very high	22 Å²	22	31.4 Å²	31.4	18%	0.182	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-41.7	176.2	0	0	0	0	0	112.7	H175 T221 D223 V225 V230 A231	H175-A227 HydrophobicContact CB-CB 3.96Å; T221-A227 HydrophobicContact CG2-CB 3.8Å; D223-A227 PolarHBondContact O-N 3.24Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.2Å; A227-V230 PolarHBondContact O-N 3.29Å; A227-A231 PolarHBondContact O-N 2.82Å
228	K	90.6	Very high	90.1	Very high	148 Å²	148	32.7 Å²	32.7	64%	0.643	18%	0.181	S	C	*	.	H	α-helix	trans	-68	-34.3	175.5	-68.3	162.2	-172.2	167.9	0	112.2	P224 V225 T226 L232	P224-K228 VanDerWaalsContact O-CD 3.28Å; P224-K228 WeakPolarHBondContact O-CD 3.49Å; P224-K228 VanDerWaalsContact O-CG 3.28Å; P224-K228 WeakPolarHBondContact O-CG 3.33Å; P224-K228 PolarHBondContact O-N 3.18Å; V225-K228 WeakPolarHBondContact O-CB 3.46Å; V225-K228 PolarHBondContact O-N 2.86Å; V225-K228 VanDerWaalsContact O-N 3.09Å; T226-K228 VanDerWaalsContact C-N 3.32Å; T226-K228 PolarHBondContact O-N 2.84Å; K228-L232 PolarHBondContact O-N 3.12Å; K228-L232 VanDerWaalsContact O-N 3.11Å
229	N	91.9	Very high	90	Very high	38 Å²	38	36.4 Å²	36.4	20%	0.203	20%	0.195	C	C	.	.	H	α-helix	trans	-69	-42	175.7	-65.1	-21.8	0	0	0	111.7	C202 V225 T226 A231 L232 L233 L475	C202-N229 HydrophobicContact CB-CB 4.44Å; C202-N229 PolarHBondContact O-ND2 3.14Å; V225-N229 PolarHBondContact O-N 3.26Å; T226-N229 WeakPolarHBondContact O-CB 3.26Å; T226-N229 PolarHBondContact O-N 3.39Å; T226-N229 VanDerWaalsContact O-N 3.1Å; N229-A231 PolarHBondContact O-N 3.05Å; N229-L232 PolarHBondContact O-N 3.37Å; N229-L233 WeakPolarHBondContact O-CB 3.41Å; N229-L233 VanDerWaalsContact O-CG 3.28Å; N229-L233 WeakPolarHBondContact O-CG 3.34Å; N229-L233 PolarHBondContact O-N 3.11Å; N229-L475 HydrophobicContact CB-CD2 4.42Å
230	V	92.3	Very high	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-53.9	-51.7	174.8	171	0	0	0	0	110.6	H177 I179 F198 C202 V219 T226 A227 L232 L233 E234	H177-V230 HydrophobicContact CB-CG1 3.86Å; I179-V230 HydrophobicContact CD1-CG1 4.44Å; F198-V230 HydrophobicContact CZ-CG1 4.04Å; C202-V230 HydrophobicContact CB-CG2 3.87Å; C202-V230 VanDerWaalsContact SG-CG2 3.53Å; V219-V230 HydrophobicContact CB-CG1 4.17Å; V219-V230 HydrophobicContact CG1-CG1 4.2Å; V219-V230 HydrophobicContact CG1-CG2 3.87Å; V219-V230 HydrophobicContact CG2-CG1 4.19Å; T226-V230 HydrophobicContact CG2-CG2 4.45Å; T226-V230 WeakPolarHBondContact O-CG2 3.27Å; T226-V230 PolarHBondContact O-N 2.94Å; A227-V230 PolarHBondContact O-N 3.29Å; V230-L232 PolarHBondContact O-N 3Å; V230-L233 PolarHBondContact O-N 2.81Å; V230-E234 PolarHBondContact O-N 2.76Å
231	A	92.5	Very high	89.8	Confident	38 Å²	38	37 Å²	37	31%	0.314	20%	0.198	S	C	.	.	H	α-helix	trans	-63.3	-38.4	178.1	0	0	0	0	0	113.2	A227 N229 L233 E234	A227-A231 PolarHBondContact O-N 2.82Å; N229-A231 PolarHBondContact O-N 3.05Å; A231-L233 VanDerWaalsContact C-N 3.3Å; A231-L233 PolarHBondContact O-N 2.79Å; A231-E234 WeakPolarHBondContact O-CG 3.48Å
232	L	91.2	Very high	89.7	Confident	28 Å²	28	42.9 Å²	42.9	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-36.4	175.8	-179.9	62.9	0	0	0	112.5	K228 N229 V230 K395 K472 L476	K228-L232 PolarHBondContact O-N 3.12Å; K228-L232 VanDerWaalsContact O-N 3.11Å; N229-L232 PolarHBondContact O-N 3.37Å; V230-L232 PolarHBondContact O-N 3Å; L232-K395 HydrophobicContact CD1-CB 4.2Å; L232-K395 PolarHBondContact O-NZ 2.9Å; L232-K472 HydrophobicContact CD2-CB 3.91Å; L232-K472 HydrophobicContact CD2-CD 4.48Å; L232-K472 HydrophobicContact CD2-CG 3.81Å; L232-L476 HydrophobicContact CD1-CD1 4.23Å
233	L	92.3	Very high	89.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-90.6	-22	-173.1	-64	-176.4	0	0	0	114	F198 H201 N229 V230 A231 D235 T236 H237 L475 L476 F479	F198-L233 HydrophobicContact CD2-CB 4.04Å; F198-L233 HydrophobicContact CE2-CB 3.71Å; H201-L233 HydrophobicContact CB-CD1 3.75Å; N229-L233 WeakPolarHBondContact O-CB 3.41Å; N229-L233 VanDerWaalsContact O-CG 3.28Å; N229-L233 WeakPolarHBondContact O-CG 3.34Å; N229-L233 PolarHBondContact O-N 3.11Å; V230-L233 PolarHBondContact O-N 2.81Å; A231-L233 VanDerWaalsContact C-N 3.3Å; A231-L233 PolarHBondContact O-N 2.79Å; L233-D235 PolarHBondContact O-N 3.3Å; L233-T236 CarbonylContact O-C 3.57Å; L233-T236 WeakPolarHBondContact O-CA 3.47Å; L233-T236 VanDerWaalsContact O-CB 3.26Å; L233-T236 WeakPolarHBondContact O-CB 3.25Å; L233-T236 PolarHBondContact O-N 2.82Å; L233-H237 PolarHBondContact O-N 2.8Å; L233-L475 HydrophobicContact CD1-CD2 4.43Å; L233-L475 HydrophobicContact CD2-CG 4.42Å; L233-L476 HydrophobicContact CD2-CD2 3.79Å; L233-L476 HydrophobicContact CD2-CG 4.43Å; L233-F479 HydrophobicContact CB-CD1 4.47Å; L233-F479 HydrophobicContact CB-CE1 4.15Å; L233-F479 HydrophobicContact CD1-CD1 4.38Å; L233-F479 HydrophobicContact CD2-CB 4.47Å; L233-F479 HydrophobicContact CD2-CD1 3.75Å; L233-F479 HydrophobicContact CD2-CE1 4.29Å; L233-F479 HydrophobicContact CD2-CG 4.34Å; L233-F479 HydrophobicContact CG-CD1 4.42Å
234	E	92.1	Very high	89.6	Confident	62 Å²	62	44.9 Å²	44.9	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-46.7	-51.5	-173.5	76.3	-169.6	169.3	0	0	114.1	H177 I179 V230 A231 T236 H237 L238	H177-E234 IonicContact CD2-OE2 3.8Å; H177-E234 IonicContact CE1-OE2 2.72Å; H177-E234 PolarHBondContact CE1-OE2 2.8Å; H177-E234 IonicContact NE2-OE2 3.21Å; H177-E234 PolarHBondContact NE2-OE2 3.14Å; I179-E234 HydrophobicContact CD1-CB 3.71Å; I179-E234 HydrophobicContact CG1-CB 4.1Å; I179-E234 HydrophobicContact CG2-CB 4.35Å; V230-E234 PolarHBondContact O-N 2.76Å; A231-E234 WeakPolarHBondContact O-CG 3.48Å; E234-T236 PolarHBondContact O-N 3.45Å; E234-H237 CarbonylContact O-C 3.5Å; E234-H237 WeakPolarHBondContact O-CA 3.48Å; E234-H237 WeakPolarHBondContact O-CB 3.2Å; E234-H237 PolarHBondContact O-N 3.33Å; E234-H237 VanDerWaalsContact O-N 3.09Å; E234-L238 PolarHBondContact O-N 2.84Å
235	D	89.6	Confident	89.4	Confident	86 Å²	86	44.4 Å²	44.4	46%	0.46	22%	0.216	S	C	.	.	H	α-helix	trans	-77.3	-16.4	-173.8	173	63.4	0	0	0	111.6	L233 K395	L233-D235 PolarHBondContact O-N 3.3Å; D235-K395 WeakPolarHBondContact OD2-CE 3.39Å; D235-K395 IonicContact OD2-NZ 3.76Å
236	T	87.8	Confident	89.2	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-81	-44.3	166.8	-46.1	0	0	0	0	109.6	L233 E234 R239 M240 K395 L476 F479 Q480	L233-T236 CarbonylContact O-C 3.57Å; L233-T236 WeakPolarHBondContact O-CA 3.47Å; L233-T236 VanDerWaalsContact O-CB 3.26Å; L233-T236 WeakPolarHBondContact O-CB 3.25Å; L233-T236 PolarHBondContact O-N 2.82Å; E234-T236 PolarHBondContact O-N 3.45Å; T236-R239 WeakPolarHBondContact O-CB 3.41Å; T236-R239 PolarHBondContact O-N 3.36Å; T236-M240 HydrophobicContact CG2-SD 3.78Å; T236-M240 WeakPolarHBondContact O-CB 3.41Å; T236-M240 VanDerWaalsContact O-CG 3.26Å; T236-M240 WeakPolarHBondContact O-CG 3.33Å; T236-M240 PolarHBondContact O-N 3.42Å; T236-K395 PolarHBondContact OG1-NZ 3Å; T236-L476 WeakPolarHBondContact OG1-CD2 3.25Å; T236-F479 HydrophobicContact CG2-CD1 3.92Å; T236-F479 HydrophobicContact CG2-CE1 4.08Å; T236-Q480 HydrophobicContact CG2-CG 3.94Å
237	H	90.7	Very high	88.8	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-44.8	177.5	-168.7	47.3	0	0	0	112.5	H195 F198 L233 E234 R239 M240 L241 F479	H195-H237 AromaticContact CE1-NE2 3.58Å; H195-H237 AromaticContact CG-NE2 3.95Å; H195-H237 AromaticContact ND1-CD2 3.95Å; H195-H237 AromaticContact ND1-NE2 3.05Å; H195-H237 PolarHBondContact ND1-NE2 3.42Å; F198-H237 HydrophobicContact CD2-CB 3.68Å; F198-H237 AromaticContact CD2-CG 3.68Å; F198-H237 HydrophobicContact CE2-CB 3.9Å; F198-H237 HydrophobicContact CG-CB 4.33Å; F198-H237 AromaticContact CG-CD2 3.84Å; F198-H237 AromaticContact CG-CG 3.82Å; L233-H237 PolarHBondContact O-N 2.8Å; E234-H237 CarbonylContact O-C 3.5Å; E234-H237 WeakPolarHBondContact O-CA 3.48Å; E234-H237 WeakPolarHBondContact O-CB 3.2Å; E234-H237 PolarHBondContact O-N 3.33Å; E234-H237 VanDerWaalsContact O-N 3.09Å; H237-R239 PolarHBondContact O-N 3.24Å; H237-M240 CarbonylContact O-C 3.51Å; H237-M240 WeakPolarHBondContact O-CA 3.32Å; H237-M240 WeakPolarHBondContact O-CB 3.48Å; H237-M240 PolarHBondContact O-N 3.48Å; H237-L241 WeakPolarHBondContact O-CB 3.32Å; H237-L241 WeakPolarHBondContact O-CG 3.45Å; H237-L241 PolarHBondContact O-N 2.73Å; H237-F479 HydrophobicContact CB-CE1 4.34Å; H237-F479 HydrophobicContact CB-CZ 4.19Å
238	L	90.4	Very high	88.1	Confident	28 Å²	28	43.9 Å²	43.9	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-27.2	175.5	-75.7	173.3	0	0	0	113.7	I179 I181 E234 L241 R242	I179-L238 HydrophobicContact CG2-CD1 3.8Å; I179-L238 HydrophobicContact CG2-CD2 4.04Å; I179-L238 HydrophobicContact CG2-CG 3.91Å; I181-L238 HydrophobicContact CG1-CD2 4.38Å; E234-L238 PolarHBondContact O-N 2.84Å; L238-L241 HydrophobicContact CD2-CD1 4.39Å; L238-R242 WeakPolarHBondContact O-CG 3.29Å; L238-R242 PolarHBondContact O-NH1 3.2Å; L238-R242 VanDerWaalsContact O-NH1 3.12Å
239	R	86.8	Confident	87.6	Confident	78 Å²	78	44.4 Å²	44.4	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-75.3	-41.3	173.1	-165.6	-168.5	-52.4	170.3	0.1	110.7	T236 H237 R242 Q243 N388 S391	T236-R239 WeakPolarHBondContact O-CB 3.41Å; T236-R239 PolarHBondContact O-N 3.36Å; H237-R239 PolarHBondContact O-N 3.24Å; R239-R242 PolarHBondContact O-N 3.05Å; R239-Q243 PolarHBondContact O-N 3.23Å; R239-N388 PolarHBondContact NH1-OD1 3.35Å; R239-S391 PolarHBondContact NH2-OG 2.91Å
240	M	87.9	Confident	86.8	Confident	11 Å²	11	44.4 Å²	44.4	5%	0.054	22%	0.216	C	C	.	.	H	α-helix	trans	-71.5	-34.6	179.3	-74.9	172.9	20.7	0	0	112.9	T236 H237 Q243 K244 F479 Q480 Y483	T236-M240 HydrophobicContact CG2-SD 3.78Å; T236-M240 WeakPolarHBondContact O-CB 3.41Å; T236-M240 VanDerWaalsContact O-CG 3.26Å; T236-M240 WeakPolarHBondContact O-CG 3.33Å; T236-M240 PolarHBondContact O-N 3.42Å; H237-M240 CarbonylContact O-C 3.51Å; H237-M240 WeakPolarHBondContact O-CA 3.32Å; H237-M240 WeakPolarHBondContact O-CB 3.48Å; H237-M240 PolarHBondContact O-N 3.48Å; M240-Q243 PolarHBondContact O-N 3.24Å; M240-K244 WeakPolarHBondContact O-CB 3.36Å; M240-K244 PolarHBondContact O-N 3.12Å; M240-F479 HydrophobicContact CE-CD1 3.91Å; M240-F479 HydrophobicContact CE-CD2 3.99Å; M240-F479 HydrophobicContact CE-CE1 3.4Å; M240-F479 HydrophobicContact CE-CE2 3.45Å; M240-F479 VanDerWaalsContact CE-CE2 3.45Å; M240-F479 HydrophobicContact CE-CG 4.21Å; M240-F479 HydrophobicContact CE-CZ 3.15Å; M240-F479 HydrophobicContact SD-CD1 4.15Å; M240-F479 HydrophobicContact SD-CE1 3.95Å; M240-F479 HydrophobicContact SD-CZ 4.31Å; M240-Q480 HydrophobicContact SD-CG 4.41Å; M240-Y483 HydrophobicContact CB-CD1 4.35Å; M240-Y483 HydrophobicContact CB-CD2 3.72Å; M240-Y483 HydrophobicContact CB-CE1 4.11Å; M240-Y483 HydrophobicContact CB-CE2 3.38Å; M240-Y483 HydrophobicContact CB-CG 4.16Å; M240-Y483 HydrophobicContact CE-CD1 4.47Å; M240-Y483 HydrophobicContact CE-CD2 3.49Å; M240-Y483 VanDerWaalsContact CE-CD2 3.49Å; M240-Y483 HydrophobicContact CE-CE2 4.27Å; M240-Y483 HydrophobicContact CE-CG 3.59Å; M240-Y483 HydrophobicContact CG-CD1 3.59Å; M240-Y483 HydrophobicContact CG-CD2 3.75Å; M240-Y483 HydrophobicContact CG-CE1 3.63Å; M240-Y483 HydrophobicContact CG-CE2 3.75Å; M240-Y483 HydrophobicContact CG-CG 3.64Å; M240-Y483 WeakPolarHBondContact O-CE2 3.44Å; M240-Y483 PolarHBondContact O-OH 3.34Å; M240-Y483 HydrophobicContact SD-CD1 3.93Å; M240-Y483 HydrophobicContact SD-CD2 4Å; M240-Y483 HydrophobicContact SD-CG 3.61Å
241	L	88.8	Confident	86.1	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-47.5	170.9	-76.7	172.7	0	0	0	111.1	L185 F188 A189 V194 H237 L238 Q243 K244 W245	L185-L241 HydrophobicContact CD1-CB 4.41Å; F188-L241 HydrophobicContact CE1-CD2 4.39Å; A189-L241 HydrophobicContact CB-CD1 4.4Å; V194-L241 HydrophobicContact CG1-CD2 3.52Å; H237-L241 WeakPolarHBondContact O-CB 3.32Å; H237-L241 WeakPolarHBondContact O-CG 3.45Å; H237-L241 PolarHBondContact O-N 2.73Å; L238-L241 HydrophobicContact CD2-CD1 4.39Å; L241-Q243 VanDerWaalsContact C-N 3.31Å; L241-Q243 PolarHBondContact O-N 3.04Å; L241-K244 PolarHBondContact O-N 3.26Å; L241-W245 WeakPolarHBondContact O-CB 3.2Å; L241-W245 PolarHBondContact O-N 3.19Å
242	R	88.5	Confident	85.2	Confident	126 Å²	126	50 Å²	50	48%	0.475	23%	0.23	S	C	.	.	H	α-helix	trans	-56.8	-43.7	175.6	-73.2	175.7	177.3	104.9	-10.8	112.3	L185 L238 R239 A246	L185-R242 HydrophobicContact CD1-CG 3.68Å; L185-R242 HydrophobicContact CD2-CG 4.35Å; L238-R242 WeakPolarHBondContact O-CG 3.29Å; L238-R242 PolarHBondContact O-NH1 3.2Å; L238-R242 VanDerWaalsContact O-NH1 3.12Å; R239-R242 PolarHBondContact O-N 3.05Å; R242-A246 WeakPolarHBondContact O-CB 3.35Å; R242-A246 PolarHBondContact O-N 2.83Å
243	Q	85.3	Confident	84.4	Confident	91 Å²	91	53.3 Å²	53.3	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-71.9	-41.4	179.4	-78.4	179.1	-60.2	0	0	112.6	R239 M240 L241 A246 L247 Y483 L487	R239-Q243 PolarHBondContact O-N 3.23Å; M240-Q243 PolarHBondContact O-N 3.24Å; L241-Q243 VanDerWaalsContact C-N 3.31Å; L241-Q243 PolarHBondContact O-N 3.04Å; Q243-A246 PolarHBondContact O-N 3.35Å; Q243-L247 PolarHBondContact O-N 2.93Å; Q243-Y483 WeakPolarHBondContact CB-OH 3.32Å; Q243-L487 HydrophobicContact CB-CD1 4.49Å
244	K	85.7	Confident	83.3	Confident	27 Å²	27	54.2 Å²	54.2	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-43.1	173.7	-97.2	-179.7	179.7	-173.3	0	110.8	F188 M240 L241 L247 T248 Y483 D486 L487 M490	F188-K244 HydrophobicContact CE1-CB 3.74Å; F188-K244 HydrophobicContact CZ-CB 3.82Å; M240-K244 WeakPolarHBondContact O-CB 3.36Å; M240-K244 PolarHBondContact O-N 3.12Å; L241-K244 PolarHBondContact O-N 3.26Å; K244-L247 PolarHBondContact O-N 3.11Å; K244-T248 WeakPolarHBondContact O-CB 3.18Å; K244-T248 PolarHBondContact O-N 3.23Å; K244-T248 PolarHBondContact O-OG1 3.14Å; K244-Y483 HydrophobicContact CB-CE2 4.49Å; K244-Y483 HydrophobicContact CD-CD2 4.4Å; K244-Y483 HydrophobicContact CD-CE2 3.77Å; K244-Y483 HydrophobicContact CG-CE2 3.65Å; K244-Y483 PolarHBondContact N-OH 3.15Å; K244-D486 WeakPolarHBondContact CE-OD2 3.46Å; K244-D486 IonicContact NZ-OD2 2.71Å; K244-D486 PolarHBondContact NZ-OD2 2.74Å; K244-L487 HydrophobicContact CG-CD2 3.85Å; K244-M490 HydrophobicContact CB-CE 4.24Å; K244-M490 HydrophobicContact CG-CE 3.72Å
245	W	84.8	Confident	82.2	Confident	52 Å²	52	53.3 Å²	53.3	20%	0.197	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-44.9	175.6	176.9	92.7	0	0	0	112.5	E184 L185 F188 L241 L247 T248 R249	E184-W245 HydrophobicContact CB-CZ2 4.39Å; E184-W245 WeakPolarHBondContact O-CZ2 3.43Å; E184-W245 PolarHBondContact O-NE1 3.09Å; L185-W245 HydrophobicContact CD2-CB 3.74Å; L185-W245 HydrophobicContact CD2-CD2 3.65Å; L185-W245 HydrophobicContact CD2-CE3 4.11Å; L185-W245 HydrophobicContact CD2-CG 3.5Å; F188-W245 HydrophobicContact CD1-CB 3.76Å; F188-W245 HydrophobicContact CD1-CG 4.44Å; F188-W245 HydrophobicContact CE1-CB 4.14Å; F188-W245 HydrophobicContact CG-CB 4.31Å; F188-W245 AromaticContact CG-CD1 4Å; L241-W245 WeakPolarHBondContact O-CB 3.2Å; L241-W245 PolarHBondContact O-N 3.19Å; W245-L247 VanDerWaalsContact C-N 3.32Å; W245-L247 PolarHBondContact O-N 3.07Å; W245-T248 PolarHBondContact O-N 3.27Å; W245-R249 WeakPolarHBondContact O-CB 3.4Å; W245-R249 PolarHBondContact O-N 2.91Å
246	A	83	Confident	81	Confident	53 Å²	53	56.2 Å²	56.2	44%	0.438	25%	0.252	S	S	.	.	H	α-helix	trans	-62.1	-40.2	179.2	0	0	0	0	0	112.1	R242 Q243 S250	R242-A246 WeakPolarHBondContact O-CB 3.35Å; R242-A246 PolarHBondContact O-N 2.83Å; Q243-A246 PolarHBondContact O-N 3.35Å; A246-S250 WeakPolarHBondContact O-CB 3.44Å; A246-S250 PolarHBondContact O-N 2.84Å; A246-S250 VanDerWaalsContact O-N 3.12Å
247	L	81	Confident	80.1	Confident	28 Å²	28	60.7 Å²	60.7	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-46.5	173.5	-79.7	163.7	0	0	0	111.9	Q243 K244 W245 R249 S250 L251 L487 M490 E491 K494	Q243-L247 PolarHBondContact O-N 2.93Å; K244-L247 PolarHBondContact O-N 3.11Å; W245-L247 VanDerWaalsContact C-N 3.32Å; W245-L247 PolarHBondContact O-N 3.07Å; L247-R249 VanDerWaalsContact C-N 3.35Å; L247-R249 PolarHBondContact O-N 2.81Å; L247-S250 CarbonylContact O-C 3.56Å; L247-S250 WeakPolarHBondContact O-CA 3.26Å; L247-S250 WeakPolarHBondContact O-CB 3.43Å; L247-S250 PolarHBondContact O-N 3.26Å; L247-S250 VanDerWaalsContact O-N 3.12Å; L247-L251 WeakPolarHBondContact O-CB 3.46Å; L247-L251 PolarHBondContact O-N 3.27Å; L247-L487 HydrophobicContact CD1-CB 4.49Å; L247-L487 HydrophobicContact CD1-CD1 4.2Å; L247-L487 HydrophobicContact CD1-CD2 3.7Å; L247-L487 HydrophobicContact CD1-CG 4.35Å; L247-M490 HydrophobicContact CB-CE 3.79Å; L247-M490 HydrophobicContact CD1-CE 4.18Å; L247-E491 HydrophobicContact CD1-CG 4.07Å; L247-E491 HydrophobicContact CD2-CG 4.01Å; L247-K494 HydrophobicContact CD2-CD 4.49Å
248	T	77.8	Confident	78.5	Confident	17 Å²	17	62.3 Å²	62.3	10%	0.104	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-39.5	178	-55.3	0	0	0	0	112.2	F188 K244 W245 L251 R252	F188-T248 HydrophobicContact CD2-CG2 4.15Å; F188-T248 HydrophobicContact CE2-CG2 3.79Å; F188-T248 WeakPolarHBondContact CE2-OG1 3.4Å; K244-T248 WeakPolarHBondContact O-CB 3.18Å; K244-T248 PolarHBondContact O-N 3.23Å; K244-T248 PolarHBondContact O-OG1 3.14Å; W245-T248 PolarHBondContact O-N 3.27Å; T248-L251 WeakPolarHBondContact O-CB 3.43Å; T248-L251 PolarHBondContact O-N 3.22Å; T248-R252 HydrophobicContact CG2-CG 4.39Å; T248-R252 WeakPolarHBondContact O-CB 3.5Å; T248-R252 VanDerWaalsContact O-CG 3.32Å; T248-R252 WeakPolarHBondContact O-CG 3.37Å; T248-R252 PolarHBondContact O-N 3.28Å
249	R	79.2	Confident	76.8	Confident	158 Å²	158	66.5 Å²	66.5	60%	0.596	30%	0.303	S	S	*	.	H	α-helix	trans	-65.9	-39.8	174.2	-176.4	174.4	-179.9	151.2	3.8	111.5	W245 L247 Q253	W245-R249 WeakPolarHBondContact O-CB 3.4Å; W245-R249 PolarHBondContact O-N 2.91Å; L247-R249 VanDerWaalsContact C-N 3.35Å; L247-R249 PolarHBondContact O-N 2.81Å; R249-Q253 WeakPolarHBondContact O-CB 3.48Å; R249-Q253 PolarHBondContact O-N 3.48Å; R249-Q253 VanDerWaalsContact O-N 3.11Å
250	S	75.7	Confident	75.3	Confident	38 Å²	38	68.8 Å²	68.8	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-66.5	-38.1	172.3	-177.2	0	0	0	0	112.3	A246 L247 Q253 T254 K494	A246-S250 WeakPolarHBondContact O-CB 3.44Å; A246-S250 PolarHBondContact O-N 2.84Å; A246-S250 VanDerWaalsContact O-N 3.12Å; L247-S250 CarbonylContact O-C 3.56Å; L247-S250 WeakPolarHBondContact O-CA 3.26Å; L247-S250 WeakPolarHBondContact O-CB 3.43Å; L247-S250 PolarHBondContact O-N 3.26Å; L247-S250 VanDerWaalsContact O-N 3.12Å; S250-Q253 PolarHBondContact O-N 3Å; S250-T254 PolarHBondContact O-N 2.86Å; S250-T254 PolarHBondContact O-OG1 2.86Å; S250-T254 VanDerWaalsContact O-OG1 3.14Å; S250-K494 WeakPolarHBondContact OG-CE 2.83Å; S250-K494 PolarHBondContact OG-NZ 2.8Å
251	L	76.9	Confident	73.4	Confident	27 Å²	27	74.2 Å²	74.2	14%	0.141	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-53	178.8	-167.8	86.9	0	0	0	110	L247 T248 Q253 T254 I255 K494 L497	L247-L251 WeakPolarHBondContact O-CB 3.46Å; L247-L251 PolarHBondContact O-N 3.27Å; T248-L251 WeakPolarHBondContact O-CB 3.43Å; T248-L251 PolarHBondContact O-N 3.22Å; L251-Q253 PolarHBondContact O-N 3.3Å; L251-T254 WeakPolarHBondContact CA-OG1 3.26Å; L251-T254 CarbonylContact O-C 3.46Å; L251-T254 PolarHBondContact O-N 2.81Å; L251-T254 PolarHBondContact O-OG1 3.1Å; L251-I255 HydrophobicContact CD2-CD1 3.84Å; L251-I255 HydrophobicContact CG-CD1 3.7Å; L251-I255 HydrophobicContact CG-CG1 4.37Å; L251-I255 VanDerWaalsContact O-CB 3.31Å; L251-I255 WeakPolarHBondContact O-CB 3.37Å; L251-I255 VanDerWaalsContact O-CG1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 2.94Å; L251-K494 HydrophobicContact CD1-CB 3.72Å; L251-K494 HydrophobicContact CD1-CG 4.5Å; L251-L497 HydrophobicContact CD1-CD1 3.67Å; L251-L497 HydrophobicContact CG-CD1 4.24Å
252	R	74.4	Confident	71	Confident	128 Å²	128	85 Å²	85	48%	0.483	40%	0.396	S	S	.	.	H	α-helix	trans	-54.4	-35.5	173.6	-73.6	175.2	179.2	172.2	-0.3	111.9	T248 I255 R256	T248-R252 HydrophobicContact CG2-CG 4.39Å; T248-R252 WeakPolarHBondContact O-CB 3.5Å; T248-R252 VanDerWaalsContact O-CG 3.32Å; T248-R252 WeakPolarHBondContact O-CG 3.37Å; T248-R252 PolarHBondContact O-N 3.28Å; R252-I255 PolarHBondContact O-N 2.65Å; R252-R256 WeakPolarHBondContact O-CG 3.47Å; R252-R256 PolarHBondContact O-N 2.9Å
253	Q	72.6	Confident	68.5	Low	98 Å²	98	82.3 Å²	82.3	46%	0.458	41%	0.407	S	S	.	.	H	α-helix	trans	-74.5	-35.9	175.9	-166.1	59.8	36.7	0	0	113.5	R249 S250 L251 I255 N257	R249-Q253 WeakPolarHBondContact O-CB 3.48Å; R249-Q253 PolarHBondContact O-N 3.48Å; R249-Q253 VanDerWaalsContact O-N 3.11Å; S250-Q253 PolarHBondContact O-N 3Å; L251-Q253 PolarHBondContact O-N 3.3Å; Q253-I255 VanDerWaalsContact C-N 3.35Å; Q253-N257 PolarHBondContact O-OD1 3.39Å
254	T	69.8	Low	66.2	Low	19 Å²	19	84.1 Å²	84.1	12%	0.117	43%	0.426	C	S	.	.	H	α-helix	trans	-70.9	-31.5	169.9	41.6	0	0	0	0	112.6	S250 L251 N257 M498	S250-T254 PolarHBondContact O-N 2.86Å; S250-T254 PolarHBondContact O-OG1 2.86Å; S250-T254 VanDerWaalsContact O-OG1 3.14Å; L251-T254 WeakPolarHBondContact CA-OG1 3.26Å; L251-T254 CarbonylContact O-C 3.46Å; L251-T254 PolarHBondContact O-N 2.81Å; L251-T254 PolarHBondContact O-OG1 3.1Å; T254-N257 PolarHBondContact O-N 3.15Å; T254-M498 HydrophobicContact CG2-CG 4.07Å
255	I	69.2	Low	63.7	Low	43 Å²	43	90.5 Å²	90.5	22%	0.221	46%	0.462	C	S	.	.	H	α-helix	trans	-73.1	-40.9	178.5	-74.5	176.3	0	0	0	110.9	L251 R252 Q253 N257 L258 E259 L497	L251-I255 HydrophobicContact CD2-CD1 3.84Å; L251-I255 HydrophobicContact CG-CD1 3.7Å; L251-I255 HydrophobicContact CG-CG1 4.37Å; L251-I255 VanDerWaalsContact O-CB 3.31Å; L251-I255 WeakPolarHBondContact O-CB 3.37Å; L251-I255 VanDerWaalsContact O-CG1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 2.94Å; R252-I255 PolarHBondContact O-N 2.65Å; Q253-I255 VanDerWaalsContact C-N 3.35Å; I255-N257 PolarHBondContact O-N 3.06Å; I255-L258 CarbonylContact O-C 3.57Å; I255-L258 VanDerWaalsContact O-CA 3.3Å; I255-L258 WeakPolarHBondContact O-CA 3.39Å; I255-L258 WeakPolarHBondContact O-CB 3.28Å; I255-L258 PolarHBondContact O-N 3.32Å; I255-E259 HydrophobicContact CG2-CG 3.62Å; I255-E259 VanDerWaalsContact CG2-OE1 3.29Å; I255-E259 WeakPolarHBondContact CG2-OE1 3.47Å; I255-E259 WeakPolarHBondContact O-CG 3.11Å; I255-E259 PolarHBondContact O-N 3.01Å; I255-L497 HydrophobicContact CD1-CD1 3.86Å; I255-L497 HydrophobicContact CG1-CD1 3.69Å; I255-L497 HydrophobicContact CG1-CD2 4.34Å
256	R	65.4	Low	61.4	Low	147 Å²	147	92 Å²	92	56%	0.555	48%	0.476	S	S	*	.	H	α-helix	trans	-58.4	-31.2	172.1	-77.3	175.2	-171.7	150.6	-5.2	113.9	R252 L258 E259	R252-R256 WeakPolarHBondContact O-CG 3.47Å; R252-R256 PolarHBondContact O-N 2.9Å; R256-L258 PolarHBondContact O-N 3.48Å; R256-E259 WeakPolarHBondContact CA-OE2 3.41Å
257	N	67.1	Low	58.9	Low	96 Å²	96	94.8 Å²	94.8	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-71.9	-12.9	173.8	-61.6	-3.7	0	0	0	112.6	Q253 T254 I255 L501	Q253-N257 PolarHBondContact O-OD1 3.39Å; T254-N257 PolarHBondContact O-N 3.15Å; I255-N257 PolarHBondContact O-N 3.06Å; N257-L501 HydrophobicContact CB-CD2 4.25Å
258	L	58.7	Low	56.5	Low	41 Å²	41	103 Å²	103	22%	0.215	52%	0.522	C	S	.	.	H	α-helix	trans	-106.3	-31.6	176.2	-71.4	166.1	0	0	0	112.8	I255 R256 V260 N261 L497 L501	I255-L258 CarbonylContact O-C 3.57Å; I255-L258 VanDerWaalsContact O-CA 3.3Å; I255-L258 WeakPolarHBondContact O-CA 3.39Å; I255-L258 WeakPolarHBondContact O-CB 3.28Å; I255-L258 PolarHBondContact O-N 3.32Å; R256-L258 PolarHBondContact O-N 3.48Å; L258-V260 PolarHBondContact O-N 2.82Å; L258-V260 VanDerWaalsContact O-N 3.12Å; L258-N261 WeakPolarHBondContact O-CA 3.18Å; L258-N261 WeakPolarHBondContact O-CB 3.44Å; L258-N261 PolarHBondContact O-N 3.11Å; L258-L497 HydrophobicContact CD1-CB 4.05Å; L258-L497 HydrophobicContact CD1-CD2 3.57Å; L258-L497 HydrophobicContact CD1-CG 4.42Å; L258-L501 HydrophobicContact CD1-CG 4.23Å; L258-L501 HydrophobicContact CD2-CD2 3.63Å; L258-L501 HydrophobicContact CD2-CG 3.82Å; L258-L501 HydrophobicContact CG-CD1 4.47Å; L258-L501 HydrophobicContact CG-CD2 3.84Å; L258-L501 HydrophobicContact CG-CG 3.93Å
259	E	54.4	Low	54.7	Low	116 Å²	116	107 Å²	107	54%	0.542	55%	0.548	S	S	.	.	H	α-helix	trans	-65.8	-11.9	-174.7	-81.3	171	152.7	0	0	114.8	I255 R256 N261	I255-E259 HydrophobicContact CG2-CG 3.62Å; I255-E259 VanDerWaalsContact CG2-OE1 3.29Å; I255-E259 WeakPolarHBondContact CG2-OE1 3.47Å; I255-E259 WeakPolarHBondContact O-CG 3.11Å; I255-E259 PolarHBondContact O-N 3.01Å; R256-E259 WeakPolarHBondContact CA-OE2 3.41Å; E259-N261 PolarHBondContact O-N 3.21Å; E259-N261 VanDerWaalsContact O-N 3.12Å
260	V	55.4	Low	52.2	Low	126 Å²	126	101.8 Å²	101.8	76%	0.764	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-24.3	160.7	-176.5	0	0	0	0	110.9	L258	L258-V260 PolarHBondContact O-N 2.82Å; L258-V260 VanDerWaalsContact O-N 3.12Å
261	N	47.3	Very low	49.9	Very low	125 Å²	125	102.4 Å²	102.4	67%	0.668	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	73.5	175.9	-63.8	-60.3	0	0	0	112.8	L258 E259	L258-N261 WeakPolarHBondContact O-CA 3.18Å; L258-N261 WeakPolarHBondContact O-CB 3.44Å; L258-N261 PolarHBondContact O-N 3.11Å; E259-N261 PolarHBondContact O-N 3.21Å; E259-N261 VanDerWaalsContact O-N 3.12Å
262	R	37.9	Very low	47.8	Very low	230 Å²	230	105.9 Å²	105.9	87%	0.868	58%	0.583	S	S	*	*			trans	59	108.3	154.1	-67.9	-177.7	162.4	94	-1.3	119.3
263	G	36.1	Very low	45.8	Very low	69 Å²	69	106.4 Å²	106.4	71%	0.711	59%	0.588	S	S	*	*				59.6	103.6	114.3	0	0	0	0	0	119.6
264	P	38.5	Very low	43.6	Very low	128 Å²	128	109.5 Å²	109.5	83%	0.831	61%	0.608	S	S	*	*			trans	-86.9	163.3	169.9	36.8	-34.5	0	0	0	113
265	D	32.3	Very low	41.7	Very low	161 Å²	161	114.7 Å²	114.7	86%	0.861	64%	0.643	S	S	*	*			trans	-141.9	159.7	170.1	-151	-20.1	0	0	0	110.6
266	V	36.1	Very low	39.8	Very low	83 Å²	83	116.8 Å²	116.8	50%	0.503	66%	0.662	S	S	.	*			trans	-128.5	141.9	-151.1	175.5	0	0	0	0	114.9	Q776	V266-Q776 HydrophobicContact CG1-CG 4.12Å
267	S	31.7	Very low	38	Very low	112 Å²	112	116.4 Å²	116.4	78%	0.783	67%	0.671	S	S	*	*			trans	-169	158.6	150.8	-88.4	0	0	0	0	113.3
268	R	30.8	Very low	36.3	Very low	201 Å²	201	123.9 Å²	123.9	76%	0.758	69%	0.692	S	S	*	*			trans	-146.1	160.1	-169.1	-108.8	-156.5	142.6	-158.2	-1	115.5
269	P	40.1	Very low	35	Very low	102 Å²	102	129.3 Å²	129.3	66%	0.662	72%	0.721	S	S	*	*			trans	38.5	-164.1	171.8	39	-36	0	0	0	121.9
270	G	27.1	Very low	34.1	Very low	48 Å²	48	127.5 Å²	127.5	50%	0.495	72%	0.722	S	S	.	*			cis	-113.5	-159.5	12.5	0	0	0	0	0	118.4	Q772	G270-Q772 VanDerWaalsContact CA-CD 3.43Å
271	G	27.2	Very low	33.3	Very low	51 Å²	51	128.2 Å²	128.2	53%	0.526	72%	0.721	S	S	.	*			trans	-130.7	-150.2	-158.1	0	0	0	0	0	117.4	S770	G271-S770 PolarHBondContact N-OG 3.05Å; G271-S770 VanDerWaalsContact O-CB 3.22Å; G271-S770 WeakPolarHBondContact O-CB 3.17Å; G271-S770 PolarHBondContact O-OG 3.22Å; G271-S770 VanDerWaalsContact O-OG 3.11Å
272	S	31.8	Very low	33.4	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	72%	0.715	S	S	*	*			trans	-115.8	170.9	-167	-172.1	0	0	0	0	113.8
273	K	32.4	Very low	34.1	Very low	138 Å²	138	120.5 Å²	120.5	60%	0.6	71%	0.711	S	S	*	*			trans	-131.4	145.4	171.7	-75.1	-173.8	174.8	180	0	112.9
274	N	26.2	Very low	35.2	Very low	164 Å²	164	122.7 Å²	122.7	88%	0.877	71%	0.705	S	S	*	*			trans	-94.9	170.3	-173.1	-83.7	-7.4	0	0	0	114.6
275	C	30.1	Very low	36.4	Very low	127 Å²	127	119.6 Å²	119.6	86%	0.858	68%	0.679	S	S	*	*			trans	-82.6	165	165.7	-172.5	0	0	0	0	111.8
276	S	29.5	Very low	38.5	Very low	88 Å²	88	115.3 Å²	115.3	62%	0.615	66%	0.658	S	S	*	*			trans	-145.4	169.1	172.6	57.9	0	0	0	0	113.7
277	D	28.4	Very low	40.2	Very low	139 Å²	139	113.3 Å²	113.3	74%	0.743	64%	0.643	S	S	*	*			trans	82.1	123.3	153.1	-49	-44.3	0	0	0	122.9
278	W	31.1	Very low	42.4	Very low	252 Å²	252	113.4 Å²	113.4	96%	0.955	63%	0.63	S	S	*	*			trans	-149.6	141.5	153.6	-78.4	98.7	0	0	0	108.4
279	N	31.6	Very low	44.8	Very low	155 Å²	155	104.1 Å²	104.1	83%	0.829	60%	0.595	S	S	*	*			trans	-157.9	158.3	177.5	-122.5	8.3	0	0	0	107.6
280	S	34.2	Very low	46.7	Very low	78 Å²	78	104.8 Å²	104.8	55%	0.545	59%	0.588	S	S	.	*			cis	-158.3	177.9	-4.5	-160.9	0	0	0	0	110.4
281	D	39.1	Very low	49.5	Very low	142 Å²	142	102.5 Å²	102.5	76%	0.759	56%	0.564	S	S	*	*			trans	73.1	145	157.1	-50.9	-17.3	0	0	0	118.5
282	P	49.9	Very low	52.1	Low	82 Å²	82	101.6 Å²	101.6	53%	0.532	55%	0.549	S	S	.	.				-147.3	179.9	90.1	41.9	-26.1	0	0	0	115.3	F285	P282-F285 WeakPolarHBondContact O-CE1 3.42Å; P282-F285 WeakPolarHBondContact O-CZ 3.31Å
283	S	52	Low	54.5	Low	111 Å²	111	101.5 Å²	101.5	78%	0.776	54%	0.537	S	S	*	.	S	Bend	trans	-73.8	138.4	166.6	57.7	0	0	0	0	112.5
284	L	59.7	Low	57	Low	114 Å²	114	99.9 Å²	99.9	60%	0.597	53%	0.532	S	S	*	.	S	Bend	trans	63.3	120.6	-166.6	-68.8	170.8	0	0	0	113.1
285	F	64	Low	59.8	Low	63 Å²	63	92.4 Å²	92.4	28%	0.276	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	99.7	-169.8	-62.9	-81.1	0	0	0	110.3	P282 A351 P354 A357	P282-F285 WeakPolarHBondContact O-CE1 3.42Å; P282-F285 WeakPolarHBondContact O-CZ 3.31Å; F285-A351 PolarHBondContact N-O 2.91Å; F285-A351 PolarHBondContact O-N 3.43Å; F285-P354 HydrophobicContact CD1-CB 3.7Å; F285-P354 HydrophobicContact CD2-CB 3.78Å; F285-P354 HydrophobicContact CD2-CG 4.18Å; F285-P354 VanDerWaalsContact CD2-N 3.31Å; F285-P354 HydrophobicContact CE1-CB 3.77Å; F285-P354 HydrophobicContact CE1-CG 4.4Å; F285-P354 HydrophobicContact CE2-CB 3.88Å; F285-P354 VanDerWaalsContact CE2-CD 3.45Å; F285-P354 HydrophobicContact CE2-CG 3.89Å; F285-P354 HydrophobicContact CG-CB 3.69Å; F285-P354 HydrophobicContact CZ-CB 3.86Å; F285-P354 HydrophobicContact CZ-CG 4Å; F285-A357 HydrophobicContact CB-CB 3.99Å
286	V	76.1	Confident	62.5	Low	71 Å²	71	87.5 Å²	87.5	43%	0.43	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	97	176	-174.7	0	0	0	0	109.2	K288 V348 I349	V286-K288 HydrophobicContact CG1-CG 4.26Å; V286-V348 HydrophobicContact CG1-CG1 3.82Å; V286-I349 CarbonylContact C-O 3.55Å; V286-I349 VanDerWaalsContact CA-O 3.3Å; V286-I349 WeakPolarHBondContact CA-O 3.33Å
287	E	72.5	Confident	65.2	Low	41 Å²	41	85.9 Å²	85.9	19%	0.192	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.6	178.2	-77.9	-76.2	-164.2	0	0	110.1	I349 A357 R361	E287-I349 HydrophobicContact CB-CB 4.3Å; E287-I349 PolarHBondContact N-O 2.94Å; E287-I349 PolarHBondContact O-N 2.88Å; E287-A357 HydrophobicContact CB-CB 4.25Å; E287-A357 HydrophobicContact CG-CB 3.58Å; E287-R361 WeakPolarHBondContact OE2-CD 3.48Å; E287-R361 IonicContact OE2-CZ 3.27Å; E287-R361 IonicContact OE2-NE 3.26Å; E287-R361 IonicContact OE2-NH1 3.42Å; E287-R361 PolarHBondContact OE2-NH1 3.32Å
288	K	77.1	Confident	68	Low	115 Å²	115	82.4 Å²	82.4	50%	0.5	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.3	178.4	-61.7	-175	-177.4	177.4	0	110.9	V286 M346 F347 V348 R361	V286-K288 HydrophobicContact CG1-CG 4.26Å; K288-M346 HydrophobicContact CD-SD 4.4Å; K288-F347 WeakPolarHBondContact CA-O 3.35Å; K288-V348 HydrophobicContact CD-CG2 4.48Å; K288-V348 HydrophobicContact CG-CG1 4.26Å; K288-V348 HydrophobicContact CG-CG2 4.29Å; K288-R361 PolarHBondContact O-NH1 2.86Å
289	F	80.3	Confident	70.7	Confident	5 Å²	5	70.4 Å²	70.4	2%	0.022	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	157.7	177.4	58.8	-83.2	0	0	0	111.1	V291 F347 I349 R361 L364 E365	F289-V291 HydrophobicContact CD2-CG2 3.85Å; F289-V291 HydrophobicContact CE2-CG2 3.75Å; F289-F347 HydrophobicContact CD1-CB 4.22Å; F289-F347 HydrophobicContact CD2-CB 4.09Å; F289-F347 HydrophobicContact CD2-CD2 4.36Å; F289-F347 HydrophobicContact CE1-CB 3.66Å; F289-F347 HydrophobicContact CE2-CB 3.52Å; F289-F347 AromaticContact CE2-CD2 3.64Å; F289-F347 HydrophobicContact CE2-CD2 3.64Å; F289-F347 AromaticContact CE2-CG 3.72Å; F289-F347 HydrophobicContact CE2-CG 3.72Å; F289-F347 HydrophobicContact CG-CB 4.4Å; F289-F347 HydrophobicContact CZ-CB 3.26Å; F289-F347 HydrophobicContact CZ-CD1 4.35Å; F289-F347 HydrophobicContact CZ-CD2 4.11Å; F289-F347 AromaticContact CZ-CG 3.68Å; F289-F347 HydrophobicContact CZ-CG 3.68Å; F289-F347 PolarHBondContact N-O 2.8Å; F289-F347 PolarHBondContact O-N 3.07Å; F289-I349 HydrophobicContact CE1-CD1 3.6Å; F289-I349 HydrophobicContact CE1-CG1 4.03Å; F289-I349 HydrophobicContact CZ-CD1 4.07Å; F289-R361 HydrophobicContact CD1-CG 3.86Å; F289-R361 HydrophobicContact CE1-CB 4.26Å; F289-R361 HydrophobicContact CE1-CG 4.05Å; F289-L364 HydrophobicContact CE2-CB 3.99Å; F289-L364 HydrophobicContact CZ-CB 3.6Å; F289-E365 HydrophobicContact CB-CG 4.09Å; F289-E365 HydrophobicContact CD2-CB 3.7Å; F289-E365 HydrophobicContact CD2-CG 3.73Å; F289-E365 HydrophobicContact CE2-CB 3.92Å; F289-E365 HydrophobicContact CE2-CG 4.45Å; F289-E365 HydrophobicContact CG-CB 4.15Å; F289-E365 HydrophobicContact CG-CG 4Å
290	F	81.3	Confident	73.5	Confident	117 Å²	117	66 Å²	66	51%	0.513	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.7	178.3	-66.3	-88.5	0	0	0	110.3	A344 A345 M346	F290-A344 HydrophobicContact CB-CB 4.4Å; F290-A344 HydrophobicContact CD1-CB 4.14Å; F290-A345 WeakPolarHBondContact CA-O 3.31Å; F290-M346 HydrophobicContact CD1-CB 3.95Å; F290-M346 HydrophobicContact CD1-CG 4.39Å; F290-M346 HydrophobicContact CE1-CB 3.75Å; F290-M346 HydrophobicContact CE1-CG 4.07Å; F290-M346 HydrophobicContact CE1-SD 4.29Å; F290-M346 HydrophobicContact CZ-CB 4.42Å; F290-M346 HydrophobicContact CZ-CG 4.27Å; F290-M346 HydrophobicContact CZ-SD 4.04Å
291	V	84.4	Confident	75.9	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.2	171.4	176.9	0	0	0	0	107.7	F289 L295 A299 A345 F347 L364	F289-V291 HydrophobicContact CD2-CG2 3.85Å; F289-V291 HydrophobicContact CE2-CG2 3.75Å; V291-L295 HydrophobicContact CG1-CB 3.96Å; V291-A299 HydrophobicContact CG1-CB 4.21Å; V291-A345 PolarHBondContact N-O 3.2Å; V291-A345 PolarHBondContact O-N 2.96Å; V291-F347 HydrophobicContact CB-CD2 4.13Å; V291-F347 HydrophobicContact CB-CE2 3.92Å; V291-F347 HydrophobicContact CG2-CD2 3.64Å; V291-F347 HydrophobicContact CG2-CE2 3.68Å; V291-L364 WeakPolarHBondContact CG2-O 3.15Å
292	P	83	Confident	78.2	Confident	31 Å²	31	60.4 Å²	60.4	20%	0.201	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	139.3	172.8	-26.6	34.8	0	0	0	111.7	H294 L295 M296	P292-H294 VanDerWaalsContact CB-CE1 3.45Å; P292-H294 WeakPolarHBondContact CB-CE1 3.44Å; P292-H294 WeakPolarHBondContact CB-ND1 3.29Å; P292-H294 PolarHBondContact O-N 2.8Å; P292-H294 VanDerWaalsContact O-N 3.12Å; P292-L295 HydrophobicContact CB-CD1 4.47Å; P292-L295 HydrophobicContact CB-CG 4.4Å; P292-L295 HydrophobicContact CG-CD1 4.18Å; P292-L295 WeakPolarHBondContact O-CA 3.4Å; P292-L295 PolarHBondContact O-N 3.17Å; P292-M296 PolarHBondContact O-N 2.65Å; P292-M296 VanDerWaalsContact O-N 3.15Å
293	Q	82	Confident	80	Confident	98 Å²	98	67.8 Å²	67.8	46%	0.458	36%	0.362	S	S	.	.	H	α-helix	trans	-57.1	-33.4	-173.9	-169.4	175.4	38.5	0	0	112.8	L295 M296 E343	Q293-L295 PolarHBondContact O-N 3.17Å; Q293-M296 VanDerWaalsContact O-CB 3.25Å; Q293-M296 WeakPolarHBondContact O-CB 3.5Å; Q293-M296 PolarHBondContact O-N 3.17Å; Q293-E343 HydrophobicContact CB-CB 4.44Å; Q293-E343 VanDerWaalsContact CB-O 3.27Å; Q293-E343 WeakPolarHBondContact CB-O 3.41Å; Q293-E343 PolarHBondContact N-O 2.96Å
294	H	84.5	Confident	81.7	Confident	104 Å²	104	63.2 Å²	63.2	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-70.6	-15.9	175.5	73.5	-80.8	0	0	0	114.4	P292 E368 R430	P292-H294 VanDerWaalsContact CB-CE1 3.45Å; P292-H294 WeakPolarHBondContact CB-CE1 3.44Å; P292-H294 WeakPolarHBondContact CB-ND1 3.29Å; P292-H294 PolarHBondContact O-N 2.8Å; P292-H294 VanDerWaalsContact O-N 3.12Å; H294-E368 IonicContact CD2-OE1 3.64Å; H294-E368 IonicContact CE1-OE1 2.8Å; H294-E368 IonicContact NE2-OE1 3.51Å; H294-E368 PolarHBondContact NE2-OE1 3.42Å; H294-R430 PolarHBondContact NE2-NH2 3.47Å
295	L	86.1	Confident	83.2	Confident	8 Å²	8	61.9 Å²	61.9	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-99.3	-10.6	172.6	-58.1	-178.1	0	0	0	113.1	V291 P292 Q293 G297 L298 A299 S367 E368	V291-L295 HydrophobicContact CG1-CB 3.96Å; P292-L295 HydrophobicContact CB-CD1 4.47Å; P292-L295 HydrophobicContact CB-CG 4.4Å; P292-L295 HydrophobicContact CG-CD1 4.18Å; P292-L295 WeakPolarHBondContact O-CA 3.4Å; P292-L295 PolarHBondContact O-N 3.17Å; Q293-L295 PolarHBondContact O-N 3.17Å; L295-G297 PolarHBondContact O-N 3.16Å; L295-L298 HydrophobicContact CD2-CD1 4.14Å; L295-L298 WeakPolarHBondContact O-CA 3.29Å; L295-L298 WeakPolarHBondContact O-CB 3.5Å; L295-L298 PolarHBondContact O-N 3.17Å; L295-A299 PolarHBondContact O-N 3.36Å; L295-S367 VanDerWaalsContact CD1-C 3.43Å; L295-E368 HydrophobicContact CD1-CG 4.38Å
296	M	84.9	Confident	84.5	Confident	24 Å²	24	60.5 Å²	60.5	12%	0.118	33%	0.325	C	S	.	.	H	α-helix	trans	-53.9	-37.6	178.8	-179.7	55.1	73	0	0	112.7	P292 Q293 L298 A299 I300 A345 F347	P292-M296 PolarHBondContact O-N 2.65Å; P292-M296 VanDerWaalsContact O-N 3.15Å; Q293-M296 VanDerWaalsContact O-CB 3.25Å; Q293-M296 WeakPolarHBondContact O-CB 3.5Å; Q293-M296 PolarHBondContact O-N 3.17Å; M296-L298 PolarHBondContact O-N 3.05Å; M296-A299 PolarHBondContact O-N 2.8Å; M296-A299 VanDerWaalsContact O-N 3.16Å; M296-A299 HydrophobicContact SD-CB 4.45Å; M296-I300 HydrophobicContact CG-CD1 3.75Å; M296-I300 HydrophobicContact CG-CG1 4.28Å; M296-I300 PolarHBondContact O-N 3.31Å; M296-I300 HydrophobicContact SD-CD1 3.7Å; M296-I300 HydrophobicContact SD-CG1 3.75Å; M296-A345 HydrophobicContact CE-CB 3.31Å; M296-F347 HydrophobicContact CE-CD2 4.43Å; M296-F347 HydrophobicContact CE-CE2 3.49Å; M296-F347 VanDerWaalsContact CE-CE2 3.49Å; M296-F347 HydrophobicContact CE-CZ 3.83Å; M296-F347 HydrophobicContact SD-CE2 3.79Å; M296-F347 HydrophobicContact SD-CZ 3.59Å; M296-F347 VanDerWaalsContact SD-CZ 3.59Å
297	G	86.3	Confident	85.1	Confident	54 Å²	54	58 Å²	58	56%	0.557	31%	0.309	S	S	*	.	H	α-helix	trans	-61.9	-24.3	175.9	0	0	0	0	0	114.5	L295 G301	L295-G297 PolarHBondContact O-N 3.16Å; G297-G301 VanDerWaalsContact O-CA 3.3Å; G297-G301 WeakPolarHBondContact O-CA 3.35Å; G297-G301 PolarHBondContact O-N 3.3Å
298	L	88.7	Confident	86	Confident	65 Å²	65	62.8 Å²	62.8	34%	0.34	33%	0.325	S	S	.	.	H	α-helix	trans	-83.1	-41.2	172.5	-57.4	177	0	0	0	111.3	L295 M296 G301 Y366	L295-L298 HydrophobicContact CD2-CD1 4.14Å; L295-L298 WeakPolarHBondContact O-CA 3.29Å; L295-L298 WeakPolarHBondContact O-CB 3.5Å; L295-L298 PolarHBondContact O-N 3.17Å; M296-L298 PolarHBondContact O-N 3.05Å; L298-G301 PolarHBondContact O-N 2.87Å; L298-Y366 HydrophobicContact CB-CD1 3.64Å; L298-Y366 HydrophobicContact CB-CD2 4.28Å; L298-Y366 HydrophobicContact CB-CE1 3.66Å; L298-Y366 HydrophobicContact CB-CE2 4.28Å; L298-Y366 HydrophobicContact CB-CG 3.96Å; L298-Y366 HydrophobicContact CD1-CD1 3.94Å; L298-Y366 HydrophobicContact CD1-CE1 4.21Å; L298-Y366 HydrophobicContact CG-CD1 4.46Å; L298-Y366 WeakPolarHBondContact O-CE2 3.22Å
299	A	87.3	Confident	86.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-46.4	176.8	0	0	0	0	0	112.1	V291 L295 M296 N306 F347 L364 Y366	V291-A299 HydrophobicContact CG1-CB 4.21Å; L295-A299 PolarHBondContact O-N 3.36Å; M296-A299 PolarHBondContact O-N 2.8Å; M296-A299 VanDerWaalsContact O-N 3.16Å; M296-A299 HydrophobicContact SD-CB 4.45Å; A299-N306 WeakPolarHBondContact O-CB 3.31Å; A299-N306 PolarHBondContact O-ND2 3.23Å; A299-F347 HydrophobicContact CB-CE2 4.03Å; A299-F347 HydrophobicContact CB-CZ 3.93Å; A299-L364 WeakPolarHBondContact O-CD2 3.48Å; A299-Y366 HydrophobicContact CB-CD2 3.86Å; A299-Y366 HydrophobicContact CB-CE2 4.5Å
300	I	89.4	Confident	87.2	Confident	62 Å²	62	58.5 Å²	58.5	32%	0.318	31%	0.312	S	S	.	.	H	α-helix	trans	-68.1	-43.4	171.5	-65.4	173.9	0	0	0	110.4	M296 G304 N306 I307	M296-I300 HydrophobicContact CG-CD1 3.75Å; M296-I300 HydrophobicContact CG-CG1 4.28Å; M296-I300 PolarHBondContact O-N 3.31Å; M296-I300 HydrophobicContact SD-CD1 3.7Å; M296-I300 HydrophobicContact SD-CG1 3.75Å; I300-G304 CarbonylContact O-C 3.57Å; I300-G304 VanDerWaalsContact O-C 3.32Å; I300-G304 VanDerWaalsContact O-CA 3.32Å; I300-G304 WeakPolarHBondContact O-CA 3.21Å; I300-N306 PolarHBondContact O-N 3.1Å; I300-N306 VanDerWaalsContact O-N 3.1Å; I300-I307 HydrophobicContact CG2-CG2 4.09Å; I300-I307 PolarHBondContact O-N 3.3Å; I300-I307 VanDerWaalsContact O-N 3.14Å
301	G	86	Confident	87.6	Confident	17 Å²	17	59.5 Å²	59.5	18%	0.175	31%	0.312	C	S	.	.			trans	76.5	161.5	-175.2	0	0	0	0	0	113.1	G297 L298 R303 G304	G297-G301 VanDerWaalsContact O-CA 3.3Å; G297-G301 WeakPolarHBondContact O-CA 3.35Å; G297-G301 PolarHBondContact O-N 3.3Å; L298-G301 PolarHBondContact O-N 2.87Å; G301-R303 PolarHBondContact O-N 3.19Å; G301-G304 PolarHBondContact O-N 3.17Å
302	A	87.2	Confident	88	Confident	86 Å²	86	67.2 Å²	67.2	71%	0.711	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-55.3	130.2	176.8	0	0	0	0	0	110.9	G304 V305	A302-G304 PolarHBondContact O-N 3.36Å; A302-V305 WeakPolarHBondContact O-CB 3.21Å; A302-V305 VanDerWaalsContact O-CG2 3.25Å; A302-V305 WeakPolarHBondContact O-CG2 3.13Å; A302-V305 PolarHBondContact O-N 2.98Å
303	R	87.4	Confident	88.2	Confident	237 Å²	237	66.2 Å²	66.2	89%	0.894	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	52.8	30	-174	-54.2	178.8	-179.3	164.3	-1.5	113.9	G301 V305 R308	G301-R303 PolarHBondContact O-N 3.19Å; R303-V305 PolarHBondContact O-N 2.94Å; R303-R308 PolarHBondContact O-NH2 2.9Å
304	G	86.9	Confident	88.4	Confident	16 Å²	16	66.4 Å²	66.4	17%	0.165	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	62	25.8	-179.9	0	0	0	0	0	114	I300 G301 A302 R308	I300-G304 CarbonylContact O-C 3.57Å; I300-G304 VanDerWaalsContact O-C 3.32Å; I300-G304 VanDerWaalsContact O-CA 3.32Å; I300-G304 WeakPolarHBondContact O-CA 3.21Å; G301-G304 PolarHBondContact O-N 3.17Å; A302-G304 PolarHBondContact O-N 3.36Å; G304-R308 WeakPolarHBondContact O-CB 3.46Å; G304-R308 VanDerWaalsContact O-CG 3.29Å; G304-R308 WeakPolarHBondContact O-CG 3.24Å; G304-R308 PolarHBondContact O-N 3.46Å; G304-R308 VanDerWaalsContact O-N 3.15Å; G304-R308 PolarHBondContact O-NE 3.31Å; G304-R308 VanDerWaalsContact O-NE 3.11Å
305	V	91.7	Very high	88.5	Confident	86 Å²	86	64.7 Å²	64.7	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-65.6	-40.2	-177.4	167.5	0	0	0	0	111.5	A302 R303 A309	A302-V305 WeakPolarHBondContact O-CB 3.21Å; A302-V305 VanDerWaalsContact O-CG2 3.25Å; A302-V305 WeakPolarHBondContact O-CG2 3.13Å; A302-V305 PolarHBondContact O-N 2.98Å; R303-V305 PolarHBondContact O-N 2.94Å; V305-A309 VanDerWaalsContact O-CB 3.31Å; V305-A309 WeakPolarHBondContact O-CB 3.46Å; V305-A309 PolarHBondContact O-N 3.38Å
306	N	90.5	Very high	88.4	Confident	34 Å²	34	65.4 Å²	65.4	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-76.3	-41.6	-174.3	-168.1	62.1	0	0	0	112.1	A299 I300 R308 A309 A310 K363	A299-N306 WeakPolarHBondContact O-CB 3.31Å; A299-N306 PolarHBondContact O-ND2 3.23Å; I300-N306 PolarHBondContact O-N 3.1Å; I300-N306 VanDerWaalsContact O-N 3.1Å; N306-R308 VanDerWaalsContact C-N 3.35Å; N306-R308 PolarHBondContact O-N 3.38Å; N306-A309 PolarHBondContact O-N 3.19Å; N306-A310 PolarHBondContact O-N 2.96Å; N306-K363 PolarHBondContact ND2-O 2.97Å
307	I	89.8	Confident	88.3	Confident	19 Å²	19	69 Å²	69	10%	0.097	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-33.5	172.8	-169.3	169	0	0	0	112.9	I300 A310 R311 F347 L364	I300-I307 HydrophobicContact CG2-CG2 4.09Å; I300-I307 PolarHBondContact O-N 3.3Å; I300-I307 VanDerWaalsContact O-N 3.14Å; I307-A310 PolarHBondContact O-N 2.99Å; I307-R311 WeakPolarHBondContact O-CG 3.48Å; I307-R311 PolarHBondContact O-N 3.42Å; I307-F347 HydrophobicContact CD1-CE1 4.37Å; I307-L364 HydrophobicContact CB-CD2 4.48Å
308	R	91.6	Very high	88.2	Confident	140 Å²	140	72.4 Å²	72.4	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-65.8	-48.7	170.5	-77.2	-176.4	-69.8	147.2	-8.2	111.6	R303 G304 N306 A310 R311 E312	R303-R308 PolarHBondContact O-NH2 2.9Å; G304-R308 WeakPolarHBondContact O-CB 3.46Å; G304-R308 VanDerWaalsContact O-CG 3.29Å; G304-R308 WeakPolarHBondContact O-CG 3.24Å; G304-R308 PolarHBondContact O-N 3.46Å; G304-R308 VanDerWaalsContact O-N 3.15Å; G304-R308 PolarHBondContact O-NE 3.31Å; G304-R308 VanDerWaalsContact O-NE 3.11Å; N306-R308 VanDerWaalsContact C-N 3.35Å; N306-R308 PolarHBondContact O-N 3.38Å; R308-A310 PolarHBondContact O-N 3.46Å; R308-R311 CarbonylContact O-C 3.57Å; R308-R311 PolarHBondContact O-N 2.89Å; R308-E312 WeakPolarHBondContact O-CB 3.48Å; R308-E312 PolarHBondContact O-N 3.2Å
309	A	91.1	Very high	88.1	Confident	30 Å²	30	69.6 Å²	69.6	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-13.2	176.6	0	0	0	0	0	114.1	V305 N306 I313 K363	V305-A309 VanDerWaalsContact O-CB 3.31Å; V305-A309 WeakPolarHBondContact O-CB 3.46Å; V305-A309 PolarHBondContact O-N 3.38Å; N306-A309 PolarHBondContact O-N 3.19Å; A309-I313 WeakPolarHBondContact O-CG1 3.48Å; A309-K363 PolarHBondContact O-NZ 3.49Å
310	A	90.3	Very high	87.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-89.2	-36.3	168.9	0	0	0	0	0	112.9	N306 I307 R308 E312 I313 I319 K363 L364	N306-A310 PolarHBondContact O-N 2.96Å; I307-A310 PolarHBondContact O-N 2.99Å; R308-A310 PolarHBondContact O-N 3.46Å; A310-E312 VanDerWaalsContact C-N 3.31Å; A310-I313 WeakPolarHBondContact O-CG1 3.42Å; A310-I319 HydrophobicContact CB-CD1 3.67Å; A310-K363 HydrophobicContact CB-CB 4.42Å; A310-L364 HydrophobicContact CB-CD1 3.68Å; A310-L364 HydrophobicContact CB-CD2 3.95Å; A310-L364 HydrophobicContact CB-CG 3.75Å
311	R	90.8	Very high	87.6	Confident	138 Å²	138	70.9 Å²	70.9	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-73.1	-20.5	173.7	-71.3	175.8	174.8	172.4	-1.7	113.8	I307 R308 I313 I319	I307-R311 WeakPolarHBondContact O-CG 3.48Å; I307-R311 PolarHBondContact O-N 3.42Å; R308-R311 CarbonylContact O-C 3.57Å; R308-R311 PolarHBondContact O-N 2.89Å; R311-I313 VanDerWaalsContact C-N 3.31Å; R311-I319 HydrophobicContact CG-CB 4.08Å; R311-I319 HydrophobicContact CG-CD1 3.96Å; R311-I319 HydrophobicContact CG-CG1 4.09Å; R311-I319 PolarHBondContact NH2-O 3.43Å
312	E	91.5	Very high	87.1	Confident	162 Å²	162	73.6 Å²	73.6	76%	0.757	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	0.2	177.9	-167.2	170.9	-163.6	0	0	113	R308 A310	R308-E312 WeakPolarHBondContact O-CB 3.48Å; R308-E312 PolarHBondContact O-N 3.2Å; A310-E312 VanDerWaalsContact C-N 3.31Å
313	I	88.2	Confident	86.5	Confident	11 Å²	11	74.3 Å²	74.3	6%	0.056	35%	0.354	C	S	.	.	S	Bend	trans	-74.7	133.9	174.3	-60.4	172.2	0	0	0	108.6	A309 A310 R311 V316 A356 Q359 A360 K363	A309-I313 WeakPolarHBondContact O-CG1 3.48Å; A310-I313 WeakPolarHBondContact O-CG1 3.42Å; R311-I313 VanDerWaalsContact C-N 3.31Å; I313-V316 HydrophobicContact CB-CG2 3.82Å; I313-V316 HydrophobicContact CG2-CG2 4.02Å; I313-V316 PolarHBondContact O-N 3.11Å; I313-A356 HydrophobicContact CG2-CB 4.45Å; I313-Q359 HydrophobicContact CD1-CB 4.13Å; I313-Q359 HydrophobicContact CG2-CB 4.28Å; I313-A360 HydrophobicContact CD1-CB 3.9Å; I313-K363 HydrophobicContact CD1-CD 3.99Å
314	P	85.9	Confident	85.3	Confident	101 Å²	101	64 Å²	64	66%	0.656	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	155.8	175.8	25.3	-35	0	0	0	112.1	V316 A356	P314-V316 PolarHBondContact O-N 3.1Å; P314-A356 WeakPolarHBondContact O-CB 3.42Å
315	D	86.4	Confident	84.1	Confident	68 Å²	68	67.1 Å²	67.1	36%	0.364	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	-7.7	-175.7	-70.1	-30.2	0	0	0	118.1	I317 A351 K352 T353 A356	D315-I317 PolarHBondContact O-N 2.98Å; D315-A351 VanDerWaalsContact O-CA 3.28Å; D315-A351 WeakPolarHBondContact O-CA 3.38Å; D315-A351 WeakPolarHBondContact O-CB 3.27Å; D315-K352 HydrophobicContact CB-CB 4.11Å; D315-K352 PolarHBondContact O-N 2.71Å; D315-T353 HydrophobicContact CB-CG2 4.43Å; D315-T353 VanDerWaalsContact CB-OG1 3.24Å; D315-T353 WeakPolarHBondContact CB-OG1 3.38Å; D315-T353 WeakPolarHBondContact OD2-CG2 3.41Å; D315-T353 PolarHBondContact OD2-OG1 3.48Å; D315-A356 HydrophobicContact CB-CB 3.7Å
316	V	84.7	Confident	82.5	Confident	24 Å²	24	68.2 Å²	68.2	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	121	167.9	179.6	0	0	0	0	109	I313 P314 I319 A356 A360	I313-V316 HydrophobicContact CB-CG2 3.82Å; I313-V316 HydrophobicContact CG2-CG2 4.02Å; I313-V316 PolarHBondContact O-N 3.11Å; P314-V316 PolarHBondContact O-N 3.1Å; V316-I319 HydrophobicContact CG1-CD1 4.02Å; V316-I319 HydrophobicContact CG1-CG1 3.69Å; V316-A356 HydrophobicContact CG2-CB 4.16Å; V316-A360 HydrophobicContact CG2-CB 3.97Å
317	I	82.6	Confident	81.1	Confident	99 Å²	99	69.9 Å²	69.9	51%	0.508	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-46.8	179.2	-54.9	168.7	0	0	0	109.4	D315 E350 K352	D315-I317 PolarHBondContact O-N 2.98Å; I317-E350 WeakPolarHBondContact CA-O 3.3Å; I317-E350 HydrophobicContact CB-CB 4.33Å; I317-E350 WeakPolarHBondContact CB-O 3.41Å; I317-E350 PolarHBondContact N-O 2.69Å; I317-K352 HydrophobicContact CD1-CG 3.89Å; I317-K352 HydrophobicContact CG1-CG 3.98Å
318	R	83.6	Confident	79.2	Confident	125 Å²	125	71.4 Å²	71.4	47%	0.472	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.3	-172.2	-167.4	178.6	179.8	175.9	-11	111.1	E320 I349 E350	R318-E320 HydrophobicContact CG-CG 3.93Å; R318-E320 IonicContact CZ-OE1 3.94Å; R318-E320 IonicContact CZ-OE2 2.76Å; R318-E320 VanDerWaalsContact NE-CG 3.3Å; R318-E320 IonicContact NE-OE1 2.75Å; R318-E320 PolarHBondContact NE-OE1 3.35Å; R318-E320 IonicContact NE-OE2 2.69Å; R318-E320 IonicContact NH1-OE1 3.33Å; R318-E320 IonicContact NH2-OE1 2.72Å; R318-E320 PolarHBondContact NH2-OE1 2.79Å; R318-E320 VanDerWaalsContact NH2-OE1 3.07Å; R318-E320 IonicContact NH2-OE2 2.92Å; R318-E320 PolarHBondContact NH2-OE2 2.7Å; R318-I349 WeakPolarHBondContact O-CA 3.43Å; R318-E350 HydrophobicContact CB-CB 4.17Å; R318-E350 HydrophobicContact CB-CG 4.38Å; R318-E350 WeakPolarHBondContact CB-OE2 3.48Å; R318-E350 WeakPolarHBondContact CD-OE2 3.41Å; R318-E350 PolarHBondContact N-O 3.3Å; R318-E350 PolarHBondContact O-N 2.88Å
319	I	86.3	Confident	77.2	Confident	6 Å²	6	68.3 Å²	68.3	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	110.1	166.1	-56.8	-172.6	0	0	0	108.3	A310 R311 V316 F347 V348 I349 A360 L364	A310-I319 HydrophobicContact CB-CD1 3.67Å; R311-I319 HydrophobicContact CG-CB 4.08Å; R311-I319 HydrophobicContact CG-CD1 3.96Å; R311-I319 HydrophobicContact CG-CG1 4.09Å; R311-I319 PolarHBondContact NH2-O 3.43Å; V316-I319 HydrophobicContact CG1-CD1 4.02Å; V316-I319 HydrophobicContact CG1-CG1 3.69Å; I319-F347 HydrophobicContact CG2-CD1 4.12Å; I319-V348 WeakPolarHBondContact CA-O 3.38Å; I319-I349 HydrophobicContact CD1-CD1 4.48Å; I319-I349 HydrophobicContact CD1-CG1 4.5Å; I319-I349 HydrophobicContact CG1-CG1 4.2Å; I319-I349 HydrophobicContact CG1-CG2 4.39Å; I319-I349 HydrophobicContact CG2-CG1 4.25Å; I319-A360 HydrophobicContact CD1-CB 4.11Å; I319-L364 HydrophobicContact CD1-CD1 3.87Å; I319-L364 HydrophobicContact CG2-CD1 3.76Å
320	E	83.2	Confident	75.2	Confident	41 Å²	41	76.7 Å²	76.7	19%	0.192	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	154.1	171.5	-50.4	-163.6	-117.3	0	0	111.1	R318 W322 F347 V348	R318-E320 HydrophobicContact CG-CG 3.93Å; R318-E320 IonicContact CZ-OE1 3.94Å; R318-E320 IonicContact CZ-OE2 2.76Å; R318-E320 VanDerWaalsContact NE-CG 3.3Å; R318-E320 IonicContact NE-OE1 2.75Å; R318-E320 PolarHBondContact NE-OE1 3.35Å; R318-E320 IonicContact NE-OE2 2.69Å; R318-E320 IonicContact NH1-OE1 3.33Å; R318-E320 IonicContact NH2-OE1 2.72Å; R318-E320 PolarHBondContact NH2-OE1 2.79Å; R318-E320 VanDerWaalsContact NH2-OE1 3.07Å; R318-E320 IonicContact NH2-OE2 2.92Å; R318-E320 PolarHBondContact NH2-OE2 2.7Å; E320-W322 PolarHBondContact OE2-NE1 3.02Å; E320-F347 WeakPolarHBondContact O-CA 3.34Å; E320-F347 WeakPolarHBondContact O-CD1 3.49Å; E320-V348 HydrophobicContact CB-CB 4.31Å; E320-V348 PolarHBondContact N-O 2.98Å; E320-V348 PolarHBondContact O-N 3.37Å
321	S	83.1	Confident	72.9	Confident	48 Å²	48	81.9 Å²	81.9	34%	0.336	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	116.3	167.2	53.6	0	0	0	0	106.9	M346	S321-M346 CarbonylContact C-O 3.31Å; S321-M346 WeakPolarHBondContact CA-O 3.19Å
322	W	76.9	Confident	70.8	Confident	75 Å²	75	83.1 Å²	83.1	28%	0.284	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.5	177.6	-57.1	-14.9	0	0	0	109.6	E320 E326 Y327 A345 M346 V348	E320-W322 PolarHBondContact OE2-NE1 3.02Å; W322-E326 VanDerWaalsContact CA-OE2 3.28Å; W322-E326 WeakPolarHBondContact CA-OE2 3.43Å; W322-Y327 HydrophobicContact CB-CD1 4.1Å; W322-A345 WeakPolarHBondContact O-CA 3.42Å; W322-M346 HydrophobicContact CD2-CE 4.1Å; W322-M346 HydrophobicContact CE3-CE 3.24Å; W322-M346 HydrophobicContact CH2-CE 4.48Å; W322-M346 HydrophobicContact CZ3-CE 3.48Å; W322-M346 VanDerWaalsContact CZ3-CE 3.48Å; W322-M346 PolarHBondContact N-O 3.09Å; W322-M346 PolarHBondContact O-N 3.33Å; W322-V348 HydrophobicContact CH2-CG2 4.5Å; W322-V348 HydrophobicContact CZ2-CG2 4.34Å
323	E	74	Confident	68.5	Low	101 Å²	101	80.7 Å²	80.7	47%	0.472	42%	0.419	S	S	.	.			trans	-77.5	156.3	175.4	-67.2	-163.3	168.2	0	0	111.4	S325 E326 Y327	E323-S325 PolarHBondContact O-N 3.27Å; E323-E326 HydrophobicContact CB-CG 4.39Å; E323-E326 PolarHBondContact N-OE2 2.95Å; E323-E326 PolarHBondContact O-N 3.44Å; E323-Y327 VanDerWaalsContact O-CD1 3.23Å; E323-Y327 WeakPolarHBondContact O-CD1 3.41Å
324	P	62.9	Low	66.3	Low	21 Å²	21	86.4 Å²	86.4	14%	0.136	46%	0.457	C	S	.	.	H	α-helix	trans	-51.3	-32	-179.1	-29.5	35.7	0	0	0	115.3	S328 G342	P324-S328 VanDerWaalsContact O-CB 3.31Å; P324-S328 WeakPolarHBondContact O-CB 3.42Å; P324-S328 PolarHBondContact O-N 3.46Å; P324-S328 PolarHBondContact O-OG 2.8Å; P324-G342 VanDerWaalsContact CB-O 3.23Å; P324-G342 WeakPolarHBondContact CB-O 3.48Å; P324-G342 VanDerWaalsContact CG-O 3.23Å; P324-G342 WeakPolarHBondContact CG-O 3.47Å
325	S	60.2	Low	64.3	Low	80 Å²	80	87.2 Å²	87.2	56%	0.559	46%	0.455	S	S	*	.	H	α-helix	trans	-66.6	-31.6	175.5	44.7	0	0	0	0	114	E323	E323-S325 PolarHBondContact O-N 3.27Å
326	E	58	Low	62.2	Low	110 Å²	110	89.8 Å²	89.8	51%	0.514	47%	0.468	S	S	.	.	H	α-helix	trans	-84.5	-33.8	-170.2	-60.7	-178	124.5	0	0	112.7	W322 E323	W322-E326 VanDerWaalsContact CA-OE2 3.28Å; W322-E326 WeakPolarHBondContact CA-OE2 3.43Å; E323-E326 HydrophobicContact CB-CG 4.39Å; E323-E326 PolarHBondContact N-OE2 2.95Å; E323-E326 PolarHBondContact O-N 3.44Å
327	Y	61.4	Low	60.1	Low	69 Å²	69	94.1 Å²	94.1	27%	0.271	49%	0.49	S	S	.	.	H	α-helix	trans	-92.7	-30	179.2	61.2	-104.4	0	0	0	113.6	W322 E323 A329 R330 A344 M346	W322-Y327 HydrophobicContact CB-CD1 4.1Å; E323-Y327 VanDerWaalsContact O-CD1 3.23Å; E323-Y327 WeakPolarHBondContact O-CD1 3.41Å; Y327-A329 VanDerWaalsContact C-N 3.25Å; Y327-A329 PolarHBondContact O-N 2.98Å; Y327-R330 PolarHBondContact O-N 3.07Å; Y327-A344 PolarHBondContact OH-O 2.89Å; Y327-M346 HydrophobicContact CE1-CB 4.49Å
328	S	51	Low	58.3	Low	50 Å²	50	94.1 Å²	94.1	35%	0.35	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-30.7	176.1	-57.9	0	0	0	0	112.7	P324 R330	P324-S328 VanDerWaalsContact O-CB 3.31Å; P324-S328 WeakPolarHBondContact O-CB 3.42Å; P324-S328 PolarHBondContact O-N 3.46Å; P324-S328 PolarHBondContact O-OG 2.8Å; S328-R330 VanDerWaalsContact C-N 3.27Å; S328-R330 PolarHBondContact O-N 3.25Å
329	A	49.3	Very low	56.2	Low	76 Å²	76	90.3 Å²	90.3	63%	0.628	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.8	-176.6	0	0	0	0	0	115.3	Y327	Y327-A329 VanDerWaalsContact C-N 3.25Å; Y327-A329 PolarHBondContact O-N 2.98Å
330	R	48.5	Very low	54.4	Low	206 Å²	206	95.3 Å²	95.3	78%	0.777	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-18	-178.6	-81.1	-169.5	172.2	-168.3	-0.5	115.1	Y327 S328	Y327-R330 PolarHBondContact O-N 3.07Å; S328-R330 VanDerWaalsContact C-N 3.27Å; S328-R330 PolarHBondContact O-N 3.25Å
331	N	42.3	Very low	52.7	Low	108 Å²	108	101.5 Å²	101.5	58%	0.578	55%	0.549	S	S	*	.	S	Bend	trans	-104.2	127.7	169.7	-65	-6.8	0	0	0	107.6	D333	N331-D333 PolarHBondContact O-N 3.18Å; N331-D333 VanDerWaalsContact O-N 3.07Å
332	N	46.3	Very low	51.2	Low	165 Å²	165	101.2 Å²	101.2	88%	0.882	55%	0.553	S	S	*	*			trans	-77.5	16.3	-179.7	-75.3	-42.9	0	0	0	113.4
333	D	44.6	Very low	50.7	Low	110 Å²	110	104.2 Å²	104.2	59%	0.588	57%	0.571	S	S	*	*	S	Bend	trans	-82.7	125.9	176.4	-60.6	-62.2	0	0	0	109.5	N331 I335	N331-D333 PolarHBondContact O-N 3.18Å; N331-D333 VanDerWaalsContact O-N 3.07Å; D333-I335 HydrophobicContact CB-CG1 4.34Å; D333-I335 PolarHBondContact O-N 2.95Å
334	P	40.6	Very low	50.5	Low	131 Å²	131	100.5 Å²	100.5	85%	0.851	56%	0.557	S	S	*	*			trans	-75.3	70.8	176	32.2	-35.2	0	0	0	110.4	D336	P334-D336 PolarHBondContact O-N 3.37Å
335	I	43.9	Very low	51.3	Low	119 Å²	119	99.7 Å²	99.7	61%	0.61	55%	0.552	S	S	*	*			trans	-65.5	121.1	168.7	-64.9	177.8	0	0	0	107.7	D333 N337	D333-I335 HydrophobicContact CB-CG1 4.34Å; D333-I335 PolarHBondContact O-N 2.95Å; I335-N337 PolarHBondContact O-N 2.89Å
336	D	42.7	Very low	52.2	Low	121 Å²	121	97 Å²	97	65%	0.647	53%	0.531	S	S	*	.			trans	-69.7	96.3	-179.1	-166.8	-26.7	0	0	0	109.9	P334 S338 G339	P334-D336 PolarHBondContact O-N 3.37Å; D336-S338 PolarHBondContact O-N 3.05Å; D336-S338 VanDerWaalsContact OD1-CB 3.25Å; D336-S338 WeakPolarHBondContact OD1-CB 3.19Å; D336-S338 PolarHBondContact OD1-N 3.42Å; D336-S338 PolarHBondContact OD1-OG 3.1Å; D336-G339 PolarHBondContact O-N 2.85Å
337	N	41.4	Very low	53.5	Low	115 Å²	115	91.7 Å²	91.7	62%	0.615	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	14.9	-178.9	-79.5	-33.8	0	0	0	114.2	I335	I335-N337 PolarHBondContact O-N 2.89Å
338	S	43.8	Very low	54.4	Low	99 Å²	99	88.7 Å²	88.7	69%	0.692	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.3	164.4	60.2	0	0	0	0	113.8	D336 D340	D336-S338 PolarHBondContact O-N 3.05Å; D336-S338 VanDerWaalsContact OD1-CB 3.25Å; D336-S338 WeakPolarHBondContact OD1-CB 3.19Å; D336-S338 PolarHBondContact OD1-N 3.42Å; D336-S338 PolarHBondContact OD1-OG 3.1Å; S338-D340 PolarHBondContact O-N 2.97Å
339	G	39.1	Very low	56	Low	45 Å²	45	86.3 Å²	86.3	46%	0.464	48%	0.478	S	S	.	.	S	Bend	trans	-91.4	91.2	-178.8	0	0	0	0	0	116.2	D336 Y341	D336-G339 PolarHBondContact O-N 2.85Å; G339-Y341 PolarHBondContact O-N 2.84Å
340	D	49.1	Very low	57.5	Low	112 Å²	112	85.7 Å²	85.7	60%	0.599	46%	0.462	S	S	*	.	S	Bend	trans	47.5	-6.6	144.6	-140.7	20.1	0	0	0	122.4	S338 S434	S338-D340 PolarHBondContact O-N 2.97Å; D340-S434 WeakPolarHBondContact OD2-CB 3.41Å; D340-S434 PolarHBondContact OD2-OG 3.19Å
341	Y	48.3	Very low	59.2	Low	170 Å²	170	75.9 Å²	75.9	67%	0.667	43%	0.426	S	S	*	.			trans	-114.9	-6.7	-178.6	-73.8	-83	0	0	0	114	G339 E343 A344 T435	G339-Y341 PolarHBondContact O-N 2.84Å; Y341-E343 PolarHBondContact O-N 3.15Å; Y341-A344 PolarHBondContact O-N 2.99Å; Y341-T435 HydrophobicContact CD1-CG2 3.95Å; Y341-T435 HydrophobicContact CE1-CG2 4Å
342	G	52.1	Low	61.1	Low	42 Å²	42	77.1 Å²	77.1	43%	0.433	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	2.3	-167.7	0	0	0	0	0	118	P324	P324-G342 VanDerWaalsContact CB-O 3.23Å; P324-G342 WeakPolarHBondContact CB-O 3.48Å; P324-G342 VanDerWaalsContact CG-O 3.23Å; P324-G342 WeakPolarHBondContact CG-O 3.47Å
343	E	65.3	Low	62.7	Low	139 Å²	139	71.6 Å²	71.6	65%	0.65	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	19.5	-178	-62.9	-172.9	177.4	0	0	113.4	Q293 Y341	Q293-E343 HydrophobicContact CB-CB 4.44Å; Q293-E343 VanDerWaalsContact CB-O 3.27Å; Q293-E343 WeakPolarHBondContact CB-O 3.41Å; Q293-E343 PolarHBondContact N-O 2.96Å; Y341-E343 PolarHBondContact O-N 3.15Å
344	A	70.4	Confident	64.5	Low	22 Å²	22	68.3 Å²	68.3	18%	0.182	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.4	176.6	0	0	0	0	0	112	F290 Y327 Y341	F290-A344 HydrophobicContact CB-CB 4.4Å; F290-A344 HydrophobicContact CD1-CB 4.14Å; Y327-A344 PolarHBondContact OH-O 2.89Å; Y341-A344 PolarHBondContact O-N 2.99Å
345	A	80.2	Confident	66.6	Low	4 Å²	4	68.6 Å²	68.6	3%	0.033	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	138.9	173.7	0	0	0	0	0	110.4	F290 V291 M296 W322	F290-A345 WeakPolarHBondContact CA-O 3.31Å; V291-A345 PolarHBondContact N-O 3.2Å; V291-A345 PolarHBondContact O-N 2.96Å; M296-A345 HydrophobicContact CE-CB 3.31Å; W322-A345 WeakPolarHBondContact O-CA 3.42Å
346	M	78.2	Confident	68.7	Low	23 Å²	23	63.1 Å²	63.1	11%	0.113	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.5	-179.7	-174.7	175.5	58.1	0	0	110.4	K288 F290 S321 W322 Y327 V348	K288-M346 HydrophobicContact CD-SD 4.4Å; F290-M346 HydrophobicContact CD1-CB 3.95Å; F290-M346 HydrophobicContact CD1-CG 4.39Å; F290-M346 HydrophobicContact CE1-CB 3.75Å; F290-M346 HydrophobicContact CE1-CG 4.07Å; F290-M346 HydrophobicContact CE1-SD 4.29Å; F290-M346 HydrophobicContact CZ-CB 4.42Å; F290-M346 HydrophobicContact CZ-CG 4.27Å; F290-M346 HydrophobicContact CZ-SD 4.04Å; S321-M346 CarbonylContact C-O 3.31Å; S321-M346 WeakPolarHBondContact CA-O 3.19Å; W322-M346 HydrophobicContact CD2-CE 4.1Å; W322-M346 HydrophobicContact CE3-CE 3.24Å; W322-M346 HydrophobicContact CH2-CE 4.48Å; W322-M346 HydrophobicContact CZ3-CE 3.48Å; W322-M346 VanDerWaalsContact CZ3-CE 3.48Å; W322-M346 PolarHBondContact N-O 3.09Å; W322-M346 PolarHBondContact O-N 3.33Å; Y327-M346 HydrophobicContact CE1-CB 4.49Å; M346-V348 HydrophobicContact CE-CG2 4Å; M346-V348 HydrophobicContact CG-CG2 4.42Å
347	F	85	Confident	70.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140	165.5	-78.7	-91.2	0	0	0	110.5	K288 F289 V291 M296 A299 I307 I319 E320 L364	K288-F347 WeakPolarHBondContact CA-O 3.35Å; F289-F347 HydrophobicContact CD1-CB 4.22Å; F289-F347 HydrophobicContact CD2-CB 4.09Å; F289-F347 HydrophobicContact CD2-CD2 4.36Å; F289-F347 HydrophobicContact CE1-CB 3.66Å; F289-F347 HydrophobicContact CE2-CB 3.52Å; F289-F347 AromaticContact CE2-CD2 3.64Å; F289-F347 HydrophobicContact CE2-CD2 3.64Å; F289-F347 AromaticContact CE2-CG 3.72Å; F289-F347 HydrophobicContact CE2-CG 3.72Å; F289-F347 HydrophobicContact CG-CB 4.4Å; F289-F347 HydrophobicContact CZ-CB 3.26Å; F289-F347 HydrophobicContact CZ-CD1 4.35Å; F289-F347 HydrophobicContact CZ-CD2 4.11Å; F289-F347 AromaticContact CZ-CG 3.68Å; F289-F347 HydrophobicContact CZ-CG 3.68Å; F289-F347 PolarHBondContact N-O 2.8Å; F289-F347 PolarHBondContact O-N 3.07Å; V291-F347 HydrophobicContact CB-CD2 4.13Å; V291-F347 HydrophobicContact CB-CE2 3.92Å; V291-F347 HydrophobicContact CG2-CD2 3.64Å; V291-F347 HydrophobicContact CG2-CE2 3.68Å; M296-F347 HydrophobicContact CE-CD2 4.43Å; M296-F347 HydrophobicContact CE-CE2 3.49Å; M296-F347 VanDerWaalsContact CE-CE2 3.49Å; M296-F347 HydrophobicContact CE-CZ 3.83Å; M296-F347 HydrophobicContact SD-CE2 3.79Å; M296-F347 HydrophobicContact SD-CZ 3.59Å; M296-F347 VanDerWaalsContact SD-CZ 3.59Å; A299-F347 HydrophobicContact CB-CE2 4.03Å; A299-F347 HydrophobicContact CB-CZ 3.93Å; I307-F347 HydrophobicContact CD1-CE1 4.37Å; I319-F347 HydrophobicContact CG2-CD1 4.12Å; E320-F347 WeakPolarHBondContact O-CA 3.34Å; E320-F347 WeakPolarHBondContact O-CD1 3.49Å; F347-L364 HydrophobicContact CD1-CD1 4.26Å; F347-L364 HydrophobicContact CE1-CD1 4.31Å
348	V	81	Confident	72.7	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.03	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.6	171.6	-173.9	0	0	0	0	107.8	V286 K288 I319 E320 W322 M346	V286-V348 HydrophobicContact CG1-CG1 3.82Å; K288-V348 HydrophobicContact CD-CG2 4.48Å; K288-V348 HydrophobicContact CG-CG1 4.26Å; K288-V348 HydrophobicContact CG-CG2 4.29Å; I319-V348 WeakPolarHBondContact CA-O 3.38Å; E320-V348 HydrophobicContact CB-CB 4.31Å; E320-V348 PolarHBondContact N-O 2.98Å; E320-V348 PolarHBondContact O-N 3.37Å; W322-V348 HydrophobicContact CH2-CG2 4.5Å; W322-V348 HydrophobicContact CZ2-CG2 4.34Å; M346-V348 HydrophobicContact CE-CG2 4Å; M346-V348 HydrophobicContact CG-CG2 4.42Å
349	I	84.9	Confident	74.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.3	177.6	-59.6	-177.5	0	0	0	108.1	V286 E287 F289 R318 I319 A360 R361 L364	V286-I349 CarbonylContact C-O 3.55Å; V286-I349 VanDerWaalsContact CA-O 3.3Å; V286-I349 WeakPolarHBondContact CA-O 3.33Å; E287-I349 HydrophobicContact CB-CB 4.3Å; E287-I349 PolarHBondContact N-O 2.94Å; E287-I349 PolarHBondContact O-N 2.88Å; F289-I349 HydrophobicContact CE1-CD1 3.6Å; F289-I349 HydrophobicContact CE1-CG1 4.03Å; F289-I349 HydrophobicContact CZ-CD1 4.07Å; R318-I349 WeakPolarHBondContact O-CA 3.43Å; I319-I349 HydrophobicContact CD1-CD1 4.48Å; I319-I349 HydrophobicContact CD1-CG1 4.5Å; I319-I349 HydrophobicContact CG1-CG1 4.2Å; I319-I349 HydrophobicContact CG1-CG2 4.39Å; I319-I349 HydrophobicContact CG2-CG1 4.25Å; I349-A360 HydrophobicContact CD1-CB 3.71Å; I349-A360 HydrophobicContact CG2-CB 4.02Å; I349-R361 HydrophobicContact CD1-CB 4.32Å; I349-L364 HydrophobicContact CD1-CD1 4.25Å
350	E	78.9	Confident	77.3	Confident	63 Å²	63	55.6 Å²	55.6	29%	0.294	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.5	172.2	-56.5	-179.3	137.5	0	0	108.1	I317 R318	I317-E350 WeakPolarHBondContact CA-O 3.3Å; I317-E350 HydrophobicContact CB-CB 4.33Å; I317-E350 WeakPolarHBondContact CB-O 3.41Å; I317-E350 PolarHBondContact N-O 2.69Å; R318-E350 HydrophobicContact CB-CB 4.17Å; R318-E350 HydrophobicContact CB-CG 4.38Å; R318-E350 WeakPolarHBondContact CB-OE2 3.48Å; R318-E350 WeakPolarHBondContact CD-OE2 3.41Å; R318-E350 PolarHBondContact N-O 3.3Å; R318-E350 PolarHBondContact O-N 2.88Å
351	A	84.7	Confident	79.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.2	174.3	0	0	0	0	0	112.4	F285 D315 A356 A357	F285-A351 PolarHBondContact N-O 2.91Å; F285-A351 PolarHBondContact O-N 3.43Å; D315-A351 VanDerWaalsContact O-CA 3.28Å; D315-A351 WeakPolarHBondContact O-CA 3.38Å; D315-A351 WeakPolarHBondContact O-CB 3.27Å; A351-A356 HydrophobicContact CB-CB 3.95Å; A351-A357 HydrophobicContact CB-CB 3.89Å
352	K	81.7	Confident	81.1	Confident	134 Å²	134	45.5 Å²	45.5	58%	0.583	24%	0.235	S	C	*	.	S	Bend	trans	-68.4	-39.9	176.6	-59	178.6	-174.8	172.1	0	111.7	D315 I317	D315-K352 HydrophobicContact CB-CB 4.11Å; D315-K352 PolarHBondContact O-N 2.71Å; I317-K352 HydrophobicContact CD1-CG 3.89Å; I317-K352 HydrophobicContact CG1-CG 3.98Å
353	T	81.6	Confident	82.9	Confident	48 Å²	48	47.3 Å²	47.3	29%	0.294	23%	0.231	S	C	.	.	S	Bend	trans	-110.7	147	-176.9	51.5	0	0	0	0	111.4	D315 E355 A356 A357	D315-T353 HydrophobicContact CB-CG2 4.43Å; D315-T353 VanDerWaalsContact CB-OG1 3.24Å; D315-T353 WeakPolarHBondContact CB-OG1 3.38Å; D315-T353 WeakPolarHBondContact OD2-CG2 3.41Å; D315-T353 PolarHBondContact OD2-OG1 3.48Å; T353-E355 PolarHBondContact O-N 3.26Å; T353-A356 PolarHBondContact O-N 3.46Å; T353-A356 WeakPolarHBondContact OG1-CB 3.44Å; T353-A357 PolarHBondContact O-N 3.08Å
354	P	81.1	Confident	84.1	Confident	42 Å²	42	40.7 Å²	40.7	27%	0.273	20%	0.2	S	C	.	.	H	α-helix	trans	-67.1	-29.2	-179.1	26.5	-30.9	0	0	0	111.2	F285 K358	F285-P354 HydrophobicContact CD1-CB 3.7Å; F285-P354 HydrophobicContact CD2-CB 3.78Å; F285-P354 HydrophobicContact CD2-CG 4.18Å; F285-P354 VanDerWaalsContact CD2-N 3.31Å; F285-P354 HydrophobicContact CE1-CB 3.77Å; F285-P354 HydrophobicContact CE1-CG 4.4Å; F285-P354 HydrophobicContact CE2-CB 3.88Å; F285-P354 VanDerWaalsContact CE2-CD 3.45Å; F285-P354 HydrophobicContact CE2-CG 3.89Å; F285-P354 HydrophobicContact CG-CB 3.69Å; F285-P354 HydrophobicContact CZ-CB 3.86Å; F285-P354 HydrophobicContact CZ-CG 4Å; P354-K358 WeakPolarHBondContact O-CB 3.42Å; P354-K358 WeakPolarHBondContact O-CD 3.31Å; P354-K358 WeakPolarHBondContact O-CG 2.91Å; P354-K358 PolarHBondContact O-N 3.35Å
355	E	84.2	Confident	85	Confident	137 Å²	137	40.5 Å²	40.5	64%	0.64	20%	0.195	S	C	*	.	H	α-helix	trans	-69.6	-42.9	179.9	-54.3	-164.4	163.6	0	0	111.5	T353 K358 Q359	T353-E355 PolarHBondContact O-N 3.26Å; E355-K358 PolarHBondContact O-N 2.56Å; E355-Q359 WeakPolarHBondContact O-CB 3.48Å; E355-Q359 VanDerWaalsContact O-CG 3.22Å; E355-Q359 WeakPolarHBondContact O-CG 3.49Å; E355-Q359 PolarHBondContact O-N 3.09Å
356	A	88.2	Confident	85.5	Confident	3 Å²	3	41.8 Å²	41.8	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-44	175	0	0	0	0	0	112.1	I313 P314 D315 V316 A351 T353 K358 Q359 A360	I313-A356 HydrophobicContact CG2-CB 4.45Å; P314-A356 WeakPolarHBondContact O-CB 3.42Å; D315-A356 HydrophobicContact CB-CB 3.7Å; V316-A356 HydrophobicContact CG2-CB 4.16Å; A351-A356 HydrophobicContact CB-CB 3.95Å; T353-A356 PolarHBondContact O-N 3.46Å; T353-A356 WeakPolarHBondContact OG1-CB 3.44Å; A356-K358 VanDerWaalsContact C-N 3.34Å; A356-K358 PolarHBondContact O-N 3.36Å; A356-Q359 PolarHBondContact O-N 2.82Å; A356-A360 WeakPolarHBondContact O-CB 3.36Å; A356-A360 PolarHBondContact O-N 2.84Å
357	A	83.8	Confident	86	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-47.1	174.8	0	0	0	0	0	111.3	F285 E287 A351 T353 A360 R361	F285-A357 HydrophobicContact CB-CB 3.99Å; E287-A357 HydrophobicContact CB-CB 4.25Å; E287-A357 HydrophobicContact CG-CB 3.58Å; A351-A357 HydrophobicContact CB-CB 3.89Å; T353-A357 PolarHBondContact O-N 3.08Å; A357-A360 PolarHBondContact O-N 3.02Å; A357-R361 VanDerWaalsContact O-CB 3.29Å; A357-R361 WeakPolarHBondContact O-CB 3.41Å; A357-R361 PolarHBondContact O-N 3.37Å
358	K	85.4	Confident	86.3	Confident	122 Å²	122	43.1 Å²	43.1	53%	0.53	21%	0.209	S	C	.	.	H	α-helix	trans	-67.7	-39.1	178.3	-71.9	168.9	-174.5	176.8	0	113	P354 E355 A356 R361 A362	P354-K358 WeakPolarHBondContact O-CB 3.42Å; P354-K358 WeakPolarHBondContact O-CD 3.31Å; P354-K358 WeakPolarHBondContact O-CG 2.91Å; P354-K358 PolarHBondContact O-N 3.35Å; E355-K358 PolarHBondContact O-N 2.56Å; A356-K358 VanDerWaalsContact C-N 3.34Å; A356-K358 PolarHBondContact O-N 3.36Å; K358-R361 PolarHBondContact O-N 3.37Å; K358-A362 VanDerWaalsContact O-CB 3.31Å; K358-A362 WeakPolarHBondContact O-CB 3.17Å; K358-A362 PolarHBondContact O-N 3.19Å
359	Q	88.9	Confident	86.7	Confident	100 Å²	100	43 Å²	43	47%	0.467	21%	0.208	S	C	.	.	H	α-helix	trans	-64.7	-41.6	175.5	-76	179.1	45.1	0	0	111.8	I313 E355 A356 A362 K363	I313-Q359 HydrophobicContact CD1-CB 4.13Å; I313-Q359 HydrophobicContact CG2-CB 4.28Å; E355-Q359 WeakPolarHBondContact O-CB 3.48Å; E355-Q359 VanDerWaalsContact O-CG 3.22Å; E355-Q359 WeakPolarHBondContact O-CG 3.49Å; E355-Q359 PolarHBondContact O-N 3.09Å; A356-Q359 PolarHBondContact O-N 2.82Å; Q359-A362 PolarHBondContact O-N 3.36Å; Q359-K363 PolarHBondContact O-N 3.4Å
360	A	89.9	Confident	87	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.2	-41	176.1	0	0	0	0	0	111.6	I313 V316 I319 I349 A356 A357 K363 L364	I313-A360 HydrophobicContact CD1-CB 3.9Å; V316-A360 HydrophobicContact CG2-CB 3.97Å; I319-A360 HydrophobicContact CD1-CB 4.11Å; I349-A360 HydrophobicContact CD1-CB 3.71Å; I349-A360 HydrophobicContact CG2-CB 4.02Å; A356-A360 WeakPolarHBondContact O-CB 3.36Å; A356-A360 PolarHBondContact O-N 2.84Å; A357-A360 PolarHBondContact O-N 3.02Å; A360-K363 PolarHBondContact O-N 3.33Å; A360-L364 WeakPolarHBondContact O-CG 3.33Å; A360-L364 PolarHBondContact O-N 3.35Å
361	R	88.8	Confident	87.5	Confident	46 Å²	46	40.2 Å²	40.2	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-56.7	-48.4	171.1	-179.2	175.4	179.8	137.2	17.6	111.4	E287 K288 F289 I349 A357 K358 K363 L364 E365 R467	E287-R361 WeakPolarHBondContact OE2-CD 3.48Å; E287-R361 IonicContact OE2-CZ 3.27Å; E287-R361 IonicContact OE2-NE 3.26Å; E287-R361 IonicContact OE2-NH1 3.42Å; E287-R361 PolarHBondContact OE2-NH1 3.32Å; K288-R361 PolarHBondContact O-NH1 2.86Å; F289-R361 HydrophobicContact CD1-CG 3.86Å; F289-R361 HydrophobicContact CE1-CB 4.26Å; F289-R361 HydrophobicContact CE1-CG 4.05Å; I349-R361 HydrophobicContact CD1-CB 4.32Å; A357-R361 VanDerWaalsContact O-CB 3.29Å; A357-R361 WeakPolarHBondContact O-CB 3.41Å; A357-R361 PolarHBondContact O-N 3.37Å; K358-R361 PolarHBondContact O-N 3.37Å; R361-K363 VanDerWaalsContact C-N 3.25Å; R361-K363 PolarHBondContact O-N 2.94Å; R361-L364 PolarHBondContact O-N 2.95Å; R361-E365 HydrophobicContact CG-CB 4.24Å; R361-E365 WeakPolarHBondContact CG-OE2 3.28Å; R361-E365 IonicContact CZ-OE1 2.77Å; R361-E365 IonicContact CZ-OE2 3.34Å; R361-E365 IonicContact NE-OE1 2.77Å; R361-E365 IonicContact NE-OE2 3.94Å; R361-E365 PolarHBondContact NE-OE2 2.94Å; R361-E365 IonicContact NH2-OE1 3.14Å; R361-E365 PolarHBondContact NH2-OE1 3.01Å; R361-E365 IonicContact NH2-OE2 3.1Å; R361-E365 PolarHBondContact NH2-OE2 3.48Å; R361-E365 WeakPolarHBondContact O-CB 3.28Å; R361-E365 PolarHBondContact O-N 3.32Å; R361-R467 VanDerWaalsContact NH2-NH1 3.19Å
362	A	89.5	Confident	87.8	Confident	25 Å²	25	40.1 Å²	40.1	21%	0.207	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-27.2	180	0	0	0	0	0	114.2	K358 Q359 T466	K358-A362 VanDerWaalsContact O-CB 3.31Å; K358-A362 WeakPolarHBondContact O-CB 3.17Å; K358-A362 PolarHBondContact O-N 3.19Å; Q359-A362 PolarHBondContact O-N 3.36Å; A362-T466 WeakPolarHBondContact O-CB 3.4Å; A362-T466 WeakPolarHBondContact O-CG2 3.47Å
363	K	88.7	Confident	88.2	Confident	79 Å²	79	33.8 Å²	33.8	34%	0.343	17%	0.167	S	C	.	.	H	α-helix	trans	-80.2	-25.1	172.6	-67.5	-170.5	-165.8	177.5	0	113.8	N306 A309 A310 I313 Q359 A360 R361 Y366	N306-K363 PolarHBondContact ND2-O 2.97Å; A309-K363 PolarHBondContact O-NZ 3.49Å; A310-K363 HydrophobicContact CB-CB 4.42Å; I313-K363 HydrophobicContact CD1-CD 3.99Å; Q359-K363 PolarHBondContact O-N 3.4Å; A360-K363 PolarHBondContact O-N 3.33Å; R361-K363 VanDerWaalsContact C-N 3.25Å; R361-K363 PolarHBondContact O-N 2.94Å; K363-Y366 WeakPolarHBondContact O-CE2 3.24Å
364	L	91.1	Very high	88.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-114.1	-22.3	-167.2	-65.2	-177.8	0	0	0	115.1	F289 V291 A299 I307 A310 I319 F347 I349 A360 R361 Y366	F289-L364 HydrophobicContact CE2-CB 3.99Å; F289-L364 HydrophobicContact CZ-CB 3.6Å; V291-L364 WeakPolarHBondContact CG2-O 3.15Å; A299-L364 WeakPolarHBondContact O-CD2 3.48Å; I307-L364 HydrophobicContact CB-CD2 4.48Å; A310-L364 HydrophobicContact CB-CD1 3.68Å; A310-L364 HydrophobicContact CB-CD2 3.95Å; A310-L364 HydrophobicContact CB-CG 3.75Å; I319-L364 HydrophobicContact CD1-CD1 3.87Å; I319-L364 HydrophobicContact CG2-CD1 3.76Å; F347-L364 HydrophobicContact CD1-CD1 4.26Å; F347-L364 HydrophobicContact CE1-CD1 4.31Å; I349-L364 HydrophobicContact CD1-CD1 4.25Å; A360-L364 WeakPolarHBondContact O-CG 3.33Å; A360-L364 PolarHBondContact O-N 3.35Å; R361-L364 PolarHBondContact O-N 2.95Å; L364-Y366 PolarHBondContact O-N 3.47Å
365	E	88.8	Confident	88.9	Confident	18 Å²	18	33.7 Å²	33.7	8%	0.084	16%	0.156	C	C	.	.			trans	-75.8	70.8	-178.3	-168.4	175.9	-166.5	0	0	111.7	F289 R361 T466 R467	F289-E365 HydrophobicContact CB-CG 4.09Å; F289-E365 HydrophobicContact CD2-CB 3.7Å; F289-E365 HydrophobicContact CD2-CG 3.73Å; F289-E365 HydrophobicContact CE2-CB 3.92Å; F289-E365 HydrophobicContact CE2-CG 4.45Å; F289-E365 HydrophobicContact CG-CB 4.15Å; F289-E365 HydrophobicContact CG-CG 4Å; R361-E365 HydrophobicContact CG-CB 4.24Å; R361-E365 WeakPolarHBondContact CG-OE2 3.28Å; R361-E365 IonicContact CZ-OE1 2.77Å; R361-E365 IonicContact CZ-OE2 3.34Å; R361-E365 IonicContact NE-OE1 2.77Å; R361-E365 IonicContact NE-OE2 3.94Å; R361-E365 PolarHBondContact NE-OE2 2.94Å; R361-E365 IonicContact NH2-OE1 3.14Å; R361-E365 PolarHBondContact NH2-OE1 3.01Å; R361-E365 IonicContact NH2-OE2 3.1Å; R361-E365 PolarHBondContact NH2-OE2 3.48Å; R361-E365 WeakPolarHBondContact O-CB 3.28Å; R361-E365 PolarHBondContact O-N 3.32Å; E365-T466 CarbonylContact O-C 3.57Å; E365-T466 WeakPolarHBondContact O-CA 3.49Å; E365-R467 HydrophobicContact CB-CB 4.41Å; E365-R467 HydrophobicContact CG-CB 4.07Å; E365-R467 PolarHBondContact O-N 3.41Å; E365-R467 VanDerWaalsContact OE1-CD 3.27Å; E365-R467 WeakPolarHBondContact OE1-CD 3.39Å; E365-R467 IonicContact OE1-CZ 3.88Å; E365-R467 IonicContact OE1-NE 2.7Å; E365-R467 IonicContact OE1-NH1 3.65Å; E365-R467 PolarHBondContact OE1-NH1 2.82Å; E365-R467 VanDerWaalsContact OE2-CD 3.26Å; E365-R467 WeakPolarHBondContact OE2-CD 3.45Å; E365-R467 IonicContact OE2-NH1 3.28Å
366	Y	90.9	Very high	89.1	Confident	32 Å²	32	32.5 Å²	32.5	13%	0.125	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132.3	171.8	-77.4	-94.8	0	0	0	111.3	L298 A299 K363 L364 V399 G465 T466	L298-Y366 HydrophobicContact CB-CD1 3.64Å; L298-Y366 HydrophobicContact CB-CD2 4.28Å; L298-Y366 HydrophobicContact CB-CE1 3.66Å; L298-Y366 HydrophobicContact CB-CE2 4.28Å; L298-Y366 HydrophobicContact CB-CG 3.96Å; L298-Y366 HydrophobicContact CD1-CD1 3.94Å; L298-Y366 HydrophobicContact CD1-CE1 4.21Å; L298-Y366 HydrophobicContact CG-CD1 4.46Å; L298-Y366 WeakPolarHBondContact O-CE2 3.22Å; A299-Y366 HydrophobicContact CB-CD2 3.86Å; A299-Y366 HydrophobicContact CB-CE2 4.5Å; K363-Y366 WeakPolarHBondContact O-CE2 3.24Å; L364-Y366 PolarHBondContact O-N 3.47Å; Y366-V399 HydrophobicContact CE1-CG2 4.06Å; Y366-G465 WeakPolarHBondContact CA-O 3.42Å; Y366-G465 VanDerWaalsContact CD1-C 3.5Å; Y366-T466 HydrophobicContact CD1-CG2 4.3Å; Y366-T466 HydrophobicContact CD2-CG2 4.11Å; Y366-T466 HydrophobicContact CE1-CG2 3.92Å; Y366-T466 HydrophobicContact CE2-CG2 3.71Å; Y366-T466 HydrophobicContact CG-CG2 4.4Å
367	S	89.4	Confident	89.2	Confident	32 Å²	32	32.4 Å²	32.4	22%	0.224	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	172.5	-178.2	49.5	0	0	0	0	111.8	L295 G465 I470	L295-S367 VanDerWaalsContact CD1-C 3.43Å; S367-G465 PolarHBondContact N-O 3.22Å; S367-G465 PolarHBondContact O-N 2.88Å; S367-I470 VanDerWaalsContact O-CD1 3.25Å; S367-I470 WeakPolarHBondContact O-CD1 3.37Å; S367-I470 WeakPolarHBondContact OG-CD1 3.33Å
368	E	90	Very high	89.6	Confident	19 Å²	19	32.9 Å²	32.9	9%	0.089	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.1	166.2	-90.6	173	-120.5	0	0	109.2	H294 L295 R430 M436 I462 L463 A464	H294-E368 IonicContact CD2-OE1 3.64Å; H294-E368 IonicContact CE1-OE1 2.8Å; H294-E368 IonicContact NE2-OE1 3.51Å; H294-E368 PolarHBondContact NE2-OE1 3.42Å; L295-E368 HydrophobicContact CD1-CG 4.38Å; E368-R430 VanDerWaalsContact CD-NH2 3.3Å; E368-R430 IonicContact OE1-CZ 2.68Å; E368-R430 IonicContact OE1-NH2 3.45Å; E368-R430 PolarHBondContact OE1-NH2 2.98Å; E368-R430 IonicContact OE2-CZ 3.66Å; E368-R430 VanDerWaalsContact OE2-CZ 3.32Å; E368-R430 IonicContact OE2-NH1 2.7Å; E368-R430 PolarHBondContact OE2-NH1 2.96Å; E368-R430 IonicContact OE2-NH2 3.99Å; E368-R430 PolarHBondContact OE2-NH2 2.79Å; E368-M436 HydrophobicContact CB-CE 3.98Å; E368-M436 HydrophobicContact CB-CG 4.09Å; E368-M436 HydrophobicContact CB-SD 4.27Å; E368-M436 WeakPolarHBondContact OE2-CE 3.4Å; E368-I462 HydrophobicContact CG-CG2 4.21Å; E368-L463 WeakPolarHBondContact CA-O 3.16Å; E368-A464 HydrophobicContact CG-CB 3.65Å
369	L	89.7	Confident	89.9	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.7	173.6	176.9	73.8	0	0	0	109.7	L371 R437 V439 I462 L463 I470	L369-L371 HydrophobicContact CD2-CD1 4.5Å; L369-R437 HydrophobicContact CD1-CB 3.92Å; L369-R437 HydrophobicContact CD1-CG 3.64Å; L369-R437 WeakPolarHBondContact CD1-O 3.37Å; L369-V439 HydrophobicContact CD1-CB 4.29Å; L369-V439 HydrophobicContact CD1-CG2 3.84Å; L369-I462 WeakPolarHBondContact O-CA 3.15Å; L369-L463 HydrophobicContact CD2-CD1 4.28Å; L369-L463 PolarHBondContact N-O 3.04Å; L369-L463 PolarHBondContact O-N 2.86Å; L369-I470 HydrophobicContact CB-CG2 3.5Å; L369-I470 HydrophobicContact CD2-CG2 3.56Å; L369-I470 HydrophobicContact CG-CG2 4.14Å
370	Y	91	Very high	90	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	109.4	167.3	-166.1	-81.9	0	0	0	109.4	D404 I407 M436 R437 R438 V439 F440 G460 I462	Y370-D404 HydrophobicContact CE2-CB 4.42Å; Y370-I407 HydrophobicContact CE1-CD1 4.09Å; Y370-I407 HydrophobicContact CE1-CG1 4.29Å; Y370-I407 WeakPolarHBondContact OH-CD1 3.34Å; Y370-I407 WeakPolarHBondContact OH-CG1 3.18Å; Y370-M436 HydrophobicContact CD2-SD 4.32Å; Y370-R437 PolarHBondContact N-O 2.91Å; Y370-R438 WeakPolarHBondContact O-CA 3.08Å; Y370-V439 PolarHBondContact O-N 3.09Å; Y370-F440 HydrophobicContact CE1-CE1 4.48Å; Y370-F440 HydrophobicContact CE1-CZ 4.46Å; Y370-G460 WeakPolarHBondContact OH-CA 3.01Å; Y370-I462 HydrophobicContact CD2-CD1 4.35Å; Y370-I462 HydrophobicContact CD2-CG1 3.84Å; Y370-I462 HydrophobicContact CE2-CG1 4.24Å
371	L	90.6	Very high	90.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	95.5	178.7	-169.5	67.8	0	0	0	110.2	L369 V373 V439 L441 F461 L463 R474 I477	L369-L371 HydrophobicContact CD2-CD1 4.5Å; L371-V373 HydrophobicContact CG-CG2 4.47Å; L371-V439 CarbonylContact C-O 3.59Å; L371-V439 WeakPolarHBondContact CA-O 3.37Å; L371-V439 HydrophobicContact CD1-CB 4.02Å; L371-V439 HydrophobicContact CD1-CG1 3.64Å; L371-L441 HydrophobicContact CD1-CD1 3.9Å; L371-L441 HydrophobicContact CD1-CD2 3.88Å; L371-L441 HydrophobicContact CD1-CG 3.73Å; L371-L441 HydrophobicContact CD2-CD1 4.05Å; L371-L441 HydrophobicContact CG-CD1 4.09Å; L371-L441 HydrophobicContact CG-CG 4.25Å; L371-F461 HydrophobicContact CB-CB 4.41Å; L371-F461 PolarHBondContact N-O 2.85Å; L371-F461 PolarHBondContact O-N 3.09Å; L371-L463 HydrophobicContact CB-CD1 4.35Å; L371-L463 HydrophobicContact CB-CG 4.45Å; L371-L463 HydrophobicContact CD2-CD1 4.07Å; L371-R474 HydrophobicContact CD1-CG 4.24Å; L371-R474 HydrophobicContact CD2-CB 4.47Å; L371-I477 HydrophobicContact CD2-CB 4.1Å; L371-I477 HydrophobicContact CD2-CD1 3.73Å; L371-I477 HydrophobicContact CD2-CG2 3.88Å
372	G	89.5	Confident	90.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.5	174.8	0	0	0	0	0	111.4	V439 F440 L441	G372-V439 PolarHBondContact N-O 3.26Å; G372-F440 WeakPolarHBondContact O-CA 3.08Å; G372-L441 PolarHBondContact O-N 2.81Å
373	V	90.4	Very high	90.3	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	-124.2	138.3	178.3	170.8	0	0	0	0	109.9	L371 R375 V378 L381 L441 Y458 G459 F461 I477 M481	L371-V373 HydrophobicContact CG-CG2 4.47Å; V373-R375 PolarHBondContact O-N 3.26Å; V373-V378 HydrophobicContact CG1-CG2 4.36Å; V373-L381 HydrophobicContact CG1-CD1 3.68Å; V373-L381 HydrophobicContact CG2-CD1 4.32Å; V373-L441 HydrophobicContact CG2-CD1 4.34Å; V373-Y458 WeakPolarHBondContact O-CA 3.49Å; V373-G459 PolarHBondContact N-O 2.91Å; V373-G459 PolarHBondContact O-N 3.25Å; V373-G459 VanDerWaalsContact O-O 3.13Å; V373-F461 HydrophobicContact CB-CD2 4.21Å; V373-F461 HydrophobicContact CB-CE2 4.13Å; V373-F461 HydrophobicContact CG1-CE2 4.48Å; V373-F461 HydrophobicContact CG2-CD2 3.82Å; V373-F461 HydrophobicContact CG2-CE2 4.06Å; V373-I477 HydrophobicContact CG2-CG2 4.11Å; V373-M481 HydrophobicContact CB-SD 4.19Å; V373-M481 HydrophobicContact CG1-CE 4.2Å; V373-M481 HydrophobicContact CG1-CG 4.37Å; V373-M481 HydrophobicContact CG1-SD 3.6Å; V373-M481 VanDerWaalsContact CG1-SD 3.6Å; V373-M481 HydrophobicContact CG2-SD 3.72Å
374	P	89	Confident	90.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	131.9	175.9	-25.4	34.6	0	0	0	112.1	R376 Y377 E456 E457 Y458 M481	P374-R376 HydrophobicContact CB-CG 4.49Å; P374-R376 VanDerWaalsContact CB-NH1 3.34Å; P374-R376 PolarHBondContact O-N 2.88Å; P374-Y377 HydrophobicContact CB-CD2 3.99Å; P374-Y377 HydrophobicContact CB-CE2 4.24Å; P374-Y377 HydrophobicContact CG-CD2 4.22Å; P374-Y377 HydrophobicContact CG-CE2 4.33Å; P374-Y377 PolarHBondContact O-N 2.86Å; P374-E456 WeakPolarHBondContact CB-OE2 3.47Å; P374-E456 WeakPolarHBondContact CG-OE2 3.24Å; P374-E457 CarbonylContact C-O 3.53Å; P374-E457 WeakPolarHBondContact CA-O 3.48Å; P374-Y458 HydrophobicContact CG-CD1 4.34Å; P374-Y458 HydrophobicContact CG-CE1 3.76Å; P374-M481 HydrophobicContact CG-CE 4.41Å
375	R	88.7	Confident	90.4	Very high	89 Å²	89	44 Å²	44	34%	0.336	20%	0.204	S	C	.	.	H	α-helix	trans	-57.4	-29.3	-164.4	-155.4	174.5	-167.9	-176.8	3.8	113.3	V373 Y377 V378 D405 E457	V373-R375 PolarHBondContact O-N 3.26Å; R375-Y377 VanDerWaalsContact C-N 3.3Å; R375-Y377 PolarHBondContact O-N 3.15Å; R375-V378 WeakPolarHBondContact O-CB 3.12Å; R375-V378 PolarHBondContact O-N 2.9Å; R375-D405 IonicContact CZ-OD1 3.63Å; R375-D405 IonicContact NE-OD1 2.75Å; R375-D405 PolarHBondContact NE-OD1 3.31Å; R375-D405 IonicContact NH2-OD1 3.65Å; R375-D405 PolarHBondContact NH2-OD1 2.85Å; R375-E457 HydrophobicContact CB-CB 4.41Å; R375-E457 HydrophobicContact CB-CG 4.27Å; R375-E457 WeakPolarHBondContact CD-OE2 3.35Å; R375-E457 IonicContact CZ-OE1 3.5Å; R375-E457 PolarHBondContact N-O 2.81Å; R375-E457 IonicContact NE-OE1 3.39Å; R375-E457 IonicContact NH1-OE1 2.75Å; R375-E457 PolarHBondContact NH1-OE1 2.86Å; R375-E457 IonicContact NH1-OE2 3.96Å
376	R	88.3	Confident	90.5	Very high	111 Å²	111	46.2 Å²	46.2	42%	0.419	22%	0.219	S	C	.	.	H	α-helix	trans	-55.9	-36.2	173.6	68.6	-179.2	175.7	-75.7	9.6	114.3	P374 E456	P374-R376 HydrophobicContact CB-CG 4.49Å; P374-R376 VanDerWaalsContact CB-NH1 3.34Å; P374-R376 PolarHBondContact O-N 2.88Å; R376-E456 IonicContact CZ-OE1 3.26Å; R376-E456 IonicContact CZ-OE2 2.81Å; R376-E456 IonicContact NH1-OE1 3.57Å; R376-E456 PolarHBondContact NH1-OE1 3.44Å; R376-E456 IonicContact NH1-OE2 3.75Å; R376-E456 PolarHBondContact NH1-OE2 2.63Å; R376-E456 IonicContact NH2-OE1 3.27Å; R376-E456 PolarHBondContact NH2-OE1 2.82Å; R376-E456 IonicContact NH2-OE2 3.36Å; R376-E456 PolarHBondContact NH2-OE2 3.05Å
377	Y	91.4	Very high	90.6	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-86.4	-20	-177.5	-57.9	-58.2	0	0	0	113.6	P374 R375 G379 R380 L381 A443 M481 F484 E488	P374-Y377 HydrophobicContact CB-CD2 3.99Å; P374-Y377 HydrophobicContact CB-CE2 4.24Å; P374-Y377 HydrophobicContact CG-CD2 4.22Å; P374-Y377 HydrophobicContact CG-CE2 4.33Å; P374-Y377 PolarHBondContact O-N 2.86Å; R375-Y377 VanDerWaalsContact C-N 3.3Å; R375-Y377 PolarHBondContact O-N 3.15Å; Y377-G379 VanDerWaalsContact C-N 3.32Å; Y377-G379 PolarHBondContact O-N 3.02Å; Y377-R380 PolarHBondContact O-N 3.33Å; Y377-L381 PolarHBondContact O-N 2.84Å; Y377-A443 HydrophobicContact CD2-CB 4.42Å; Y377-A443 HydrophobicContact CE2-CB 3.52Å; Y377-M481 HydrophobicContact CD2-CE 4.09Å; Y377-M481 HydrophobicContact CD2-CG 4.49Å; Y377-M481 HydrophobicContact CE2-CE 4.46Å; Y377-F484 HydrophobicContact CD1-CB 3.84Å; Y377-F484 HydrophobicContact CD1-CD2 4.41Å; Y377-F484 HydrophobicContact CE1-CB 4.04Å; Y377-E488 WeakPolarHBondContact CE1-OE1 3.34Å; Y377-E488 WeakPolarHBondContact CE1-OE2 3.43Å
378	V	91.8	Very high	90.7	Very high	10 Å²	10	47.5 Å²	47.5	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-53.4	-47.3	-176.7	171.7	0	0	0	0	111.7	V373 R375 R380 L381 I382 F403 F461	V373-V378 HydrophobicContact CG1-CG2 4.36Å; R375-V378 WeakPolarHBondContact O-CB 3.12Å; R375-V378 PolarHBondContact O-N 2.9Å; V378-R380 PolarHBondContact O-N 3.29Å; V378-L381 PolarHBondContact O-N 2.88Å; V378-I382 HydrophobicContact CG1-CD1 3.73Å; V378-I382 HydrophobicContact CG1-CG1 4.43Å; V378-I382 WeakPolarHBondContact O-CG1 3.42Å; V378-I382 PolarHBondContact O-N 2.88Å; V378-F403 HydrophobicContact CB-CE2 4.36Å; V378-F403 HydrophobicContact CB-CZ 4.43Å; V378-F403 HydrophobicContact CG1-CD2 4.07Å; V378-F403 HydrophobicContact CG1-CE1 3.99Å; V378-F403 HydrophobicContact CG1-CE2 3.51Å; V378-F403 HydrophobicContact CG1-CZ 3.49Å; V378-F403 VanDerWaalsContact CG1-CZ 3.49Å; V378-F403 HydrophobicContact CG2-CE2 3.87Å; V378-F403 HydrophobicContact CG2-CZ 4.2Å; V378-F461 HydrophobicContact CB-CZ 4.47Å; V378-F461 HydrophobicContact CG1-CZ 4.01Å; V378-F461 HydrophobicContact CG2-CE2 4.22Å; V378-F461 HydrophobicContact CG2-CZ 4.41Å
379	G	90.8	Very high	90.9	Very high	55 Å²	55	47.3 Å²	47.3	57%	0.567	23%	0.231	S	C	*	.	H	α-helix	trans	-63.7	-37	179	0	0	0	0	0	113.7	Y377 G383	Y377-G379 VanDerWaalsContact C-N 3.32Å; Y377-G379 PolarHBondContact O-N 3.02Å; G379-G383 PolarHBondContact O-N 2.82Å; G379-G383 VanDerWaalsContact O-N 3.12Å
380	R	91.5	Very high	91.1	Very high	84 Å²	84	51.8 Å²	51.8	32%	0.317	25%	0.253	S	S	.	.	H	α-helix	trans	-70	-41.9	175.7	-69.7	-179.1	165	-157.6	-9.9	111	Y377 V378 G383 F484 E488 E491	Y377-R380 PolarHBondContact O-N 3.33Å; V378-R380 PolarHBondContact O-N 3.29Å; R380-G383 PolarHBondContact O-N 3.18Å; R380-F484 HydrophobicContact CB-CD1 4.31Å; R380-F484 HydrophobicContact CB-CD2 3.76Å; R380-F484 HydrophobicContact CB-CE1 4.15Å; R380-F484 HydrophobicContact CB-CE2 3.57Å; R380-F484 HydrophobicContact CB-CG 4.15Å; R380-F484 HydrophobicContact CB-CZ 3.79Å; R380-F484 PolarHBondContact NH1-O 3.45Å; R380-E488 IonicContact CZ-OE1 2.65Å; R380-E488 VanDerWaalsContact CZ-OE1 3.28Å; R380-E488 IonicContact NE-OE1 3.66Å; R380-E488 IonicContact NH1-OE1 3.94Å; R380-E488 PolarHBondContact NH1-OE1 3.19Å; R380-E491 IonicContact CZ-OE2 3.71Å; R380-E491 IonicContact NH1-OE2 3.07Å; R380-E491 IonicContact NH2-OE1 3.53Å; R380-E491 IonicContact NH2-OE2 3.37Å; R380-E491 PolarHBondContact NH2-OE2 2.81Å
381	L	93.1	Very high	91.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-43	176.6	-75	167.6	0	0	0	113.4	V373 Y377 V378 N388 I389 F461 I477 Q480 M481 F484	V373-L381 HydrophobicContact CG1-CD1 3.68Å; V373-L381 HydrophobicContact CG2-CD1 4.32Å; Y377-L381 PolarHBondContact O-N 2.84Å; V378-L381 PolarHBondContact O-N 2.88Å; L381-N388 WeakPolarHBondContact O-CB 3.46Å; L381-N388 PolarHBondContact O-ND2 2.93Å; L381-I389 PolarHBondContact O-N 3.21Å; L381-F461 HydrophobicContact CB-CZ 4.3Å; L381-F461 HydrophobicContact CD1-CE2 3.88Å; L381-F461 HydrophobicContact CD1-CZ 4.43Å; L381-I477 HydrophobicContact CD1-CG2 3.98Å; L381-I477 HydrophobicContact CD2-CG2 4.13Å; L381-Q480 HydrophobicContact CD2-CB 3.86Å; L381-M481 HydrophobicContact CD1-CG 4.09Å; L381-F484 HydrophobicContact CD2-CE2 3.87Å; L381-F484 HydrophobicContact CG-CE2 3.93Å
382	I	92.5	Very high	91.4	Very high	44 Å²	44	52.6 Å²	52.6	23%	0.226	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-47.1	175.1	-67.4	170.7	0	0	0	110	V378 T386 N388 I389 F461	V378-I382 HydrophobicContact CG1-CD1 3.73Å; V378-I382 HydrophobicContact CG1-CG1 4.43Å; V378-I382 WeakPolarHBondContact O-CG1 3.42Å; V378-I382 PolarHBondContact O-N 2.88Å; I382-T386 HydrophobicContact CG2-CG2 3.85Å; I382-T386 CarbonylContact O-C 3.52Å; I382-T386 VanDerWaalsContact O-C 3.31Å; I382-T386 WeakPolarHBondContact O-CA 3.17Å; I382-N388 PolarHBondContact O-N 2.87Å; I382-I389 HydrophobicContact CG2-CG2 4.31Å; I382-I389 PolarHBondContact O-N 3.43Å; I382-F461 HydrophobicContact CD1-CE1 4.48Å; I382-F461 HydrophobicContact CG1-CE1 4.12Å; I382-F461 HydrophobicContact CG1-CZ 4.21Å
383	G	89.8	Confident	91.6	Very high	19 Å²	19	54.6 Å²	54.6	20%	0.196	27%	0.269	C	S	.	.			trans	77.9	165.8	176.2	0	0	0	0	0	114.8	G379 R380 R385 T386	G379-G383 PolarHBondContact O-N 2.82Å; G379-G383 VanDerWaalsContact O-N 3.12Å; R380-G383 PolarHBondContact O-N 3.18Å; G383-R385 PolarHBondContact O-N 3.1Å; G383-R385 VanDerWaalsContact O-N 3.08Å; G383-T386 PolarHBondContact O-N 2.77Å
384	K	90.3	Very high	91.8	Very high	159 Å²	159	63.7 Å²	63.7	69%	0.691	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-53.9	115	-179.2	-66.9	-179	180	178.1	0	109.9	S387 D620	K384-S387 WeakPolarHBondContact O-CB 3.28Å; K384-S387 PolarHBondContact O-N 2.96Å; K384-S387 PolarHBondContact O-OG 2.88Å; K384-S387 VanDerWaalsContact O-OG 3.11Å; K384-D620 IonicContact NZ-OD1 3.07Å; K384-D620 PolarHBondContact NZ-OD1 3.08Å
385	R	90.3	Very high	92	Very high	244 Å²	244	66 Å²	66	92%	0.921	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	58	41.5	-175.9	-42.4	-176.4	-146.6	125.2	3.5	114.6	G383 S387	G383-R385 PolarHBondContact O-N 3.1Å; G383-R385 VanDerWaalsContact O-N 3.08Å; R385-S387 PolarHBondContact O-N 2.77Å
386	T	91.2	Very high	92.2	Very high	65 Å²	65	62.1 Å²	62.1	40%	0.399	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	55.9	17.3	-178.3	70.1	0	0	0	0	114.8	I382 G383 N388 I389 M390	I382-T386 HydrophobicContact CG2-CG2 3.85Å; I382-T386 CarbonylContact O-C 3.52Å; I382-T386 VanDerWaalsContact O-C 3.31Å; I382-T386 WeakPolarHBondContact O-CA 3.17Å; G383-T386 PolarHBondContact O-N 2.77Å; T386-N388 VanDerWaalsContact C-N 3.29Å; T386-N388 PolarHBondContact O-N 3.04Å; T386-I389 WeakPolarHBondContact O-CG2 3.41Å; T386-M390 WeakPolarHBondContact O-CB 3.48Å; T386-M390 WeakPolarHBondContact O-CG 3.29Å; T386-M390 PolarHBondContact O-N 2.84Å; T386-M390 VanDerWaalsContact O-N 3.08Å
387	S	93	Very high	92.4	Very high	75 Å²	75	59.4 Å²	59.4	52%	0.524	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-32.8	-171.1	65.5	0	0	0	0	113	K384 R385 S391	K384-S387 WeakPolarHBondContact O-CB 3.28Å; K384-S387 PolarHBondContact O-N 2.96Å; K384-S387 PolarHBondContact O-OG 2.88Å; K384-S387 VanDerWaalsContact O-OG 3.11Å; R385-S387 PolarHBondContact O-N 2.77Å; S387-S391 PolarHBondContact O-N 2.97Å; S387-S391 VanDerWaalsContact O-N 3.14Å
388	N	92.6	Very high	92.5	Very high	16 Å²	16	59.6 Å²	59.6	9%	0.086	31%	0.308	C	S	.	.	H	α-helix	trans	-80.6	-46.3	-176.5	-173.1	49.6	0	0	0	111.4	R239 L381 I382 T386 M390 S391 I392 Q480	R239-N388 PolarHBondContact NH1-OD1 3.35Å; L381-N388 WeakPolarHBondContact O-CB 3.46Å; L381-N388 PolarHBondContact O-ND2 2.93Å; I382-N388 PolarHBondContact O-N 2.87Å; T386-N388 VanDerWaalsContact C-N 3.29Å; T386-N388 PolarHBondContact O-N 3.04Å; N388-M390 VanDerWaalsContact C-N 3.28Å; N388-M390 PolarHBondContact O-N 2.94Å; N388-S391 CarbonylContact O-C 3.56Å; N388-S391 WeakPolarHBondContact O-CA 3.37Å; N388-S391 WeakPolarHBondContact O-CB 3.4Å; N388-S391 PolarHBondContact O-N 3.41Å; N388-I392 WeakPolarHBondContact O-CG1 3.49Å; N388-I392 PolarHBondContact O-N 3.24Å; N388-Q480 PolarHBondContact ND2-OE1 2.63Å
389	I	93.4	Very high	92.5	Very high	15 Å²	15	62.9 Å²	62.9	8%	0.077	33%	0.328	C	S	.	.	H	α-helix	trans	-62.6	-35	174.5	-165.7	65.1	0	0	0	112.1	L381 I382 T386 S391 I392 I393 I401	L381-I389 PolarHBondContact O-N 3.21Å; I382-I389 HydrophobicContact CG2-CG2 4.31Å; I382-I389 PolarHBondContact O-N 3.43Å; T386-I389 WeakPolarHBondContact O-CG2 3.41Å; I389-S391 VanDerWaalsContact C-N 3.3Å; I389-S391 PolarHBondContact O-N 2.58Å; I389-I392 HydrophobicContact CD1-CB 4.45Å; I389-I392 HydrophobicContact CD1-CD1 4.12Å; I389-I392 PolarHBondContact O-N 3.21Å; I389-I393 WeakPolarHBondContact O-CG1 3.46Å; I389-I393 PolarHBondContact O-N 3.07Å; I389-I401 HydrophobicContact CD1-CB 4.49Å; I389-I401 HydrophobicContact CD1-CD1 3.6Å; I389-I401 HydrophobicContact CD1-CG2 4.19Å; I389-I401 HydrophobicContact CG1-CB 4.49Å; I389-I401 HydrophobicContact CG1-CD1 4.22Å; I389-I401 HydrophobicContact CG1-CG2 4.44Å
390	M	93.6	Very high	92.5	Very high	97 Å²	97	64.4 Å²	64.4	48%	0.478	32%	0.32	S	S	.	.	H	α-helix	trans	-67.7	-26.5	170.9	-67.9	-71.3	173.5	0	0	113.3	T386 N388 I393 R394	T386-M390 WeakPolarHBondContact O-CB 3.48Å; T386-M390 WeakPolarHBondContact O-CG 3.29Å; T386-M390 PolarHBondContact O-N 2.84Å; T386-M390 VanDerWaalsContact O-N 3.08Å; N388-M390 VanDerWaalsContact C-N 3.28Å; N388-M390 PolarHBondContact O-N 2.94Å; M390-I393 HydrophobicContact SD-CD1 4.28Å; M390-R394 PolarHBondContact O-N 2.85Å
391	S	93.4	Very high	92.6	Very high	19 Å²	19	61.6 Å²	61.6	13%	0.133	31%	0.311	C	S	.	.	H	α-helix	trans	-73	-37.3	169.8	-175.1	0	0	0	0	111.7	R239 S387 N388 I389 K395	R239-S391 PolarHBondContact NH2-OG 2.91Å; S387-S391 PolarHBondContact O-N 2.97Å; S387-S391 VanDerWaalsContact O-N 3.14Å; N388-S391 CarbonylContact O-C 3.56Å; N388-S391 WeakPolarHBondContact O-CA 3.37Å; N388-S391 WeakPolarHBondContact O-CB 3.4Å; N388-S391 PolarHBondContact O-N 3.41Å; I389-S391 VanDerWaalsContact C-N 3.3Å; I389-S391 PolarHBondContact O-N 2.58Å; S391-K395 WeakPolarHBondContact O-CB 3.23Å; S391-K395 WeakPolarHBondContact O-CG 3.46Å; S391-K395 PolarHBondContact O-N 2.84Å; S391-K395 VanDerWaalsContact O-N 3.12Å
392	I	94.3	Very high	92.5	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-50.6	176.5	-64.7	167.9	0	0	0	109.6	N388 I389 R394 K395 S396 I401 A473 L476 I477	N388-I392 WeakPolarHBondContact O-CG1 3.49Å; N388-I392 PolarHBondContact O-N 3.24Å; I389-I392 HydrophobicContact CD1-CB 4.45Å; I389-I392 HydrophobicContact CD1-CD1 4.12Å; I389-I392 PolarHBondContact O-N 3.21Å; I392-R394 VanDerWaalsContact C-N 3.34Å; I392-R394 PolarHBondContact O-N 2.63Å; I392-K395 PolarHBondContact O-N 3.37Å; I392-K395 VanDerWaalsContact O-N 3.15Å; I392-S396 WeakPolarHBondContact O-CB 3.43Å; I392-S396 PolarHBondContact O-N 2.9Å; I392-S396 PolarHBondContact O-OG 3.37Å; I392-I401 HydrophobicContact CG2-CD1 4.33Å; I392-A473 HydrophobicContact CG2-CB 4.29Å; I392-L476 HydrophobicContact CG2-CB 4.19Å; I392-L476 HydrophobicContact CG2-CD1 4.31Å; I392-I477 HydrophobicContact CD1-CG1 3.99Å; I392-I477 HydrophobicContact CG2-CG1 4.36Å
393	I	94.3	Very high	92.3	Very high	41 Å²	41	66.9 Å²	66.9	21%	0.21	33%	0.334	C	S	.	.	H	α-helix	trans	-51.4	-50.7	175.9	-71	166.8	0	0	0	111.2	I389 M390 K395 S396 G397 I401	I389-I393 WeakPolarHBondContact O-CG1 3.46Å; I389-I393 PolarHBondContact O-N 3.07Å; M390-I393 HydrophobicContact SD-CD1 4.28Å; I393-K395 PolarHBondContact O-N 3.14Å; I393-S396 PolarHBondContact O-OG 2.98Å; I393-G397 PolarHBondContact O-N 2.94Å; I393-I401 HydrophobicContact CD1-CB 4.32Å; I393-I401 HydrophobicContact CD1-CD1 4.42Å; I393-I401 HydrophobicContact CD1-CG1 4.3Å; I393-I401 HydrophobicContact CG1-CB 4.45Å; I393-I401 HydrophobicContact CG1-CD1 3.72Å; I393-I401 HydrophobicContact CG1-CG1 3.89Å
394	R	94.4	Very high	92.1	Very high	192 Å²	192	67.7 Å²	67.7	73%	0.725	33%	0.334	S	S	*	.	H	α-helix	trans	-63.9	-37.9	-179.4	-171.1	-176.8	-60.3	98.3	5.6	113.2	M390 I392	M390-R394 PolarHBondContact O-N 2.85Å; I392-R394 VanDerWaalsContact C-N 3.34Å; I392-R394 PolarHBondContact O-N 2.63Å
395	K	92.8	Very high	91.2	Very high	49 Å²	49	63.6 Å²	63.6	21%	0.213	32%	0.319	C	S	.	.	H	α-helix	trans	-75.4	-38.8	179.8	-82.3	-170.9	158	-152.2	0	113.2	L232 D235 T236 S391 I392 I393 L476	L232-K395 HydrophobicContact CD1-CB 4.2Å; L232-K395 PolarHBondContact O-NZ 2.9Å; D235-K395 WeakPolarHBondContact OD2-CE 3.39Å; D235-K395 IonicContact OD2-NZ 3.76Å; T236-K395 PolarHBondContact OG1-NZ 3Å; S391-K395 WeakPolarHBondContact O-CB 3.23Å; S391-K395 WeakPolarHBondContact O-CG 3.46Å; S391-K395 PolarHBondContact O-N 2.84Å; S391-K395 VanDerWaalsContact O-N 3.12Å; I392-K395 PolarHBondContact O-N 3.37Å; I392-K395 VanDerWaalsContact O-N 3.15Å; I393-K395 PolarHBondContact O-N 3.14Å; K395-L476 HydrophobicContact CB-CD1 3.7Å; K395-L476 HydrophobicContact CD-CD1 4.35Å; K395-L476 HydrophobicContact CD-CD2 4.14Å
396	S	94	Very high	89.7	Confident	6 Å²	6	57.5 Å²	57.5	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-81.5	-29.8	-175.9	63.5	0	0	0	0	113.3	I392 I393 V398 S469	I392-S396 WeakPolarHBondContact O-CB 3.43Å; I392-S396 PolarHBondContact O-N 2.9Å; I392-S396 PolarHBondContact O-OG 3.37Å; I393-S396 PolarHBondContact O-OG 2.98Å; S396-V398 VanDerWaalsContact C-N 3.34Å; S396-V398 WeakPolarHBondContact OG-CG2 3.42Å; S396-V398 PolarHBondContact OG-N 2.87Å; S396-S469 WeakPolarHBondContact CB-O 3.33Å; S396-S469 WeakPolarHBondContact O-CA 3.48Å; S396-S469 VanDerWaalsContact O-CB 3.27Å; S396-S469 WeakPolarHBondContact O-CB 3.45Å
397	G	92.5	Very high	88.2	Confident	54 Å²	54	56.6 Å²	56.6	56%	0.557	29%	0.293	S	S	*	.			trans	81.2	11.2	-172.2	0	0	0	0	0	114	I393	I393-G397 PolarHBondContact O-N 2.94Å
398	V	93	Very high	86.2	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.03	31%	0.308	C	S	.	.			trans	-64.3	136.6	177	170.5	0	0	0	0	109.9	S396 H400 I401 A464 S469 I470 A473	S396-V398 VanDerWaalsContact C-N 3.34Å; S396-V398 WeakPolarHBondContact OG-CG2 3.42Å; S396-V398 PolarHBondContact OG-N 2.87Å; V398-H400 WeakPolarHBondContact CG1-O 3.39Å; V398-I401 HydrophobicContact CG1-CG1 3.92Å; V398-A464 VanDerWaalsContact CG1-O 3.24Å; V398-A464 WeakPolarHBondContact CG1-O 3.23Å; V398-S469 WeakPolarHBondContact CG2-O 3.35Å; V398-I470 HydrophobicContact CG2-CG1 4.41Å; V398-A473 HydrophobicContact CG2-CB 3.64Å
399	V	91.8	Very high	83.9	Confident	80 Å²	80	62.8 Å²	62.8	49%	0.485	32%	0.324	S	S	.	.	S	Bend	trans	-68.2	-44.4	-174.4	178.7	0	0	0	0	111.3	Y366 A464	Y366-V399 HydrophobicContact CE1-CG2 4.06Å; V399-A464 WeakPolarHBondContact CA-O 3.32Å; V399-A464 WeakPolarHBondContact CB-O 3.28Å; V399-A464 PolarHBondContact N-O 3.26Å
400	H	91.3	Very high	81.5	Confident	86 Å²	86	67 Å²	67	40%	0.398	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	160.4	165.6	90.5	-68.1	0	0	0	112.3	V398 A464	V398-H400 WeakPolarHBondContact CG1-O 3.39Å; H400-A464 PolarHBondContact N-O 2.94Å; H400-A464 WeakPolarHBondContact ND1-CB 3.48Å; H400-A464 PolarHBondContact O-N 3.43Å
401	I	93.1	Very high	78.9	Confident	26 Å²	26	68 Å²	68	13%	0.133	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.5	167.1	-59.4	178.3	0	0	0	107.7	I389 I392 I393 V398 F461 I462 L463	I389-I401 HydrophobicContact CD1-CB 4.49Å; I389-I401 HydrophobicContact CD1-CD1 3.6Å; I389-I401 HydrophobicContact CD1-CG2 4.19Å; I389-I401 HydrophobicContact CG1-CB 4.49Å; I389-I401 HydrophobicContact CG1-CD1 4.22Å; I389-I401 HydrophobicContact CG1-CG2 4.44Å; I392-I401 HydrophobicContact CG2-CD1 4.33Å; I393-I401 HydrophobicContact CD1-CB 4.32Å; I393-I401 HydrophobicContact CD1-CD1 4.42Å; I393-I401 HydrophobicContact CD1-CG1 4.3Å; I393-I401 HydrophobicContact CG1-CB 4.45Å; I393-I401 HydrophobicContact CG1-CD1 3.72Å; I393-I401 HydrophobicContact CG1-CG1 3.89Å; V398-I401 HydrophobicContact CG1-CG1 3.92Å; I401-F461 HydrophobicContact CG2-CB 4.13Å; I401-F461 HydrophobicContact CG2-CD1 3.78Å; I401-F461 HydrophobicContact CG2-CG 4.38Å; I401-I462 WeakPolarHBondContact CA-O 3.46Å; I401-L463 HydrophobicContact CB-CD2 4.24Å; I401-L463 HydrophobicContact CD1-CD2 3.68Å; I401-L463 HydrophobicContact CG1-CD2 3.61Å; I401-L463 HydrophobicContact CG2-CD2 3.76Å
402	H	90.5	Very high	76.3	Confident	106 Å²	106	72 Å²	72	49%	0.491	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	154.9	167.4	-171	68.1	0	0	0	109.6	F461 I462	H402-F461 CarbonylContact O-C 3.45Å; H402-F461 WeakPolarHBondContact O-CA 2.94Å; H402-I462 HydrophobicContact CB-CB 4.29Å; H402-I462 PolarHBondContact N-O 3.46Å; H402-I462 PolarHBondContact O-N 3.08Å
403	F	89.5	Confident	73.6	Confident	50 Å²	50	79.9 Å²	79.9	22%	0.219	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.6	175.6	175.2	-109.2	0	0	0	109.5	V378 D405 G460 F461	V378-F403 HydrophobicContact CB-CE2 4.36Å; V378-F403 HydrophobicContact CB-CZ 4.43Å; V378-F403 HydrophobicContact CG1-CD2 4.07Å; V378-F403 HydrophobicContact CG1-CE1 3.99Å; V378-F403 HydrophobicContact CG1-CE2 3.51Å; V378-F403 HydrophobicContact CG1-CZ 3.49Å; V378-F403 VanDerWaalsContact CG1-CZ 3.49Å; V378-F403 HydrophobicContact CG2-CE2 3.87Å; V378-F403 HydrophobicContact CG2-CZ 4.2Å; F403-D405 HydrophobicContact CE1-CB 4.18Å; F403-D405 VanDerWaalsContact CE1-CG 3.4Å; F403-D405 WeakPolarHBondContact CE1-OD1 3.18Å; F403-G460 CarbonylContact C-O 3.58Å; F403-G460 WeakPolarHBondContact CA-O 3.33Å; F403-G460 WeakPolarHBondContact CD2-O 3.14Å; F403-F461 HydrophobicContact CB-CD1 4.18Å; F403-F461 HydrophobicContact CB-CE1 4.18Å; F403-F461 AromaticContact CD2-CD1 3.87Å; F403-F461 HydrophobicContact CD2-CD1 3.87Å; F403-F461 AromaticContact CD2-CE1 3.7Å; F403-F461 HydrophobicContact CD2-CE1 3.7Å; F403-F461 HydrophobicContact CD2-CE2 4.5Å; F403-F461 HydrophobicContact CD2-CG 4.36Å; F403-F461 HydrophobicContact CD2-CZ 4.05Å; F403-F461 HydrophobicContact CG-CD1 4.45Å; F403-F461 HydrophobicContact CG-CE1 4.2Å
404	D	84.2	Confident	71.2	Confident	35 Å²	35	83 Å²	83	19%	0.187	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.9	-175.9	-173.5	-1.2	0	0	0	108.8	Y370 H406 G460	Y370-D404 HydrophobicContact CE2-CB 4.42Å; D404-H406 VanDerWaalsContact C-N 3.26Å; D404-H406 PolarHBondContact O-N 2.76Å; D404-H406 PolarHBondContact OD1-N 2.92Å; D404-G460 PolarHBondContact N-O 2.75Å; D404-G460 PolarHBondContact O-N 2.84Å
405	D	71.9	Confident	68.5	Low	73 Å²	73	81.1 Å²	81.1	39%	0.39	46%	0.463	S	S	.	.			trans	-82.6	-0.3	-173.8	-113.1	-44.4	0	0	0	113	R375 F403	R375-D405 IonicContact CZ-OD1 3.63Å; R375-D405 IonicContact NE-OD1 2.75Å; R375-D405 PolarHBondContact NE-OD1 3.31Å; R375-D405 IonicContact NH2-OD1 3.65Å; R375-D405 PolarHBondContact NH2-OD1 2.85Å; F403-D405 HydrophobicContact CE1-CB 4.18Å; F403-D405 VanDerWaalsContact CE1-CG 3.4Å; F403-D405 WeakPolarHBondContact CE1-OD1 3.18Å
406	H	58.4	Low	66.3	Low	117 Å²	117	86.3 Å²	86.3	54%	0.542	49%	0.493	S	S	.	.			trans	-129.7	98.6	-168.6	-63.5	-24.9	0	0	0	112.9	D404 H427	D404-H406 VanDerWaalsContact C-N 3.26Å; D404-H406 PolarHBondContact O-N 2.76Å; D404-H406 PolarHBondContact OD1-N 2.92Å; H406-H427 AromaticContact CD2-NE2 3.94Å
407	I	60	Low	63.7	Low	46 Å²	46	93.2 Å²	93.2	24%	0.236	53%	0.529	C	S	.	.			trans	-101.7	98.7	159.1	-67.5	158.2	0	0	0	107.3	Y370 G409 F440	Y370-I407 HydrophobicContact CE1-CD1 4.09Å; Y370-I407 HydrophobicContact CE1-CG1 4.29Å; Y370-I407 WeakPolarHBondContact OH-CD1 3.34Å; Y370-I407 WeakPolarHBondContact OH-CG1 3.18Å; I407-G409 PolarHBondContact O-N 2.69Å; I407-F440 HydrophobicContact CD1-CE1 4.02Å
408	E	51.2	Low	61.2	Low	180 Å²	180	98.5 Å²	98.5	84%	0.841	55%	0.545	S	S	*	.			trans	-65.3	117.3	155.9	-67.4	-173.4	165.7	0	0	107
409	G	45	Very low	58.7	Low	40 Å²	40	106.6 Å²	106.6	41%	0.412	58%	0.582	S	S	.	*			trans	-62.3	163.8	174.3	0	0	0	0	0	111.1	I407 V411	I407-G409 PolarHBondContact O-N 2.69Å; G409-V411 PolarHBondContact O-N 2.72Å
410	P	42.1	Very low	55.9	Low	103 Å²	103	108.9 Å²	108.9	67%	0.669	60%	0.597	S	S	*	*			trans	-55.5	113.2	179.2	24	-33.6	0	0	0	110	S412	P410-S412 PolarHBondContact O-N 2.75Å
411	V	38.7	Very low	53.2	Low	118 Å²	118	111.4 Å²	111.4	72%	0.715	61%	0.613	S	S	*	*			trans	-59	116.2	-178.4	-177.7	0	0	0	0	107.8	G409 L413	G409-V411 PolarHBondContact O-N 2.72Å; V411-L413 PolarHBondContact O-N 3.35Å
412	S	39.1	Very low	50.2	Low	104 Å²	104	116.3 Å²	116.3	73%	0.727	64%	0.644	S	S	*	*			trans	-67.1	110.1	175.8	-64.9	0	0	0	0	108.2	P410 S414	P410-S412 PolarHBondContact O-N 2.75Å; S412-S414 PolarHBondContact O-N 3.02Å
413	L	38.2	Very low	47.6	Very low	166 Å²	166	117.6 Å²	117.6	87%	0.869	65%	0.653	S	S	*	*			trans	-70	79	169.8	-67.4	173.4	0	0	0	108.5	V411	V411-L413 PolarHBondContact O-N 3.35Å
414	S	42.5	Very low	44.7	Very low	106 Å²	106	124 Å²	124	74%	0.741	68%	0.681	S	S	*	*			trans	-78.5	113.1	160.5	53.2	0	0	0	0	107.9	S412 D416	S412-S414 PolarHBondContact O-N 3.02Å; S414-D416 PolarHBondContact O-N 3.35Å
415	D	38.9	Very low	42.5	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	71%	0.708	S	S	*	*			trans	-56.8	118.4	171.8	-65.8	-62.7	0	0	0	110.3
416	D	45.7	Very low	40.5	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	73%	0.725	S	S	*	*			trans	-153.2	137.1	149.1	-128.5	-28.3	0	0	0	111.8	S414 N418	S414-D416 PolarHBondContact O-N 3.35Å; D416-N418 PolarHBondContact O-N 2.85Å
417	N	40.5	Very low	39.5	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	73%	0.729	S	S	*	*			trans	-93.2	103.1	-167.9	-75.6	-88.6	0	0	0	111.6
418	N	39.4	Very low	38.1	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	76%	0.762	S	S	*	*			trans	-154.1	150.9	140.1	-125.5	-42.3	0	0	0	115.7	D416	D416-N418 PolarHBondContact O-N 2.85Å
419	Q	39.8	Very low	37.2	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	76%	0.761	S	S	*	*			trans	-103.8	105.5	-168.6	176.5	-178.9	61.8	0	0	111.1
420	T	33.7	Very low	37	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	76%	0.763	S	S	*	*			trans	-169	154.4	148.9	8.7	0	0	0	0	112.7
421	D	34.2	Very low	36.8	Very low	138 Å²	138	138.4 Å²	138.4	74%	0.738	77%	0.768	S	S	*	*			trans	54.1	83.3	152.3	-62.2	-5	0	0	0	121.1
422	V	30.3	Very low	37.1	Very low	130 Å²	130	136 Å²	136	79%	0.788	75%	0.75	S	S	*	*				45.9	96.9	115.4	-175.5	0	0	0	0	117.1
423	I	37.3	Very low	37.4	Very low	132 Å²	132	133.1 Å²	133.1	68%	0.677	73%	0.733	S	S	*	*			trans	-128.8	111.3	137.5	-67.3	-172.2	0	0	0	109.6	Y425	I423-Y425 HydrophobicContact CD1-CE2 4.4Å; I423-Y425 HydrophobicContact CG2-CD1 4.41Å; I423-Y425 HydrophobicContact CG2-CD2 3.24Å; I423-Y425 HydrophobicContact CG2-CE1 4.47Å; I423-Y425 HydrophobicContact CG2-CE2 3.35Å; I423-Y425 HydrophobicContact CG2-CG 3.8Å
424	K	28.9	Very low	38	Very low	186 Å²	186	128.2 Å²	128.2	81%	0.809	71%	0.712	S	S	*	*			trans	-99.5	107.6	163	-83.2	-176	172.4	-178.2	0	108.7
425	Y	37.5	Very low	38.8	Very low	192 Å²	192	126.6 Å²	126.6	75%	0.753	70%	0.698	S	S	*	*			trans	-121.2	38.6	167.3	-66.6	-37.3	0	0	0	114	I423 H427	I423-Y425 HydrophobicContact CD1-CE2 4.4Å; I423-Y425 HydrophobicContact CG2-CD1 4.41Å; I423-Y425 HydrophobicContact CG2-CD2 3.24Å; I423-Y425 HydrophobicContact CG2-CE1 4.47Å; I423-Y425 HydrophobicContact CG2-CE2 3.35Å; I423-Y425 HydrophobicContact CG2-CG 3.8Å; Y425-H427 PolarHBondContact O-N 2.94Å
426	S	30.3	Very low	40.5	Very low	106 Å²	106	120.1 Å²	120.1	74%	0.741	66%	0.663	S	S	*	*			trans	-56.8	121.8	152.1	-43.5	0	0	0	0	108.8	P428	S426-P428 WeakPolarHBondContact O-CD 3.24Å
427	H	35.5	Very low	42.2	Very low	138 Å²	138	118.1 Å²	118.1	64%	0.639	64%	0.644	S	S	*	*			trans	-58.6	124.4	173.3	-69.2	-44.9	0	0	0	109.9	H406 Y425 G429	H406-H427 AromaticContact CD2-NE2 3.94Å; Y425-H427 PolarHBondContact O-N 2.94Å; H427-G429 VanDerWaalsContact C-N 3.34Å; H427-G429 PolarHBondContact O-N 2.84Å
428	P	30.7	Very low	44.3	Very low	141 Å²	141	116.1 Å²	116.1	92%	0.916	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	81.7	-174.1	30.8	-35.4	0	0	0	111	S426	S426-P428 WeakPolarHBondContact O-CD 3.24Å
429	G	32.8	Very low	46.5	Very low	80 Å²	80	108.7 Å²	108.7	83%	0.825	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-179.6	-30.1	176.3	0	0	0	0	0	118.1	H427	H427-G429 VanDerWaalsContact C-N 3.34Å; H427-G429 PolarHBondContact O-N 2.84Å
430	R	40.3	Very low	48.8	Very low	122 Å²	122	100.5 Å²	100.5	46%	0.46	55%	0.547	S	S	.	.			trans	-147.5	120.3	178.4	-161.9	-176.3	-166.7	-147.8	3.1	110.9	H294 E368 L432	H294-R430 PolarHBondContact NE2-NH2 3.47Å; E368-R430 VanDerWaalsContact CD-NH2 3.3Å; E368-R430 IonicContact OE1-CZ 2.68Å; E368-R430 IonicContact OE1-NH2 3.45Å; E368-R430 PolarHBondContact OE1-NH2 2.98Å; E368-R430 IonicContact OE2-CZ 3.66Å; E368-R430 VanDerWaalsContact OE2-CZ 3.32Å; E368-R430 IonicContact OE2-NH1 2.7Å; E368-R430 PolarHBondContact OE2-NH1 2.96Å; E368-R430 IonicContact OE2-NH2 3.99Å; E368-R430 PolarHBondContact OE2-NH2 2.79Å; R430-L432 PolarHBondContact O-N 2.72Å
431	P	37.9	Very low	51.3	Low	117 Å²	117	94.4 Å²	94.4	76%	0.76	51%	0.51	S	S	*	.			trans	-66.4	127.3	160.5	29.1	-31.5	0	0	0	108.1	A433	P431-A433 PolarHBondContact O-N 3.07Å; P431-A433 VanDerWaalsContact O-N 3.09Å
432	L	45.7	Very low	53.7	Low	67 Å²	67	91 Å²	91	35%	0.351	49%	0.488	S	S	.	.			trans	-80.3	92.6	174.5	-156.4	81.6	0	0	0	107.9	R430 S434 M436 I462	R430-L432 PolarHBondContact O-N 2.72Å; L432-S434 PolarHBondContact O-N 3.12Å; L432-M436 HydrophobicContact CD1-CE 4.25Å; L432-I462 HydrophobicContact CD1-CD1 4.11Å
433	A	44.6	Very low	56.2	Low	44 Å²	44	85.3 Å²	85.3	36%	0.364	46%	0.455	S	S	.	.			trans	-49.8	128	-173.9	0	0	0	0	0	111.8	P431 T435 M436	P431-A433 PolarHBondContact O-N 3.07Å; P431-A433 VanDerWaalsContact O-N 3.09Å; A433-T435 PolarHBondContact O-N 2.94Å; A433-M436 WeakPolarHBondContact O-CB 3.46Å; A433-M436 PolarHBondContact O-N 3.43Å
434	S	51.3	Low	57.9	Low	62 Å²	62	80.7 Å²	80.7	43%	0.434	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.9	-176.8	64.2	0	0	0	0	112.7	D340 L432 M436	D340-S434 WeakPolarHBondContact OD2-CB 3.41Å; D340-S434 PolarHBondContact OD2-OG 3.19Å; L432-S434 PolarHBondContact O-N 3.12Å; S434-M436 PolarHBondContact O-N 2.82Å
435	T	60.5	Low	60	Low	73 Å²	73	73.4 Å²	73.4	45%	0.448	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-11	176.2	54.7	0	0	0	0	114.4	Y341 A433 R437	Y341-T435 HydrophobicContact CD1-CG2 3.95Å; Y341-T435 HydrophobicContact CE1-CG2 4Å; A433-T435 PolarHBondContact O-N 2.94Å; T435-R437 PolarHBondContact O-N 2.92Å
436	M	73.6	Confident	61.2	Low	17 Å²	17	68.7 Å²	68.7	8%	0.084	41%	0.413	C	S	.	.	S	Bend	trans	-69.9	112.4	174.8	-169.8	-176.4	-56.8	0	0	111.1	E368 Y370 L432 A433 S434 R438 I462	E368-M436 HydrophobicContact CB-CE 3.98Å; E368-M436 HydrophobicContact CB-CG 4.09Å; E368-M436 HydrophobicContact CB-SD 4.27Å; E368-M436 WeakPolarHBondContact OE2-CE 3.4Å; Y370-M436 HydrophobicContact CD2-SD 4.32Å; L432-M436 HydrophobicContact CD1-CE 4.25Å; A433-M436 WeakPolarHBondContact O-CB 3.46Å; A433-M436 PolarHBondContact O-N 3.43Å; S434-M436 PolarHBondContact O-N 2.82Å; M436-R438 WeakPolarHBondContact O-CG 3.18Å; M436-R438 PolarHBondContact O-N 3.38Å; M436-I462 HydrophobicContact CE-CG2 4.15Å; M436-I462 HydrophobicContact SD-CG1 4.44Å; M436-I462 HydrophobicContact SD-CG2 4.04Å
437	R	81.9	Confident	62.8	Low	115 Å²	115	71 Å²	71	43%	0.434	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	130.3	175	-179.2	178.7	171	-147.4	1.7	109.9	L369 Y370 T435 E471	L369-R437 HydrophobicContact CD1-CB 3.92Å; L369-R437 HydrophobicContact CD1-CG 3.64Å; L369-R437 WeakPolarHBondContact CD1-O 3.37Å; Y370-R437 PolarHBondContact N-O 2.91Å; T435-R437 PolarHBondContact O-N 2.92Å; R437-E471 IonicContact CZ-OE1 3.32Å; R437-E471 IonicContact NH1-OE1 2.91Å; R437-E471 PolarHBondContact NH1-OE1 2.87Å; R437-E471 IonicContact NH2-OE1 3.93Å; R437-E471 PolarHBondContact NH2-OE1 2.85Å
438	R	84.3	Confident	64.4	Low	110 Å²	110	66.6 Å²	66.6	42%	0.415	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.5	175.5	-50.6	-161.3	-176.4	-161.9	4.5	111	Y370 M436 F440	Y370-R438 WeakPolarHBondContact O-CA 3.08Å; M436-R438 WeakPolarHBondContact O-CG 3.18Å; M436-R438 PolarHBondContact O-N 3.38Å; R438-F440 HydrophobicContact CB-CE2 4.08Å
439	V	86.2	Confident	66.5	Low	8 Å²	8	61.3 Å²	61.3	5%	0.048	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.9	176.7	166.4	0	0	0	0	107.3	L369 Y370 L371 G372 L441 T448 R474	L369-V439 HydrophobicContact CD1-CB 4.29Å; L369-V439 HydrophobicContact CD1-CG2 3.84Å; Y370-V439 PolarHBondContact O-N 3.09Å; L371-V439 CarbonylContact C-O 3.59Å; L371-V439 WeakPolarHBondContact CA-O 3.37Å; L371-V439 HydrophobicContact CD1-CB 4.02Å; L371-V439 HydrophobicContact CD1-CG1 3.64Å; G372-V439 PolarHBondContact N-O 3.26Å; V439-L441 HydrophobicContact CG1-CD2 3.91Å; V439-T448 HydrophobicContact CG1-CG2 4.48Å; V439-R474 VanDerWaalsContact CG1-NH1 3.34Å
440	F	87.4	Confident	68.4	Low	4 Å²	4	61.7 Å²	61.7	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.2	173.8	-63.4	-96.9	0	0	0	109.3	Y370 G372 I407 R438 T448 S449 S450 P452 Y458	Y370-F440 HydrophobicContact CE1-CE1 4.48Å; Y370-F440 HydrophobicContact CE1-CZ 4.46Å; G372-F440 WeakPolarHBondContact O-CA 3.08Å; I407-F440 HydrophobicContact CD1-CE1 4.02Å; R438-F440 HydrophobicContact CB-CE2 4.08Å; F440-T448 WeakPolarHBondContact O-CA 3.42Å; F440-S449 PolarHBondContact N-O 2.97Å; F440-S449 PolarHBondContact O-N 3.22Å; F440-S449 VanDerWaalsContact O-N 3.11Å; F440-S450 WeakPolarHBondContact CE2-O 3.38Å; F440-P452 HydrophobicContact CD1-CB 3.79Å; F440-P452 HydrophobicContact CE1-CB 3.8Å; F440-P452 HydrophobicContact CE1-CG 4.21Å; F440-P452 HydrophobicContact CG-CB 4.41Å; F440-P452 HydrophobicContact CZ-CB 4.42Å; F440-P452 HydrophobicContact CZ-CG 4.38Å; F440-Y458 HydrophobicContact CB-CE1 4.15Å; F440-Y458 AromaticContact CD1-CD1 3.81Å; F440-Y458 HydrophobicContact CD1-CD1 3.81Å; F440-Y458 HydrophobicContact CD1-CE1 4.05Å; F440-Y458 HydrophobicContact CD1-CG 4.2Å
441	L	86.7	Confident	69.7	Low	0 Å²	0	61.6 Å²	61.6	0%	0	36%	0.356	C	S	.	.			trans	-97.6	148.3	179.3	-58	-171.7	0	0	0	110.7	L371 G372 V373 V439 T448 Y458 I477 N478 M481	L371-L441 HydrophobicContact CD1-CD1 3.9Å; L371-L441 HydrophobicContact CD1-CD2 3.88Å; L371-L441 HydrophobicContact CD1-CG 3.73Å; L371-L441 HydrophobicContact CD2-CD1 4.05Å; L371-L441 HydrophobicContact CG-CD1 4.09Å; L371-L441 HydrophobicContact CG-CG 4.25Å; G372-L441 PolarHBondContact O-N 2.81Å; V373-L441 HydrophobicContact CG2-CD1 4.34Å; V439-L441 HydrophobicContact CG1-CD2 3.91Å; L441-T448 HydrophobicContact CD2-CG2 3.4Å; L441-Y458 VanDerWaalsContact O-CE1 3.31Å; L441-Y458 WeakPolarHBondContact O-CE1 3.43Å; L441-Y458 PolarHBondContact O-OH 2.9Å; L441-I477 HydrophobicContact CD1-CG2 4.01Å; L441-N478 HydrophobicContact CD1-CB 4.17Å; L441-N478 WeakPolarHBondContact CD2-OD1 3.46Å; L441-M481 HydrophobicContact CB-CE 3.55Å; L441-M481 HydrophobicContact CB-SD 3.77Å; L441-M481 HydrophobicContact CD1-CE 4.47Å; L441-M481 HydrophobicContact CD1-SD 3.59Å; L441-M481 VanDerWaalsContact CD1-SD 3.59Å; L441-M481 HydrophobicContact CG-SD 4.3Å
442	K	85.1	Confident	71.1	Confident	67 Å²	67	57.5 Å²	57.5	29%	0.291	33%	0.33	S	S	.	.			trans	-130.6	115.7	171	-176.8	167.8	-171.8	162	0	108.4	S445	K442-S445 WeakPolarHBondContact O-CB 3.43Å; K442-S445 PolarHBondContact O-N 2.94Å; K442-S445 VanDerWaalsContact O-N 3.15Å
443	A	82.1	Confident	72.1	Confident	10 Å²	10	57.2 Å²	57.2	8%	0.083	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	142	-177.2	0	0	0	0	0	111.3	Y377 S445 M481 D482 Y485	Y377-A443 HydrophobicContact CD2-CB 4.42Å; Y377-A443 HydrophobicContact CE2-CB 3.52Å; A443-S445 PolarHBondContact O-N 2.6Å; A443-M481 HydrophobicContact CB-CB 4.28Å; A443-M481 HydrophobicContact CB-CE 4.13Å; A443-D482 WeakPolarHBondContact CA-OD1 3.21Å; A443-Y485 HydrophobicContact CB-CG 4.34Å
444	G	73.2	Confident	73.2	Confident	36 Å²	36	61.6 Å²	61.6	37%	0.371	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-3.1	-173	0	0	0	0	0	114.4	D482	G444-D482 PolarHBondContact N-OD1 3.13Å
445	S	72.1	Confident	74.2	Confident	32 Å²	32	64.8 Å²	64.8	22%	0.224	36%	0.361	C	S	.	.			trans	-116.5	128.9	-176.3	157.3	0	0	0	0	111.4	K442 A443 Q447	K442-S445 WeakPolarHBondContact O-CB 3.43Å; K442-S445 PolarHBondContact O-N 2.94Å; K442-S445 VanDerWaalsContact O-N 3.15Å; A443-S445 PolarHBondContact O-N 2.6Å; S445-Q447 PolarHBondContact O-N 2.83Å; S445-Q447 PolarHBondContact OG-N 2.78Å; S445-Q447 VanDerWaalsContact OG-N 3.11Å; S445-Q447 PolarHBondContact OG-O 2.85Å
446	A	63.9	Low	74.9	Confident	94 Å²	94	63.8 Å²	63.8	78%	0.777	35%	0.351	S	S	*	.	S	Bend	trans	-72.3	-8.7	173.9	0	0	0	0	0	113.7
447	Q	62.7	Low	75.3	Confident	154 Å²	154	68.8 Å²	68.8	72%	0.72	38%	0.375	S	S	*	.			trans	-95.8	128.7	-177.5	-164.2	173.6	32.7	0	0	111.1	S445	S445-Q447 PolarHBondContact O-N 2.83Å; S445-Q447 PolarHBondContact OG-N 2.78Å; S445-Q447 VanDerWaalsContact OG-N 3.11Å; S445-Q447 PolarHBondContact OG-O 2.85Å
448	T	69.8	Low	75.5	Confident	45 Å²	45	63.8 Å²	63.8	28%	0.276	36%	0.356	S	S	.	.			trans	-110.3	125.9	172.7	63.6	0	0	0	0	110.3	V439 F440 L441 R474	V439-T448 HydrophobicContact CG1-CG2 4.48Å; F440-T448 WeakPolarHBondContact O-CA 3.42Å; L441-T448 HydrophobicContact CD2-CG2 3.4Å; T448-R474 PolarHBondContact OG1-NH1 2.95Å; T448-R474 PolarHBondContact OG1-NH2 2.96Å
449	S	73.6	Confident	75.5	Confident	30 Å²	30	58.5 Å²	58.5	21%	0.21	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-93.3	162.4	-177.4	51.9	0	0	0	0	112.7	F440 Q451	F440-S449 PolarHBondContact N-O 2.97Å; F440-S449 PolarHBondContact O-N 3.22Å; F440-S449 VanDerWaalsContact O-N 3.11Å; S449-Q451 VanDerWaalsContact CB-O 3.31Å; S449-Q451 WeakPolarHBondContact CB-O 3.33Å; S449-Q451 PolarHBondContact OG-O 3.37Å
450	S	72.6	Confident	75.7	Confident	88 Å²	88	58.1 Å²	58.1	62%	0.615	33%	0.334	S	S	*	.	S	Bend	trans	-88.6	-8.4	169.7	52.3	0	0	0	0	113.5	F440	F440-S450 WeakPolarHBondContact CE2-O 3.38Å
451	Q	67.7	Low	75.9	Confident	120 Å²	120	58.1 Å²	58.1	56%	0.561	33%	0.334	S	S	*	.	S	Bend	trans	-126.5	150.5	178.8	-68.3	-68.6	-4.4	0	0	109.9	S449	S449-Q451 VanDerWaalsContact CB-O 3.31Å; S449-Q451 WeakPolarHBondContact CB-O 3.33Å; S449-Q451 PolarHBondContact OG-O 3.37Å
452	P	67.5	Low	76.2	Confident	32 Å²	32	58.4 Å²	58.4	21%	0.208	34%	0.335	C	S	.	.			trans	-65.2	150.3	172.2	29.5	-33.7	0	0	0	110.6	F440 Y458	F440-P452 HydrophobicContact CD1-CB 3.79Å; F440-P452 HydrophobicContact CE1-CB 3.8Å; F440-P452 HydrophobicContact CE1-CG 4.21Å; F440-P452 HydrophobicContact CG-CB 4.41Å; F440-P452 HydrophobicContact CZ-CB 4.42Å; F440-P452 HydrophobicContact CZ-CG 4.38Å; P452-Y458 HydrophobicContact CB-CD2 3.81Å; P452-Y458 HydrophobicContact CB-CE2 4.09Å; P452-Y458 HydrophobicContact CB-CG 4.34Å
453	H	67.2	Low	76.5	Confident	60 Å²	60	55.2 Å²	55.2	28%	0.278	32%	0.321	S	S	.	.			trans	-75.4	140.8	168.1	-69.6	-70.7	0	0	0	110.2	D455 Y458	H453-D455 PolarHBondContact O-N 2.92Å; H453-D455 VanDerWaalsContact O-N 3.16Å; H453-Y458 HydrophobicContact CB-CE2 4.39Å
454	T	66.7	Low	77	Confident	137 Å²	137	54.9 Å²	54.9	84%	0.84	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.6	-176.6	39.5	0	0	0	0	114.8
455	D	72.8	Confident	77.9	Confident	129 Å²	129	53.2 Å²	53.2	69%	0.69	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-4.8	-162.9	-34.9	-37.2	0	0	0	112.7	H453	H453-D455 PolarHBondContact O-N 2.92Å; H453-D455 VanDerWaalsContact O-N 3.16Å
456	E	75.4	Confident	78.9	Confident	51 Å²	51	52.9 Å²	52.9	24%	0.238	30%	0.298	C	S	.	.	S	Bend	trans	-134.5	139.2	-176	-57.8	-166.2	171.3	0	0	111.6	P374 R376 Y458	P374-E456 WeakPolarHBondContact CB-OE2 3.47Å; P374-E456 WeakPolarHBondContact CG-OE2 3.24Å; R376-E456 IonicContact CZ-OE1 3.26Å; R376-E456 IonicContact CZ-OE2 2.81Å; R376-E456 IonicContact NH1-OE1 3.57Å; R376-E456 PolarHBondContact NH1-OE1 3.44Å; R376-E456 IonicContact NH1-OE2 3.75Å; R376-E456 PolarHBondContact NH1-OE2 2.63Å; R376-E456 IonicContact NH2-OE1 3.27Å; R376-E456 PolarHBondContact NH2-OE1 2.82Å; R376-E456 IonicContact NH2-OE2 3.36Å; R376-E456 PolarHBondContact NH2-OE2 3.05Å; E456-Y458 HydrophobicContact CB-CE2 4.12Å; E456-Y458 VanDerWaalsContact O-CD2 3.27Å; E456-Y458 WeakPolarHBondContact O-CD2 3.29Å
457	E	82.3	Confident	80.1	Confident	122 Å²	122	53.3 Å²	53.3	57%	0.57	28%	0.28	S	S	*	.			trans	-74.8	136.1	169.7	-171.1	-173.8	-158.8	0	0	110.3	P374 R375	P374-E457 CarbonylContact C-O 3.53Å; P374-E457 WeakPolarHBondContact CA-O 3.48Å; R375-E457 HydrophobicContact CB-CB 4.41Å; R375-E457 HydrophobicContact CB-CG 4.27Å; R375-E457 WeakPolarHBondContact CD-OE2 3.35Å; R375-E457 IonicContact CZ-OE1 3.5Å; R375-E457 PolarHBondContact N-O 2.81Å; R375-E457 IonicContact NE-OE1 3.39Å; R375-E457 IonicContact NH1-OE1 2.75Å; R375-E457 PolarHBondContact NH1-OE1 2.86Å; R375-E457 IonicContact NH1-OE2 3.96Å
458	Y	85.5	Confident	81.4	Confident	10 Å²	10	49.6 Å²	49.6	4%	0.039	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	153.7	-178.8	-81.7	-96.7	0	0	0	112.2	V373 P374 F440 L441 P452 H453 E456	V373-Y458 WeakPolarHBondContact O-CA 3.49Å; P374-Y458 HydrophobicContact CG-CD1 4.34Å; P374-Y458 HydrophobicContact CG-CE1 3.76Å; F440-Y458 HydrophobicContact CB-CE1 4.15Å; F440-Y458 AromaticContact CD1-CD1 3.81Å; F440-Y458 HydrophobicContact CD1-CD1 3.81Å; F440-Y458 HydrophobicContact CD1-CE1 4.05Å; F440-Y458 HydrophobicContact CD1-CG 4.2Å; L441-Y458 VanDerWaalsContact O-CE1 3.31Å; L441-Y458 WeakPolarHBondContact O-CE1 3.43Å; L441-Y458 PolarHBondContact O-OH 2.9Å; P452-Y458 HydrophobicContact CB-CD2 3.81Å; P452-Y458 HydrophobicContact CB-CE2 4.09Å; P452-Y458 HydrophobicContact CB-CG 4.34Å; H453-Y458 HydrophobicContact CB-CE2 4.39Å; E456-Y458 HydrophobicContact CB-CE2 4.12Å; E456-Y458 VanDerWaalsContact O-CD2 3.27Å; E456-Y458 WeakPolarHBondContact O-CD2 3.29Å
459	G	85.9	Confident	82.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.3	161.5	0	0	0	0	0	110.5	V373	V373-G459 PolarHBondContact N-O 2.91Å; V373-G459 PolarHBondContact O-N 3.25Å; V373-G459 VanDerWaalsContact O-O 3.13Å
460	G	88.7	Confident	83.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.1	-172.3	0	0	0	0	0	114.1	Y370 F403 D404	Y370-G460 WeakPolarHBondContact OH-CA 3.01Å; F403-G460 CarbonylContact C-O 3.58Å; F403-G460 WeakPolarHBondContact CA-O 3.33Å; F403-G460 WeakPolarHBondContact CD2-O 3.14Å; D404-G460 PolarHBondContact N-O 2.75Å; D404-G460 PolarHBondContact O-N 2.84Å
461	F	92	Very high	84.3	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.7	162.2	-67.8	-75.7	0	0	0	109.8	L371 V373 V378 L381 I382 I401 H402 F403 L463	L371-F461 HydrophobicContact CB-CB 4.41Å; L371-F461 PolarHBondContact N-O 2.85Å; L371-F461 PolarHBondContact O-N 3.09Å; V373-F461 HydrophobicContact CB-CD2 4.21Å; V373-F461 HydrophobicContact CB-CE2 4.13Å; V373-F461 HydrophobicContact CG1-CE2 4.48Å; V373-F461 HydrophobicContact CG2-CD2 3.82Å; V373-F461 HydrophobicContact CG2-CE2 4.06Å; V378-F461 HydrophobicContact CB-CZ 4.47Å; V378-F461 HydrophobicContact CG1-CZ 4.01Å; V378-F461 HydrophobicContact CG2-CE2 4.22Å; V378-F461 HydrophobicContact CG2-CZ 4.41Å; L381-F461 HydrophobicContact CB-CZ 4.3Å; L381-F461 HydrophobicContact CD1-CE2 3.88Å; L381-F461 HydrophobicContact CD1-CZ 4.43Å; I382-F461 HydrophobicContact CD1-CE1 4.48Å; I382-F461 HydrophobicContact CG1-CE1 4.12Å; I382-F461 HydrophobicContact CG1-CZ 4.21Å; I401-F461 HydrophobicContact CG2-CB 4.13Å; I401-F461 HydrophobicContact CG2-CD1 3.78Å; I401-F461 HydrophobicContact CG2-CG 4.38Å; H402-F461 CarbonylContact O-C 3.45Å; H402-F461 WeakPolarHBondContact O-CA 2.94Å; F403-F461 HydrophobicContact CB-CD1 4.18Å; F403-F461 HydrophobicContact CB-CE1 4.18Å; F403-F461 AromaticContact CD2-CD1 3.87Å; F403-F461 HydrophobicContact CD2-CD1 3.87Å; F403-F461 AromaticContact CD2-CE1 3.7Å; F403-F461 HydrophobicContact CD2-CE1 3.7Å; F403-F461 HydrophobicContact CD2-CE2 4.5Å; F403-F461 HydrophobicContact CD2-CG 4.36Å; F403-F461 HydrophobicContact CD2-CZ 4.05Å; F403-F461 HydrophobicContact CG-CD1 4.45Å; F403-F461 HydrophobicContact CG-CE1 4.2Å; F461-L463 HydrophobicContact CB-CD2 4.04Å; F461-L463 PolarHBondContact O-N 3.23Å
462	I	92.4	Very high	85.5	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	110.9	171.7	-56.3	177.2	0	0	0	107.6	E368 L369 Y370 I401 H402 L432 M436	E368-I462 HydrophobicContact CG-CG2 4.21Å; L369-I462 WeakPolarHBondContact O-CA 3.15Å; Y370-I462 HydrophobicContact CD2-CD1 4.35Å; Y370-I462 HydrophobicContact CD2-CG1 3.84Å; Y370-I462 HydrophobicContact CE2-CG1 4.24Å; I401-I462 WeakPolarHBondContact CA-O 3.46Å; H402-I462 HydrophobicContact CB-CB 4.29Å; H402-I462 PolarHBondContact N-O 3.46Å; H402-I462 PolarHBondContact O-N 3.08Å; L432-I462 HydrophobicContact CD1-CD1 4.11Å; M436-I462 HydrophobicContact CE-CG2 4.15Å; M436-I462 HydrophobicContact SD-CG1 4.44Å; M436-I462 HydrophobicContact SD-CG2 4.04Å
463	L	92.9	Very high	86.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.5	178.5	-44.8	-177	0	0	0	108.9	E368 L369 L371 I401 F461 I470 A473 I477	E368-L463 WeakPolarHBondContact CA-O 3.16Å; L369-L463 HydrophobicContact CD2-CD1 4.28Å; L369-L463 PolarHBondContact N-O 3.04Å; L369-L463 PolarHBondContact O-N 2.86Å; L371-L463 HydrophobicContact CB-CD1 4.35Å; L371-L463 HydrophobicContact CB-CG 4.45Å; L371-L463 HydrophobicContact CD2-CD1 4.07Å; I401-L463 HydrophobicContact CB-CD2 4.24Å; I401-L463 HydrophobicContact CD1-CD2 3.68Å; I401-L463 HydrophobicContact CG1-CD2 3.61Å; I401-L463 HydrophobicContact CG2-CD2 3.76Å; F461-L463 HydrophobicContact CB-CD2 4.04Å; F461-L463 PolarHBondContact O-N 3.23Å; L463-I470 HydrophobicContact CB-CG1 4.17Å; L463-I470 HydrophobicContact CB-CG2 4.36Å; L463-I470 HydrophobicContact CD1-CG2 4.34Å; L463-A473 HydrophobicContact CD1-CB 3.96Å; L463-I477 HydrophobicContact CD2-CD1 4.22Å
464	A	92.5	Very high	88	Confident	3 Å²	3	41.6 Å²	41.6	3%	0.025	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.4	178.3	0	0	0	0	0	112.1	E368 V398 V399 H400	E368-A464 HydrophobicContact CG-CB 3.65Å; V398-A464 VanDerWaalsContact CG1-O 3.24Å; V398-A464 WeakPolarHBondContact CG1-O 3.23Å; V399-A464 WeakPolarHBondContact CA-O 3.32Å; V399-A464 WeakPolarHBondContact CB-O 3.28Å; V399-A464 PolarHBondContact N-O 3.26Å; H400-A464 PolarHBondContact N-O 2.94Å; H400-A464 WeakPolarHBondContact ND1-CB 3.48Å; H400-A464 PolarHBondContact O-N 3.43Å
465	G	92	Very high	89.2	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.9	-164.2	-175.6	0	0	0	0	0	111.4	Y366 S367 I470	Y366-G465 WeakPolarHBondContact CA-O 3.42Å; Y366-G465 VanDerWaalsContact CD1-C 3.5Å; S367-G465 PolarHBondContact N-O 3.22Å; S367-G465 PolarHBondContact O-N 2.88Å; G465-I470 WeakPolarHBondContact O-CD1 3.49Å
466	T	92.8	Very high	90.3	Very high	25 Å²	25	30.7 Å²	30.7	15%	0.153	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	151	168.8	63.8	0	0	0	0	110.2	A362 E365 Y366 D468 S469 I470	A362-T466 WeakPolarHBondContact O-CB 3.4Å; A362-T466 WeakPolarHBondContact O-CG2 3.47Å; E365-T466 CarbonylContact O-C 3.57Å; E365-T466 WeakPolarHBondContact O-CA 3.49Å; Y366-T466 HydrophobicContact CD1-CG2 4.3Å; Y366-T466 HydrophobicContact CD2-CG2 4.11Å; Y366-T466 HydrophobicContact CE1-CG2 3.92Å; Y366-T466 HydrophobicContact CE2-CG2 3.71Å; Y366-T466 HydrophobicContact CG-CG2 4.4Å; T466-D468 VanDerWaalsContact C-N 3.27Å; T466-D468 PolarHBondContact O-N 2.9Å; T466-S469 PolarHBondContact N-OG 3.33Å; T466-S469 VanDerWaalsContact N-OG 3.14Å; T466-S469 WeakPolarHBondContact O-CA 3.36Å; T466-S469 WeakPolarHBondContact O-CB 3.4Å; T466-S469 PolarHBondContact O-N 3.08Å; T466-S469 PolarHBondContact O-OG 3.31Å; T466-S469 PolarHBondContact OG1-N 2.91Å; T466-S469 PolarHBondContact OG1-OG 3.28Å; T466-I470 PolarHBondContact O-N 2.84Å
467	R	89.1	Confident	91.1	Very high	104 Å²	104	28.2 Å²	28.2	39%	0.392	13%	0.13	S	C	.	.	H	α-helix	trans	-51.4	-44.9	179.3	-176.1	173.7	177	171.8	-7.5	112.8	R361 E365 S469 I470 E471	R361-R467 VanDerWaalsContact NH2-NH1 3.19Å; E365-R467 HydrophobicContact CB-CB 4.41Å; E365-R467 HydrophobicContact CG-CB 4.07Å; E365-R467 PolarHBondContact O-N 3.41Å; E365-R467 VanDerWaalsContact OE1-CD 3.27Å; E365-R467 WeakPolarHBondContact OE1-CD 3.39Å; E365-R467 IonicContact OE1-CZ 3.88Å; E365-R467 IonicContact OE1-NE 2.7Å; E365-R467 IonicContact OE1-NH1 3.65Å; E365-R467 PolarHBondContact OE1-NH1 2.82Å; E365-R467 VanDerWaalsContact OE2-CD 3.26Å; E365-R467 WeakPolarHBondContact OE2-CD 3.45Å; E365-R467 IonicContact OE2-NH1 3.28Å; R467-S469 VanDerWaalsContact C-N 3.34Å; R467-S469 PolarHBondContact O-N 2.98Å; R467-I470 PolarHBondContact O-N 3.37Å; R467-E471 PolarHBondContact O-N 2.83Å
468	D	89.8	Confident	91.6	Very high	75 Å²	75	23.3 Å²	23.3	40%	0.401	11%	0.108	S	C	.	.	H	α-helix	trans	-55.1	-45.1	173.3	-81.3	34.3	0	0	0	113	T466 I470 K472	T466-D468 VanDerWaalsContact C-N 3.27Å; T466-D468 PolarHBondContact O-N 2.9Å; D468-I470 VanDerWaalsContact C-N 3.33Å; D468-K472 WeakPolarHBondContact O-CB 3.32Å; D468-K472 WeakPolarHBondContact O-CD 3.4Å; D468-K472 WeakPolarHBondContact O-CG 3.32Å; D468-K472 PolarHBondContact O-N 2.97Å; D468-K472 VanDerWaalsContact O-N 3.07Å
469	S	93.6	Very high	91.8	Very high	4 Å²	4	23 Å²	23	3%	0.028	11%	0.107	C	C	.	.	H	α-helix	trans	-65.8	-38.9	178.7	73.7	0	0	0	0	111.6	S396 V398 T466 R467 K472 A473	S396-S469 WeakPolarHBondContact CB-O 3.33Å; S396-S469 WeakPolarHBondContact O-CA 3.48Å; S396-S469 VanDerWaalsContact O-CB 3.27Å; S396-S469 WeakPolarHBondContact O-CB 3.45Å; V398-S469 WeakPolarHBondContact CG2-O 3.35Å; T466-S469 PolarHBondContact N-OG 3.33Å; T466-S469 VanDerWaalsContact N-OG 3.14Å; T466-S469 WeakPolarHBondContact O-CA 3.36Å; T466-S469 WeakPolarHBondContact O-CB 3.4Å; T466-S469 PolarHBondContact O-N 3.08Å; T466-S469 PolarHBondContact O-OG 3.31Å; T466-S469 PolarHBondContact OG1-N 2.91Å; T466-S469 PolarHBondContact OG1-OG 3.28Å; R467-S469 VanDerWaalsContact C-N 3.34Å; R467-S469 PolarHBondContact O-N 2.98Å; S469-K472 PolarHBondContact O-N 2.89Å; S469-A473 WeakPolarHBondContact O-CB 3.33Å; S469-A473 PolarHBondContact O-N 3.47Å
470	I	92.8	Very high	92.2	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-45.6	179.8	-72.9	168.4	0	0	0	111.1	S367 L369 V398 L463 G465 T466 R467 D468 K472 A473 R474	S367-I470 VanDerWaalsContact O-CD1 3.25Å; S367-I470 WeakPolarHBondContact O-CD1 3.37Å; S367-I470 WeakPolarHBondContact OG-CD1 3.33Å; L369-I470 HydrophobicContact CB-CG2 3.5Å; L369-I470 HydrophobicContact CD2-CG2 3.56Å; L369-I470 HydrophobicContact CG-CG2 4.14Å; V398-I470 HydrophobicContact CG2-CG1 4.41Å; L463-I470 HydrophobicContact CB-CG1 4.17Å; L463-I470 HydrophobicContact CB-CG2 4.36Å; L463-I470 HydrophobicContact CD1-CG2 4.34Å; G465-I470 WeakPolarHBondContact O-CD1 3.49Å; T466-I470 PolarHBondContact O-N 2.84Å; R467-I470 PolarHBondContact O-N 3.37Å; D468-I470 VanDerWaalsContact C-N 3.33Å; I470-K472 PolarHBondContact O-N 2.99Å; I470-A473 PolarHBondContact O-N 2.81Å; I470-R474 PolarHBondContact O-N 3.13Å
471	E	91.4	Very high	92.3	Very high	59 Å²	59	23.3 Å²	23.3	28%	0.276	11%	0.108	S	C	.	.	H	α-helix	trans	-67.4	-35.6	177.3	-62.4	-69.5	-173.5	0	0	111.3	R437 R467 A473 R474 L475	R437-E471 IonicContact CZ-OE1 3.32Å; R437-E471 IonicContact NH1-OE1 2.91Å; R437-E471 PolarHBondContact NH1-OE1 2.87Å; R437-E471 IonicContact NH2-OE1 3.93Å; R437-E471 PolarHBondContact NH2-OE1 2.85Å; R467-E471 PolarHBondContact O-N 2.83Å; E471-A473 PolarHBondContact O-N 3.24Å; E471-R474 PolarHBondContact O-N 2.85Å; E471-R474 WeakPolarHBondContact OE2-CD 3.48Å; E471-R474 IonicContact OE2-NE 2.8Å; E471-L475 WeakPolarHBondContact O-CB 3.45Å; E471-L475 PolarHBondContact O-N 3.09Å
472	K	93.1	Very high	92.1	Very high	87 Å²	87	23.5 Å²	23.5	38%	0.378	11%	0.109	S	C	.	.	H	α-helix	trans	-61.8	-39.8	170.1	-71.8	168.2	-171	168.9	0	112.6	L232 D468 S469 I470 L475 L476	L232-K472 HydrophobicContact CD2-CB 3.91Å; L232-K472 HydrophobicContact CD2-CD 4.48Å; L232-K472 HydrophobicContact CD2-CG 3.81Å; D468-K472 WeakPolarHBondContact O-CB 3.32Å; D468-K472 WeakPolarHBondContact O-CD 3.4Å; D468-K472 WeakPolarHBondContact O-CG 3.32Å; D468-K472 PolarHBondContact O-N 2.97Å; D468-K472 VanDerWaalsContact O-N 3.07Å; S469-K472 PolarHBondContact O-N 2.89Å; I470-K472 PolarHBondContact O-N 2.99Å; K472-L475 PolarHBondContact O-N 3.22Å; K472-L476 WeakPolarHBondContact O-CG 3.38Å; K472-L476 PolarHBondContact O-N 2.88Å
473	A	94.5	Very high	91.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-69.5	-42.5	175.6	0	0	0	0	0	112.1	I392 V398 L463 S469 I470 E471 L475 L476 I477	I392-A473 HydrophobicContact CG2-CB 4.29Å; V398-A473 HydrophobicContact CG2-CB 3.64Å; L463-A473 HydrophobicContact CD1-CB 3.96Å; S469-A473 WeakPolarHBondContact O-CB 3.33Å; S469-A473 PolarHBondContact O-N 3.47Å; I470-A473 PolarHBondContact O-N 2.81Å; E471-A473 PolarHBondContact O-N 3.24Å; A473-L475 VanDerWaalsContact C-N 3.31Å; A473-L475 PolarHBondContact O-N 2.61Å; A473-L476 PolarHBondContact O-N 3.13Å; A473-I477 WeakPolarHBondContact O-CB 3.27Å; A473-I477 VanDerWaalsContact O-CG1 3.27Å; A473-I477 WeakPolarHBondContact O-CG1 3.3Å; A473-I477 PolarHBondContact O-N 3.03Å
474	R	92.6	Very high	91.8	Very high	55 Å²	55	24.4 Å²	24.4	21%	0.208	11%	0.113	C	C	.	.	H	α-helix	trans	-55.2	-46.9	170.9	172.1	-173.2	152.3	136.7	2.8	110.7	L371 V439 T448 I470 E471 I477 N478	L371-R474 HydrophobicContact CD1-CG 4.24Å; L371-R474 HydrophobicContact CD2-CB 4.47Å; V439-R474 VanDerWaalsContact CG1-NH1 3.34Å; T448-R474 PolarHBondContact OG1-NH1 2.95Å; T448-R474 PolarHBondContact OG1-NH2 2.96Å; I470-R474 PolarHBondContact O-N 3.13Å; E471-R474 PolarHBondContact O-N 2.85Å; E471-R474 WeakPolarHBondContact OE2-CD 3.48Å; E471-R474 IonicContact OE2-NE 2.8Å; R474-I477 PolarHBondContact O-N 2.66Å; R474-N478 WeakPolarHBondContact O-CB 3.3Å; R474-N478 PolarHBondContact O-N 2.91Å
475	L	92	Very high	91.7	Very high	36 Å²	36	29.3 Å²	29.3	19%	0.188	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-47.1	179.4	-176.2	63.9	0	0	0	111.9	H201 N229 L233 E471 K472 A473 I477 N478 F479	H201-L475 HydrophobicContact CB-CD1 4.23Å; H201-L475 WeakPolarHBondContact O-CD1 3.47Å; N229-L475 HydrophobicContact CB-CD2 4.42Å; L233-L475 HydrophobicContact CD1-CD2 4.43Å; L233-L475 HydrophobicContact CD2-CG 4.42Å; E471-L475 WeakPolarHBondContact O-CB 3.45Å; E471-L475 PolarHBondContact O-N 3.09Å; K472-L475 PolarHBondContact O-N 3.22Å; A473-L475 VanDerWaalsContact C-N 3.31Å; A473-L475 PolarHBondContact O-N 2.61Å; L475-I477 VanDerWaalsContact C-N 3.34Å; L475-I477 PolarHBondContact O-N 2.96Å; L475-N478 PolarHBondContact O-N 3.45Å; L475-F479 WeakPolarHBondContact O-CB 3.32Å; L475-F479 PolarHBondContact O-N 3.47Å
476	L	94.1	Very high	91.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.2	-37.5	176.3	-77.1	165.1	0	0	0	113	L232 L233 T236 I392 K395 K472 A473 Q480	L232-L476 HydrophobicContact CD1-CD1 4.23Å; L233-L476 HydrophobicContact CD2-CD2 3.79Å; L233-L476 HydrophobicContact CD2-CG 4.43Å; T236-L476 WeakPolarHBondContact OG1-CD2 3.25Å; I392-L476 HydrophobicContact CG2-CB 4.19Å; I392-L476 HydrophobicContact CG2-CD1 4.31Å; K395-L476 HydrophobicContact CB-CD1 3.7Å; K395-L476 HydrophobicContact CD-CD1 4.35Å; K395-L476 HydrophobicContact CD-CD2 4.14Å; K472-L476 WeakPolarHBondContact O-CG 3.38Å; K472-L476 PolarHBondContact O-N 2.88Å; A473-L476 PolarHBondContact O-N 3.13Å; L476-Q480 VanDerWaalsContact O-CG 3.26Å; L476-Q480 WeakPolarHBondContact O-CG 3.27Å; L476-Q480 PolarHBondContact O-N 2.91Å
477	I	93.8	Very high	91.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-71.3	-45.2	177.5	-70.4	166.6	0	0	0	110.7	L371 V373 L381 I392 L441 L463 A473 R474 L475 Q480 M481	L371-I477 HydrophobicContact CD2-CB 4.1Å; L371-I477 HydrophobicContact CD2-CD1 3.73Å; L371-I477 HydrophobicContact CD2-CG2 3.88Å; V373-I477 HydrophobicContact CG2-CG2 4.11Å; L381-I477 HydrophobicContact CD1-CG2 3.98Å; L381-I477 HydrophobicContact CD2-CG2 4.13Å; I392-I477 HydrophobicContact CD1-CG1 3.99Å; I392-I477 HydrophobicContact CG2-CG1 4.36Å; L441-I477 HydrophobicContact CD1-CG2 4.01Å; L463-I477 HydrophobicContact CD2-CD1 4.22Å; A473-I477 WeakPolarHBondContact O-CB 3.27Å; A473-I477 VanDerWaalsContact O-CG1 3.27Å; A473-I477 WeakPolarHBondContact O-CG1 3.3Å; A473-I477 PolarHBondContact O-N 3.03Å; R474-I477 PolarHBondContact O-N 2.66Å; L475-I477 VanDerWaalsContact C-N 3.34Å; L475-I477 PolarHBondContact O-N 2.96Å; I477-Q480 PolarHBondContact O-N 3.46Å; I477-M481 HydrophobicContact CG2-SD 4.2Å; I477-M481 WeakPolarHBondContact O-CG 3.43Å; I477-M481 PolarHBondContact O-N 3.1Å
478	N	91.8	Very high	91.2	Very high	19 Å²	19	27.9 Å²	27.9	10%	0.102	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-44.6	179.5	-158.3	88.9	0	0	0	111.7	H201 L441 R474 L475 Q480 M481 D482	H201-N478 PolarHBondContact NE2-ND2 2.93Å; L441-N478 HydrophobicContact CD1-CB 4.17Å; L441-N478 WeakPolarHBondContact CD2-OD1 3.46Å; R474-N478 WeakPolarHBondContact O-CB 3.3Å; R474-N478 PolarHBondContact O-N 2.91Å; L475-N478 PolarHBondContact O-N 3.45Å; N478-Q480 VanDerWaalsContact C-N 3.27Å; N478-Q480 PolarHBondContact O-N 3.33Å; N478-M481 PolarHBondContact O-N 2.79Å; N478-M481 VanDerWaalsContact O-N 3.09Å; N478-D482 PolarHBondContact O-N 2.95Å
479	F	91.1	Very high	91.1	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-59.1	-38.7	176.8	-177.3	-134.8	0	0	0	112.2	F198 H201 L233 T236 H237 M240 L475 Y483	F198-F479 HydrophobicContact CB-CE2 4.04Å; F198-F479 HydrophobicContact CB-CZ 3.92Å; F198-F479 HydrophobicContact CD2-CE1 4.38Å; F198-F479 AromaticContact CD2-CZ 3.79Å; F198-F479 HydrophobicContact CD2-CZ 3.79Å; F198-F479 HydrophobicContact CG-CZ 4.36Å; H201-F479 HydrophobicContact CB-CB 4.39Å; H201-F479 HydrophobicContact CB-CD2 3.91Å; H201-F479 HydrophobicContact CB-CG 4.33Å; H201-F479 AromaticContact CG-CD2 3.64Å; H201-F479 AromaticContact ND1-CD2 3.56Å; H201-F479 WeakPolarHBondContact NE2-CA 3.49Å; H201-F479 PolarHBondContact NE2-N 3.04Å; L233-F479 HydrophobicContact CB-CD1 4.47Å; L233-F479 HydrophobicContact CB-CE1 4.15Å; L233-F479 HydrophobicContact CD1-CD1 4.38Å; L233-F479 HydrophobicContact CD2-CB 4.47Å; L233-F479 HydrophobicContact CD2-CD1 3.75Å; L233-F479 HydrophobicContact CD2-CE1 4.29Å; L233-F479 HydrophobicContact CD2-CG 4.34Å; L233-F479 HydrophobicContact CG-CD1 4.42Å; T236-F479 HydrophobicContact CG2-CD1 3.92Å; T236-F479 HydrophobicContact CG2-CE1 4.08Å; H237-F479 HydrophobicContact CB-CE1 4.34Å; H237-F479 HydrophobicContact CB-CZ 4.19Å; M240-F479 HydrophobicContact CE-CD1 3.91Å; M240-F479 HydrophobicContact CE-CD2 3.99Å; M240-F479 HydrophobicContact CE-CE1 3.4Å; M240-F479 HydrophobicContact CE-CE2 3.45Å; M240-F479 VanDerWaalsContact CE-CE2 3.45Å; M240-F479 HydrophobicContact CE-CG 4.21Å; M240-F479 HydrophobicContact CE-CZ 3.15Å; M240-F479 HydrophobicContact SD-CD1 4.15Å; M240-F479 HydrophobicContact SD-CE1 3.95Å; M240-F479 HydrophobicContact SD-CZ 4.31Å; L475-F479 WeakPolarHBondContact O-CB 3.32Å; L475-F479 PolarHBondContact O-N 3.47Å; F479-Y483 WeakPolarHBondContact O-CB 3.31Å; F479-Y483 PolarHBondContact O-N 3.06Å; F479-Y483 VanDerWaalsContact O-N 3.17Å
480	Q	92.5	Very high	90.6	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.028	14%	0.138	C	C	.	.	H	α-helix	trans	-74.6	-31.7	175.4	-71	178.4	19.5	0	0	113.2	T236 M240 L381 N388 L476 I477 N478 F484	T236-Q480 HydrophobicContact CG2-CG 3.94Å; M240-Q480 HydrophobicContact SD-CG 4.41Å; L381-Q480 HydrophobicContact CD2-CB 3.86Å; N388-Q480 PolarHBondContact ND2-OE1 2.63Å; L476-Q480 VanDerWaalsContact O-CG 3.26Å; L476-Q480 WeakPolarHBondContact O-CG 3.27Å; L476-Q480 PolarHBondContact O-N 2.91Å; I477-Q480 PolarHBondContact O-N 3.46Å; N478-Q480 VanDerWaalsContact C-N 3.27Å; N478-Q480 PolarHBondContact O-N 3.33Å; Q480-F484 HydrophobicContact CB-CE2 4.11Å; Q480-F484 HydrophobicContact CB-CZ 4.33Å; Q480-F484 WeakPolarHBondContact O-CD2 3.34Å; Q480-F484 WeakPolarHBondContact O-CG 3.45Å; Q480-F484 PolarHBondContact O-N 3.29Å
481	M	90.9	Very high	90.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-50.7	174.7	-80	179.5	53.5	0	0	112.5	V373 P374 Y377 L381 L441 A443 I477 N478 Y483 F484 Y485	V373-M481 HydrophobicContact CB-SD 4.19Å; V373-M481 HydrophobicContact CG1-CE 4.2Å; V373-M481 HydrophobicContact CG1-CG 4.37Å; V373-M481 HydrophobicContact CG1-SD 3.6Å; V373-M481 VanDerWaalsContact CG1-SD 3.6Å; V373-M481 HydrophobicContact CG2-SD 3.72Å; P374-M481 HydrophobicContact CG-CE 4.41Å; Y377-M481 HydrophobicContact CD2-CE 4.09Å; Y377-M481 HydrophobicContact CD2-CG 4.49Å; Y377-M481 HydrophobicContact CE2-CE 4.46Å; L381-M481 HydrophobicContact CD1-CG 4.09Å; L441-M481 HydrophobicContact CB-CE 3.55Å; L441-M481 HydrophobicContact CB-SD 3.77Å; L441-M481 HydrophobicContact CD1-CE 4.47Å; L441-M481 HydrophobicContact CD1-SD 3.59Å; L441-M481 VanDerWaalsContact CD1-SD 3.59Å; L441-M481 HydrophobicContact CG-SD 4.3Å; A443-M481 HydrophobicContact CB-CB 4.28Å; A443-M481 HydrophobicContact CB-CE 4.13Å; I477-M481 HydrophobicContact CG2-SD 4.2Å; I477-M481 WeakPolarHBondContact O-CG 3.43Å; I477-M481 PolarHBondContact O-N 3.1Å; N478-M481 PolarHBondContact O-N 2.79Å; N478-M481 VanDerWaalsContact O-N 3.09Å; M481-Y483 PolarHBondContact O-N 2.8Å; M481-F484 PolarHBondContact O-N 3.18Å; M481-F484 VanDerWaalsContact O-N 3.11Å; M481-Y485 PolarHBondContact O-N 3.09Å
482	D	88.5	Confident	90.3	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.032	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-38.6	175.7	-82.7	11.5	0	0	0	110.4	R200 H201 A443 G444 N478 Y485 D486	R200-D482 IonicContact NH1-OD2 2.78Å; H201-D482 IonicContact CE1-OD2 3.83Å; H201-D482 PolarHBondContact CE1-OD2 2.88Å; H201-D482 IonicContact NE2-OD2 3.48Å; A443-D482 WeakPolarHBondContact CA-OD1 3.21Å; G444-D482 PolarHBondContact N-OD1 3.13Å; N478-D482 PolarHBondContact O-N 2.95Å; D482-Y485 WeakPolarHBondContact O-CB 3.39Å; D482-Y485 PolarHBondContact O-N 2.92Å; D482-D486 PolarHBondContact O-N 2.84Å
483	Y	88.6	Confident	90	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.027	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-40.9	173.3	178.9	-97.7	0	0	0	114.5	M240 Q243 K244 F479 M481 Y485 D486 L487	M240-Y483 HydrophobicContact CB-CD1 4.35Å; M240-Y483 HydrophobicContact CB-CD2 3.72Å; M240-Y483 HydrophobicContact CB-CE1 4.11Å; M240-Y483 HydrophobicContact CB-CE2 3.38Å; M240-Y483 HydrophobicContact CB-CG 4.16Å; M240-Y483 HydrophobicContact CE-CD1 4.47Å; M240-Y483 HydrophobicContact CE-CD2 3.49Å; M240-Y483 VanDerWaalsContact CE-CD2 3.49Å; M240-Y483 HydrophobicContact CE-CE2 4.27Å; M240-Y483 HydrophobicContact CE-CG 3.59Å; M240-Y483 HydrophobicContact CG-CD1 3.59Å; M240-Y483 HydrophobicContact CG-CD2 3.75Å; M240-Y483 HydrophobicContact CG-CE1 3.63Å; M240-Y483 HydrophobicContact CG-CE2 3.75Å; M240-Y483 HydrophobicContact CG-CG 3.64Å; M240-Y483 WeakPolarHBondContact O-CE2 3.44Å; M240-Y483 PolarHBondContact O-OH 3.34Å; M240-Y483 HydrophobicContact SD-CD1 3.93Å; M240-Y483 HydrophobicContact SD-CD2 4Å; M240-Y483 HydrophobicContact SD-CG 3.61Å; Q243-Y483 WeakPolarHBondContact CB-OH 3.32Å; K244-Y483 HydrophobicContact CB-CE2 4.49Å; K244-Y483 HydrophobicContact CD-CD2 4.4Å; K244-Y483 HydrophobicContact CD-CE2 3.77Å; K244-Y483 HydrophobicContact CG-CE2 3.65Å; K244-Y483 PolarHBondContact N-OH 3.15Å; F479-Y483 WeakPolarHBondContact O-CB 3.31Å; F479-Y483 PolarHBondContact O-N 3.06Å; F479-Y483 VanDerWaalsContact O-N 3.17Å; M481-Y483 PolarHBondContact O-N 2.8Å; Y483-Y485 VanDerWaalsContact C-N 3.28Å; Y483-Y485 PolarHBondContact O-N 3.35Å; Y483-D486 WeakPolarHBondContact O-CB 3.24Å; Y483-D486 PolarHBondContact O-N 2.8Å; Y483-L487 HydrophobicContact CD1-CD1 4.38Å; Y483-L487 HydrophobicContact CD1-CG 4.23Å; Y483-L487 HydrophobicContact CE1-CD1 3.47Å; Y483-L487 VanDerWaalsContact CE1-CD1 3.47Å; Y483-L487 HydrophobicContact CE1-CD2 4.15Å; Y483-L487 HydrophobicContact CE1-CG 3.58Å; Y483-L487 HydrophobicContact CE2-CD2 4.14Å; Y483-L487 HydrophobicContact CE2-CG 4.34Å; Y483-L487 WeakPolarHBondContact O-CG 3.44Å; Y483-L487 PolarHBondContact O-N 2.98Å; Y483-L487 WeakPolarHBondContact OH-CD2 2.86Å
484	F	90.8	Very high	89.5	Confident	19 Å²	19	36.1 Å²	36.1	8%	0.083	17%	0.171	C	C	.	.	H	α-helix	trans	-67.2	-32	176.1	-65.2	-36.9	0	0	0	112	Y377 R380 L381 Q480 M481 L487 E488	Y377-F484 HydrophobicContact CD1-CB 3.84Å; Y377-F484 HydrophobicContact CD1-CD2 4.41Å; Y377-F484 HydrophobicContact CE1-CB 4.04Å; R380-F484 HydrophobicContact CB-CD1 4.31Å; R380-F484 HydrophobicContact CB-CD2 3.76Å; R380-F484 HydrophobicContact CB-CE1 4.15Å; R380-F484 HydrophobicContact CB-CE2 3.57Å; R380-F484 HydrophobicContact CB-CG 4.15Å; R380-F484 HydrophobicContact CB-CZ 3.79Å; R380-F484 PolarHBondContact NH1-O 3.45Å; L381-F484 HydrophobicContact CD2-CE2 3.87Å; L381-F484 HydrophobicContact CG-CE2 3.93Å; Q480-F484 HydrophobicContact CB-CE2 4.11Å; Q480-F484 HydrophobicContact CB-CZ 4.33Å; Q480-F484 WeakPolarHBondContact O-CD2 3.34Å; Q480-F484 WeakPolarHBondContact O-CG 3.45Å; Q480-F484 PolarHBondContact O-N 3.29Å; M481-F484 PolarHBondContact O-N 3.18Å; M481-F484 VanDerWaalsContact O-N 3.11Å; F484-L487 PolarHBondContact O-N 3.18Å; F484-E488 WeakPolarHBondContact O-CB 3.48Å; F484-E488 WeakPolarHBondContact O-CG 3.23Å; F484-E488 PolarHBondContact O-N 3.42Å
485	Y	89.4	Confident	89.3	Confident	105 Å²	105	38.6 Å²	38.6	41%	0.412	19%	0.187	S	C	.	.	H	α-helix	trans	-66.5	-44.3	172	175.6	-99.4	0	0	0	112.1	A443 M481 D482 Y483 L487 E488 K489	A443-Y485 HydrophobicContact CB-CG 4.34Å; M481-Y485 PolarHBondContact O-N 3.09Å; D482-Y485 WeakPolarHBondContact O-CB 3.39Å; D482-Y485 PolarHBondContact O-N 2.92Å; Y483-Y485 VanDerWaalsContact C-N 3.28Å; Y483-Y485 PolarHBondContact O-N 3.35Å; Y485-L487 VanDerWaalsContact C-N 3.3Å; Y485-L487 PolarHBondContact O-N 2.8Å; Y485-E488 PolarHBondContact O-N 3.22Å; Y485-K489 PolarHBondContact O-N 3.2Å
486	D	87	Confident	89	Confident	37 Å²	37	43 Å²	43	20%	0.198	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-42.3	170.3	-80.9	-9.1	0	0	0	112.2	K244 D482 Y483 K489 M490	K244-D486 WeakPolarHBondContact CE-OD2 3.46Å; K244-D486 IonicContact NZ-OD2 2.71Å; K244-D486 PolarHBondContact NZ-OD2 2.74Å; D482-D486 PolarHBondContact O-N 2.84Å; Y483-D486 WeakPolarHBondContact O-CB 3.24Å; Y483-D486 PolarHBondContact O-N 2.8Å; D486-K489 PolarHBondContact O-N 2.85Å; D486-M490 PolarHBondContact O-N 2.86Å
487	L	88.2	Confident	88.4	Confident	9 Å²	9	45.1 Å²	45.1	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-44.5	176.2	-72.2	-157	0	0	0	111.9	Q243 K244 L247 Y483 F484 Y485 K489 M490 E491	Q243-L487 HydrophobicContact CB-CD1 4.49Å; K244-L487 HydrophobicContact CG-CD2 3.85Å; L247-L487 HydrophobicContact CD1-CB 4.49Å; L247-L487 HydrophobicContact CD1-CD1 4.2Å; L247-L487 HydrophobicContact CD1-CD2 3.7Å; L247-L487 HydrophobicContact CD1-CG 4.35Å; Y483-L487 HydrophobicContact CD1-CD1 4.38Å; Y483-L487 HydrophobicContact CD1-CG 4.23Å; Y483-L487 HydrophobicContact CE1-CD1 3.47Å; Y483-L487 VanDerWaalsContact CE1-CD1 3.47Å; Y483-L487 HydrophobicContact CE1-CD2 4.15Å; Y483-L487 HydrophobicContact CE1-CG 3.58Å; Y483-L487 HydrophobicContact CE2-CD2 4.14Å; Y483-L487 HydrophobicContact CE2-CG 4.34Å; Y483-L487 WeakPolarHBondContact O-CG 3.44Å; Y483-L487 PolarHBondContact O-N 2.98Å; Y483-L487 WeakPolarHBondContact OH-CD2 2.86Å; F484-L487 PolarHBondContact O-N 3.18Å; Y485-L487 VanDerWaalsContact C-N 3.3Å; Y485-L487 PolarHBondContact O-N 2.8Å; L487-K489 PolarHBondContact O-N 3.01Å; L487-M490 HydrophobicContact CD2-CE 3.64Å; L487-M490 PolarHBondContact O-N 3.13Å; L487-E491 VanDerWaalsContact O-CB 3.27Å; L487-E491 WeakPolarHBondContact O-CB 3.45Å; L487-E491 VanDerWaalsContact O-CG 3.23Å; L487-E491 WeakPolarHBondContact O-CG 3.33Å; L487-E491 PolarHBondContact O-N 3.04Å
488	E	88.2	Confident	87.8	Confident	54 Å²	54	49.9 Å²	49.9	25%	0.252	24%	0.241	S	C	.	.	H	α-helix	trans	-59.2	-37.1	176.2	-84.3	153.5	-137.6	0	0	111.7	Y377 R380 F484 Y485 S492	Y377-E488 WeakPolarHBondContact CE1-OE1 3.34Å; Y377-E488 WeakPolarHBondContact CE1-OE2 3.43Å; R380-E488 IonicContact CZ-OE1 2.65Å; R380-E488 VanDerWaalsContact CZ-OE1 3.28Å; R380-E488 IonicContact NE-OE1 3.66Å; R380-E488 IonicContact NH1-OE1 3.94Å; R380-E488 PolarHBondContact NH1-OE1 3.19Å; F484-E488 WeakPolarHBondContact O-CB 3.48Å; F484-E488 WeakPolarHBondContact O-CG 3.23Å; F484-E488 PolarHBondContact O-N 3.42Å; Y485-E488 PolarHBondContact O-N 3.22Å; E488-S492 WeakPolarHBondContact O-CB 3.19Å; E488-S492 PolarHBondContact O-N 3.16Å; E488-S492 PolarHBondContact O-OG 3.03Å
489	K	88.3	Confident	87.5	Confident	108 Å²	108	55.9 Å²	55.9	47%	0.47	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-52.9	172.3	-174.6	174.5	179.2	-68.7	0	112	Y485 D486 L487 E491 S492 E493	Y485-K489 PolarHBondContact O-N 3.2Å; D486-K489 PolarHBondContact O-N 2.85Å; L487-K489 PolarHBondContact O-N 3.01Å; K489-E491 VanDerWaalsContact C-N 3.33Å; K489-E491 PolarHBondContact O-N 3.34Å; K489-S492 PolarHBondContact O-N 3.16Å; K489-S492 VanDerWaalsContact O-N 3.15Å; K489-S492 PolarHBondContact O-OG 2.91Å; K489-E493 IonicContact NZ-OE1 3.2Å; K489-E493 PolarHBondContact NZ-OE1 3.29Å; K489-E493 WeakPolarHBondContact O-CG 3.28Å; K489-E493 PolarHBondContact O-N 3.36Å
490	M	84.1	Confident	87.1	Confident	33 Å²	33	58.5 Å²	58.5	16%	0.163	28%	0.281	C	S	.	.	H	α-helix	trans	-66.2	-32	177.9	-64.7	-164.1	-45.9	0	0	113.4	K244 L247 D486 L487 S492 K494	K244-M490 HydrophobicContact CB-CE 4.24Å; K244-M490 HydrophobicContact CG-CE 3.72Å; L247-M490 HydrophobicContact CB-CE 3.79Å; L247-M490 HydrophobicContact CD1-CE 4.18Å; D486-M490 PolarHBondContact O-N 2.86Å; L487-M490 HydrophobicContact CD2-CE 3.64Å; L487-M490 PolarHBondContact O-N 3.13Å; M490-S492 VanDerWaalsContact C-N 3.33Å; M490-K494 VanDerWaalsContact O-CB 3.28Å; M490-K494 WeakPolarHBondContact O-CB 3.45Å; M490-K494 PolarHBondContact O-N 3Å
491	E	88.6	Confident	86.2	Confident	77 Å²	77	61.5 Å²	61.5	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-36.6	173.5	-74.8	179.3	141.6	0	0	110.8	L247 R380 L487 K489 L495	L247-E491 HydrophobicContact CD1-CG 4.07Å; L247-E491 HydrophobicContact CD2-CG 4.01Å; R380-E491 IonicContact CZ-OE2 3.71Å; R380-E491 IonicContact NH1-OE2 3.07Å; R380-E491 IonicContact NH2-OE1 3.53Å; R380-E491 IonicContact NH2-OE2 3.37Å; R380-E491 PolarHBondContact NH2-OE2 2.81Å; L487-E491 VanDerWaalsContact O-CB 3.27Å; L487-E491 WeakPolarHBondContact O-CB 3.45Å; L487-E491 VanDerWaalsContact O-CG 3.23Å; L487-E491 WeakPolarHBondContact O-CG 3.33Å; L487-E491 PolarHBondContact O-N 3.04Å; K489-E491 VanDerWaalsContact C-N 3.33Å; K489-E491 PolarHBondContact O-N 3.34Å; E491-L495 WeakPolarHBondContact O-CB 3.49Å; E491-L495 PolarHBondContact O-N 3.21Å; E491-L495 VanDerWaalsContact O-N 3.07Å
492	S	88.4	Confident	85.4	Confident	66 Å²	66	65.6 Å²	65.6	46%	0.462	33%	0.326	S	S	.	.	H	α-helix	trans	-72.3	-44	175	74.2	0	0	0	0	113.3	E488 K489 M490 K494 L495 E496	E488-S492 WeakPolarHBondContact O-CB 3.19Å; E488-S492 PolarHBondContact O-N 3.16Å; E488-S492 PolarHBondContact O-OG 3.03Å; K489-S492 PolarHBondContact O-N 3.16Å; K489-S492 VanDerWaalsContact O-N 3.15Å; K489-S492 PolarHBondContact O-OG 2.91Å; M490-S492 VanDerWaalsContact C-N 3.33Å; S492-K494 VanDerWaalsContact C-N 3.32Å; S492-K494 PolarHBondContact O-N 2.68Å; S492-L495 WeakPolarHBondContact O-CB 3.48Å; S492-L495 PolarHBondContact O-N 2.9Å; S492-E496 PolarHBondContact O-N 2.81Å
493	E	86	Confident	84.2	Confident	64 Å²	64	71.8 Å²	71.8	30%	0.299	35%	0.354	S	S	.	.	H	α-helix	trans	-58.4	-44.8	174.3	-71.7	166.1	176.1	0	0	110.9	K489 L495 E496 L497	K489-E493 IonicContact NZ-OE1 3.2Å; K489-E493 PolarHBondContact NZ-OE1 3.29Å; K489-E493 WeakPolarHBondContact O-CG 3.28Å; K489-E493 PolarHBondContact O-N 3.36Å; E493-L495 VanDerWaalsContact C-N 3.34Å; E493-L495 PolarHBondContact O-N 3.3Å; E493-E496 PolarHBondContact O-N 2.72Å; E493-L497 WeakPolarHBondContact O-CD1 3.2Å; E493-L497 VanDerWaalsContact O-CG 3.3Å; E493-L497 WeakPolarHBondContact O-CG 3.42Å; E493-L497 PolarHBondContact O-N 2.85Å
494	K	84.7	Confident	82.6	Confident	53 Å²	53	74.9 Å²	74.9	23%	0.23	39%	0.389	C	S	.	.	H	α-helix	trans	-59.8	-41.9	172.8	177.4	177.4	165.1	177	0	112.4	L247 S250 L251 M490 S492 E496 M498	L247-K494 HydrophobicContact CD2-CD 4.49Å; S250-K494 WeakPolarHBondContact OG-CE 2.83Å; S250-K494 PolarHBondContact OG-NZ 2.8Å; L251-K494 HydrophobicContact CD1-CB 3.72Å; L251-K494 HydrophobicContact CD1-CG 4.5Å; M490-K494 VanDerWaalsContact O-CB 3.28Å; M490-K494 WeakPolarHBondContact O-CB 3.45Å; M490-K494 PolarHBondContact O-N 3Å; S492-K494 VanDerWaalsContact C-N 3.32Å; S492-K494 PolarHBondContact O-N 2.68Å; K494-E496 VanDerWaalsContact C-N 3.32Å; K494-M498 HydrophobicContact CG-SD 4.33Å; K494-M498 WeakPolarHBondContact O-CB 3.29Å; K494-M498 WeakPolarHBondContact O-CG 3.38Å; K494-M498 PolarHBondContact O-N 3.24Å
495	L	87.7	Confident	80.9	Confident	106 Å²	106	77.1 Å²	77.1	56%	0.555	42%	0.417	S	S	*	.	H	α-helix	trans	-65.7	-37.2	179.6	-168	77.6	0	0	0	111.5	E491 S492 E493 M498 R499	E491-L495 WeakPolarHBondContact O-CB 3.49Å; E491-L495 PolarHBondContact O-N 3.21Å; E491-L495 VanDerWaalsContact O-N 3.07Å; S492-L495 WeakPolarHBondContact O-CB 3.48Å; S492-L495 PolarHBondContact O-N 2.9Å; E493-L495 VanDerWaalsContact C-N 3.34Å; E493-L495 PolarHBondContact O-N 3.3Å; L495-M498 PolarHBondContact O-N 2.83Å; L495-R499 WeakPolarHBondContact O-CB 3.33Å; L495-R499 PolarHBondContact O-N 2.91Å
496	E	86.2	Confident	79	Confident	129 Å²	129	77.2 Å²	77.2	60%	0.603	43%	0.428	S	S	*	.	H	α-helix	trans	-68.2	-45	177	-175.9	156	-136.7	0	0	112	S492 E493 K494 M498 R499 S500	S492-E496 PolarHBondContact O-N 2.81Å; E493-E496 PolarHBondContact O-N 2.72Å; K494-E496 VanDerWaalsContact C-N 3.32Å; E496-M498 VanDerWaalsContact C-N 3.3Å; E496-M498 PolarHBondContact O-N 2.71Å; E496-R499 WeakPolarHBondContact O-CA 3.38Å; E496-R499 WeakPolarHBondContact O-CB 3.44Å; E496-R499 PolarHBondContact O-N 3.08Å; E496-S500 PolarHBondContact O-N 3.15Å
497	L	81	Confident	77.1	Confident	46 Å²	46	83.5 Å²	83.5	24%	0.241	46%	0.462	C	S	.	.	H	α-helix	trans	-62.9	-34.6	172.9	-66.7	161.4	0	0	0	112.5	L251 I255 L258 E493 R499 S500 L501	L251-L497 HydrophobicContact CD1-CD1 3.67Å; L251-L497 HydrophobicContact CG-CD1 4.24Å; I255-L497 HydrophobicContact CD1-CD1 3.86Å; I255-L497 HydrophobicContact CG1-CD1 3.69Å; I255-L497 HydrophobicContact CG1-CD2 4.34Å; L258-L497 HydrophobicContact CD1-CB 4.05Å; L258-L497 HydrophobicContact CD1-CD2 3.57Å; L258-L497 HydrophobicContact CD1-CG 4.42Å; E493-L497 WeakPolarHBondContact O-CD1 3.2Å; E493-L497 VanDerWaalsContact O-CG 3.3Å; E493-L497 WeakPolarHBondContact O-CG 3.42Å; E493-L497 PolarHBondContact O-N 2.85Å; L497-R499 VanDerWaalsContact C-N 3.33Å; L497-S500 PolarHBondContact O-OG 2.98Å; L497-L501 WeakPolarHBondContact O-CG 3.39Å; L497-L501 PolarHBondContact O-N 3.41Å
498	M	81.9	Confident	75.1	Confident	99 Å²	99	88.1 Å²	88.1	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-71.1	-26.5	170.8	-74.1	-175.3	65.1	0	0	112.9	T254 K494 L495 E496 S502	T254-M498 HydrophobicContact CG2-CG 4.07Å; K494-M498 HydrophobicContact CG-SD 4.33Å; K494-M498 WeakPolarHBondContact O-CB 3.29Å; K494-M498 WeakPolarHBondContact O-CG 3.38Å; K494-M498 PolarHBondContact O-N 3.24Å; L495-M498 PolarHBondContact O-N 2.83Å; E496-M498 VanDerWaalsContact C-N 3.3Å; E496-M498 PolarHBondContact O-N 2.71Å; M498-S502 PolarHBondContact O-N 2.7Å
499	R	85.6	Confident	72.9	Confident	146 Å²	146	88.9 Å²	88.9	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-75.1	-41.9	175.7	-174.3	-177.4	-67.7	150.2	-0.2	111.5	L495 E496 L497 S502 H503	L495-R499 WeakPolarHBondContact O-CB 3.33Å; L495-R499 PolarHBondContact O-N 2.91Å; E496-R499 WeakPolarHBondContact O-CA 3.38Å; E496-R499 WeakPolarHBondContact O-CB 3.44Å; E496-R499 PolarHBondContact O-N 3.08Å; L497-R499 VanDerWaalsContact C-N 3.33Å; R499-S502 WeakPolarHBondContact O-CB 3.41Å; R499-S502 PolarHBondContact O-N 2.84Å; R499-S502 VanDerWaalsContact O-N 3.09Å; R499-H503 PolarHBondContact O-N 3.22Å; R499-H503 PolarHBondContact O-ND1 2.88Å
500	S	83.1	Confident	70.9	Confident	58 Å²	58	89.3 Å²	89.3	41%	0.406	53%	0.531	S	S	.	.	H	α-helix	trans	-63.7	-43.7	177	56.3	0	0	0	0	111.8	E496 L497 S502 H503 G504	E496-S500 PolarHBondContact O-N 3.15Å; L497-S500 PolarHBondContact O-OG 2.98Å; S500-S502 PolarHBondContact O-N 2.76Å; S500-S502 VanDerWaalsContact O-N 3.12Å; S500-H503 PolarHBondContact O-N 2.67Å; S500-G504 PolarHBondContact O-N 3.18Å; S500-G504 VanDerWaalsContact O-N 3.17Å
501	L	72.3	Confident	68.9	Low	69 Å²	69	94.3 Å²	94.3	36%	0.361	56%	0.558	S	S	.	*	H	α-helix	trans	-52.5	-31.1	169.9	-78.7	170.5	0	0	0	113.4	N257 L258 L497	N257-L501 HydrophobicContact CB-CD2 4.25Å; L258-L501 HydrophobicContact CD1-CG 4.23Å; L258-L501 HydrophobicContact CD2-CD2 3.63Å; L258-L501 HydrophobicContact CD2-CG 3.82Å; L258-L501 HydrophobicContact CG-CD1 4.47Å; L258-L501 HydrophobicContact CG-CD2 3.84Å; L258-L501 HydrophobicContact CG-CG 3.93Å; L497-L501 WeakPolarHBondContact O-CG 3.39Å; L497-L501 PolarHBondContact O-N 3.41Å
502	S	74.2	Confident	66.9	Low	86 Å²	86	102 Å²	102	60%	0.601	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-12.1	-179.1	-170.2	0	0	0	0	114.7	M498 R499 S500	M498-S502 PolarHBondContact O-N 2.7Å; R499-S502 WeakPolarHBondContact O-CB 3.41Å; R499-S502 PolarHBondContact O-N 2.84Å; R499-S502 VanDerWaalsContact O-N 3.09Å; S500-S502 PolarHBondContact O-N 2.76Å; S500-S502 VanDerWaalsContact O-N 3.12Å
503	H	63.2	Low	65	Low	136 Å²	136	104.3 Å²	104.3	63%	0.63	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-33.3	-177.2	-70	74.9	0	0	0	112.6	R499 S500 G505	R499-H503 PolarHBondContact O-N 3.22Å; R499-H503 PolarHBondContact O-ND1 2.88Å; S500-H503 PolarHBondContact O-N 2.67Å; H503-G505 PolarHBondContact O-N 3.35Å
504	G	56.7	Low	63.1	Low	73 Å²	73	107.6 Å²	107.6	75%	0.753	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	19	179.4	0	0	0	0	0	116.1	S500	S500-G504 PolarHBondContact O-N 3.18Å; S500-G504 VanDerWaalsContact O-N 3.17Å
505	G	53.8	Low	61	Low	66 Å²	66	117.2 Å²	117.2	68%	0.68	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	11	-175.9	0	0	0	0	0	114.8	H503	H503-G505 PolarHBondContact O-N 3.35Å
506	V	50.2	Low	58.6	Low	106 Å²	106	115.2 Å²	115.2	64%	0.642	67%	0.666	S	S	*	*			trans	-135.3	36.7	-170.1	-150.6	0	0	0	0	113.6	S508	V506-S508 PolarHBondContact O-N 2.86Å
507	D	46	Very low	56.4	Low	170 Å²	170	115.8 Å²	115.8	91%	0.909	68%	0.678	S	S	*	*			trans	-71.7	75.6	167	-79.8	-28.8	0	0	0	110.8
508	S	47	Very low	54.6	Low	106 Å²	106	120.8 Å²	120.8	74%	0.741	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-82.5	124.2	163.3	-63.6	0	0	0	0	109	V506	V506-S508 PolarHBondContact O-N 2.86Å
509	G	42.9	Very low	52.7	Low	69 Å²	69	122.7 Å²	122.7	71%	0.711	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-62	161.8	-173.8	0	0	0	0	0	115.2
510	P	45.3	Very low	50.7	Low	118 Å²	118	119.3 Å²	119.3	77%	0.766	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.3	152	-165.3	30.7	-36.8	0	0	0	115.7
511	D	43.3	Very low	48.5	Very low	138 Å²	138	126.1 Å²	126.1	74%	0.738	76%	0.755	S	S	*	*			trans	49.1	99.8	148.7	-63.2	-39.9	0	0	0	120.9
512	Y	45.9	Very low	46.9	Very low	238 Å²	238	133.5 Å²	133.5	93%	0.933	78%	0.778	S	S	*	*			trans	-148.4	109.1	137.3	-93.3	-71.9	0	0	0	111.9
513	P	47.7	Very low	45.3	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	79%	0.785	S	S	*	*			trans	-81.3	166.4	175.6	31.6	-33.3	0	0	0	113.7
514	P	46.5	Very low	44.3	Very low	132 Å²	132	133.3 Å²	133.3	86%	0.857	79%	0.792	S	S	*	*			trans	-94.9	167.2	-148.7	36.3	-38.5	0	0	0	117.2
515	R	40.2	Very low	43.6	Very low	256 Å²	256	140.5 Å²	140.5	97%	0.966	80%	0.796	S	S	*	*			trans	-131.3	145.7	171.6	-142.8	179.8	-165.7	-147	4.4	110.1
516	G	38.5	Very low	42.9	Very low	64 Å²	64	141.5 Å²	141.5	66%	0.66	81%	0.807	S	S	*	*			trans	-121.7	175.8	-165.6	0	0	0	0	0	117.8
517	T	39.9	Very low	42.4	Very low	140 Å²	140	140.3 Å²	140.3	86%	0.859	82%	0.816	S	S	*	*			trans	58.3	109.4	157.1	59.2	0	0	0	0	120.7
518	V	41.6	Very low	42.2	Very low	152 Å²	152	139.5 Å²	139.5	92%	0.921	82%	0.817	S	S	*	*			trans	-138.4	156.9	143.4	-178.1	0	0	0	0	108.4
519	V	43.9	Very low	41.8	Very low	139 Å²	139	137.8 Å²	137.8	84%	0.842	82%	0.816	S	S	*	*			trans	-112.1	148	-162.9	175.5	0	0	0	0	113.3
520	G	42.1	Very low	41.7	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	82%	0.819	S	S	*	*			trans	-150.9	129.7	167.5	0	0	0	0	0	113.9
521	R	37	Very low	41.2	Very low	201 Å²	201	146.2 Å²	146.2	76%	0.758	82%	0.823	S	S	*	*			trans	-83.2	167.9	172.5	-87	-179.7	160.2	-153.4	-0.6	110.6
522	W	39.3	Very low	41	Very low	223 Å²	223	143.3 Å²	143.3	85%	0.845	83%	0.826	S	S	*	*				-166	156.2	50	-76.5	85.8	0	0	0	113.8
523	G	39.8	Very low	40.7	Very low	73 Å²	73	143.9 Å²	143.9	75%	0.753	83%	0.826	S	S	*	*			trans	68.6	113.6	156.5	0	0	0	0	0	117.2
524	D	42.7	Very low	40	Very low	146 Å²	146	142.5 Å²	142.5	78%	0.781	83%	0.833	S	S	*	*			cis	94.2	140.9	33.1	-165.5	35.4	0	0	0	115.6
525	R	41.6	Very low	39.7	Very low	223 Å²	223	140 Å²	140	84%	0.842	83%	0.831	S	S	*	*			trans	77	90.3	173.8	-53.1	-166.2	178.8	-170.5	-2.2	120.5
526	G	39.2	Very low	39.6	Very low	87 Å²	87	140.3 Å²	140.3	90%	0.897	83%	0.832	S	S	*	*				100.5	138	101.5	0	0	0	0	0	119.4
527	G	40.2	Very low	39.6	Very low	81 Å²	81	141 Å²	141	84%	0.835	84%	0.84	S	S	*	*			trans	157.4	111.7	170.7	0	0	0	0	0	112.6
528	V	41.6	Very low	39.8	Very low	154 Å²	154	146 Å²	146	93%	0.933	84%	0.843	S	S	*	*			trans	-92	139.3	179.5	-178.8	0	0	0	0	110.1
529	G	39.3	Very low	39.9	Very low	69 Å²	69	150.4 Å²	150.4	71%	0.711	84%	0.843	S	S	*	*			trans	-86.6	166	-179.8	0	0	0	0	0	114.7
530	N	40.2	Very low	39.8	Very low	145 Å²	145	150.1 Å²	150.1	78%	0.775	84%	0.844	S	S	*	*			trans	-152.3	161.6	162.9	-160.4	9.5	0	0	0	111.2
531	Y	34.2	Very low	39.4	Very low	220 Å²	220	150.1 Å²	150.1	86%	0.863	84%	0.844	S	S	*	*			trans	-89	139	-168.5	-36.6	-86.3	0	0	0	112.7
532	G	39.7	Very low	39.5	Very low	77 Å²	77	152.5 Å²	152.5	79%	0.794	85%	0.853	S	S	*	*			trans	-163.1	120.4	-179.3	0	0	0	0	0	115.6
533	R	39	Very low	39.4	Very low	250 Å²	250	147.9 Å²	147.9	94%	0.943	85%	0.854	S	S	*	*			trans	-51	127.9	-177	-65.9	172.3	166.9	-153.7	-0.6	116.3
534	G	32.8	Very low	39.3	Very low	85 Å²	85	147.4 Å²	147.4	88%	0.876	85%	0.849	S	S	*	*				75.8	130.7	119.7	0	0	0	0	0	120.2
535	G	40.4	Very low	39.1	Very low	80 Å²	80	148.5 Å²	148.5	83%	0.825	85%	0.854	S	S	*	*			trans	-157.1	140.5	169.6	0	0	0	0	0	112.5
536	R	39.1	Very low	39	Very low	262 Å²	262	145.2 Å²	145.2	99%	0.989	85%	0.853	S	S	*	*			trans	-91.4	118.4	168.4	-73.6	177.2	172.2	173.7	-3	108.7
537	G	38.6	Very low	39	Very low	79 Å²	79	149.2 Å²	149.2	81%	0.814	85%	0.847	S	S	*	*			trans	-109.4	128.2	171.7	0	0	0	0	0	111.8
538	R	43.9	Very low	38.9	Very low	246 Å²	246	150.8 Å²	150.8	93%	0.928	84%	0.843	S	S	*	*			trans	-97.5	165.9	161.7	-81.8	-173.9	169.2	-165.1	-2.4	109.5
539	R	43	Very low	39.4	Very low	244 Å²	244	149.5 Å²	149.5	92%	0.921	84%	0.838	S	S	*	*			trans	-35.8	152.3	170.1	-63.1	175.7	171.3	178.8	-5.8	113.5
540	P	43	Very low	39.2	Very low	132 Å²	132	152.7 Å²	152.7	86%	0.857	84%	0.843	S	S	*	*				-125.1	166.8	103.6	36.5	-32.7	0	0	0	113
541	G	33.1	Very low	39.1	Very low	75 Å²	75	150.7 Å²	150.7	77%	0.773	84%	0.84	S	S	*	*			trans	-133.2	160.7	166.2	0	0	0	0	0	109.7
542	R	38.4	Very low	39.4	Very low	252 Å²	252	147.1 Å²	147.1	95%	0.951	84%	0.837	S	S	*	*			trans	-153.5	151.9	176.4	-162	173	-177.6	-166.2	-1.4	111
543	S	38	Very low	39.3	Very low	125 Å²	125	149.2 Å²	149.2	87%	0.874	83%	0.834	S	S	*	*			trans	-93.4	163	-171.3	-40.2	0	0	0	0	114.6
544	G	37.3	Very low	39.4	Very low	63 Å²	63	143.4 Å²	143.4	65%	0.649	83%	0.825	S	S	*	*			trans	144	108	171.1	0	0	0	0	0	108.9
545	L	39.7	Very low	39.6	Very low	170 Å²	170	145.1 Å²	145.1	89%	0.89	82%	0.815	S	S	*	*				61.3	114.8	65.3	-67.4	173.7	0	0	0	113.9
546	L	39.5	Very low	39.7	Very low	154 Å²	154	149.7 Å²	149.7	81%	0.806	81%	0.814	S	S	*	*			trans	153.6	121.7	133.1	-78.5	162	0	0	0	112.1
547	H	37.8	Very low	39.6	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.787	80%	0.797	S	S	*	*			trans	30.2	146.7	158.9	-56.9	-80.8	0	0	0	125
548	P	37.9	Very low	39.6	Very low	114 Å²	114	144.3 Å²	144.3	74%	0.74	80%	0.795	S	S	*	*			trans	-94.5	165	167.6	39.5	-35	0	0	0	113.8
549	P	52.2	Low	39.3	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	79%	0.789	S	S	*	*			trans	-90.8	169	167.4	36.8	-33.6	0	0	0	113.6
550	V	36.1	Very low	39.1	Very low	137 Å²	137	135 Å²	135	83%	0.83	77%	0.771	S	S	*	*			trans	-116.1	-162.3	-177.2	-119.8	0	0	0	0	111.1
551	S	38.5	Very low	38.8	Very low	102 Å²	102	135.7 Å²	135.7	71%	0.713	77%	0.768	S	S	*	*			trans	70.9	139.5	176.2	42.7	0	0	0	0	116.8
552	D	38.8	Very low	39.2	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	77%	0.769	S	S	*	*			cis	-156	152.1	-0.2	-104.2	-18.7	0	0	0	114.2
553	V	38.9	Very low	39.3	Very low	121 Å²	121	134.5 Å²	134.5	73%	0.733	76%	0.758	S	S	*	*			trans	31	130.9	145.6	-155.8	0	0	0	0	119.2
554	V	39.7	Very low	39.1	Very low	127 Å²	127	134.5 Å²	134.5	77%	0.77	75%	0.748	S	S	*	*				-164.7	143.8	73.8	171.5	0	0	0	0	113.1
555	N	37.9	Very low	39	Very low	121 Å²	121	138.8 Å²	138.8	65%	0.647	75%	0.754	S	S	*	*			trans	-14.3	162	154.8	-67.7	-1.1	0	0	0	121.4
556	H	41.3	Very low	38.7	Very low	177 Å²	177	134 Å²	134	82%	0.819	75%	0.747	S	S	*	*			cis	-146.3	166.8	3.3	-78.3	-67.8	0	0	0	108.4
557	G	38.4	Very low	38.4	Very low	60 Å²	60	134.6 Å²	134.6	62%	0.619	75%	0.75	S	S	*	*			cis	156.6	143.1	-7.9	0	0	0	0	0	113.6
558	H	38.5	Very low	38.5	Very low	168 Å²	168	131.8 Å²	131.8	78%	0.778	75%	0.747	S	S	*	*			trans	59.6	152	170.2	-58.6	-90.6	0	0	0	118.5
559	Y	37.2	Very low	38.4	Very low	204 Å²	204	132.8 Å²	132.8	80%	0.8	75%	0.745	S	S	*	*			cis	-124.4	141.6	4.1	-101.7	-98.9	0	0	0	107.8
560	T	38.4	Very low	37.7	Very low	90 Å²	90	132.3 Å²	132.3	55%	0.552	74%	0.742	S	S	*	*				49.3	129.8	66.6	108.2	0	0	0	0	114
561	D	37.5	Very low	37.7	Very low	146 Å²	146	135.4 Å²	135.4	78%	0.781	74%	0.74	S	S	*	*			cis	-134.2	179.3	1.1	-68.7	-73.3	0	0	0	107.9
562	D	40.7	Very low	37.5	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	75%	0.75	S	S	*	*			cis	-162.3	178.7	41.4	-153.6	-11.9	0	0	0	112.9
563	E	40.6	Very low	37.2	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	75%	0.75	S	S	*	*			trans	-54.2	143.3	-162.2	-84.4	-156.8	174.3	0	0	121.1
564	N	34.5	Very low	37.1	Very low	124 Å²	124	137.3 Å²	137.3	66%	0.663	75%	0.749	S	S	*	*				60.3	147.9	88	-69.5	-31.2	0	0	0	115.4
565	I	35.5	Very low	37.2	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	76%	0.756	S	S	*	*			cis	-154.4	143.6	-7.6	-108.6	158.7	0	0	0	107.8
566	G	32.5	Very low	37	Very low	71 Å²	71	146.1 Å²	146.1	73%	0.732	77%	0.766	S	S	*	*				129.1	148.8	117.5	0	0	0	0	0	115.2
567	N	33.3	Very low	37.2	Very low	165 Å²	165	146.4 Å²	146.4	88%	0.882	77%	0.769	S	S	*	*			trans	-132.2	164.9	-175.7	-122.2	-10.8	0	0	0	111.7
568	P	40.3	Very low	37.2	Very low	112 Å²	112	149.5 Å²	149.5	73%	0.727	78%	0.779	S	S	*	*			trans	-101.7	170	-158	39.6	-39.7	0	0	0	116.7
569	I	35.7	Very low	37	Very low	135 Å²	135	152.5 Å²	152.5	69%	0.692	78%	0.783	S	S	*	*			trans	-135.7	137.3	169.9	-60.1	-177.4	0	0	0	111.4
570	P	36.6	Very low	37	Very low	117 Å²	117	151.9 Å²	151.9	76%	0.76	79%	0.787	S	S	*	*			trans	-106.3	167.6	175.8	39.9	-34.2	0	0	0	114.2
571	Y	36.2	Very low	36.8	Very low	202 Å²	202	151.2 Å²	151.2	79%	0.792	79%	0.791	S	S	*	*			trans	-119.5	164.7	175.5	-120	-96	0	0	0	115.3	E635	Y571-E635 PolarHBondContact OH-OE1 2.7Å
572	R	34.3	Very low	36.8	Very low	246 Å²	246	155.7 Å²	155.7	93%	0.928	80%	0.799	S	S	*	*			trans	-142.9	135.3	-154.5	-172.2	-164.6	-161.6	-168.7	13.9	114.8
573	G	32.1	Very low	36.8	Very low	74 Å²	74	152.1 Å²	152.1	76%	0.763	80%	0.798	S	S	*	*			trans	-177.7	148.9	165.1	0	0	0	0	0	112.5
574	A	38.8	Very low	36.8	Very low	88 Å²	88	152.6 Å²	152.6	73%	0.727	80%	0.8	S	S	*	*			cis	-157.5	158.3	2.2	0	0	0	0	0	114
575	K	40.4	Very low	36.8	Very low	210 Å²	210	157.5 Å²	157.5	91%	0.913	81%	0.809	S	S	*	*			trans	71	135.8	155.4	-67.7	165.4	-176.7	177.4	0	120.4
576	R	34.8	Very low	37	Very low	224 Å²	224	155.4 Å²	155.4	85%	0.845	81%	0.808	S	S	*	*			trans	-119.2	165.4	169.3	-69.6	175.3	169.7	171.4	-4	108.9
577	M	44.3	Very low	37.3	Very low	182 Å²	182	157.7 Å²	157.7	90%	0.897	81%	0.812	S	S	*	*			trans	-139.4	155.8	144.3	-84.3	-57.2	174.8	0	0	110.9
578	P	39	Very low	37.5	Very low	126 Å²	126	153.6 Å²	153.6	82%	0.818	81%	0.809	S	S	*	*			trans	-107.6	-169.9	-166.9	42.2	-35.7	0	0	0	115.3
579	R	33.6	Very low	37.4	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.868	82%	0.815	S	S	*	*			trans	-94.9	143.6	-167.6	167.8	-171.5	-175.7	175.2	3.7	113.6
580	E	38.1	Very low	37.3	Very low	191 Å²	191	157.5 Å²	157.5	89%	0.893	83%	0.826	S	S	*	*			trans	-108.8	166.9	162.6	-65.8	-168.5	151.8	0	0	112.3
581	A	35	Very low	37.6	Very low	77 Å²	77	160.1 Å²	160.1	64%	0.636	83%	0.832	S	S	*	*			trans	-162.4	132.4	172.4	0	0	0	0	0	111.4
582	Y	37.5	Very low	37.7	Very low	240 Å²	240	155.6 Å²	155.6	94%	0.941	83%	0.827	S	S	*	*			trans	-161.5	146.4	158.1	-107.7	-73.6	0	0	0	110.9
583	G	39.6	Very low	37.7	Very low	75 Å²	75	155.6 Å²	155.6	77%	0.773	83%	0.827	S	S	*	*			trans	162.3	133	179.2	0	0	0	0	0	110.8
584	H	39.7	Very low	38.1	Very low	163 Å²	163	161.9 Å²	161.9	76%	0.755	84%	0.837	S	S	*	*			trans	-154.9	156.7	-156.8	-152	-59.5	0	0	0	113.6
585	R	36.1	Very low	37.9	Very low	226 Å²	226	163.4 Å²	163.4	85%	0.853	84%	0.842	S	S	*	*			trans	78.9	155.7	171.4	-50.3	173.4	-176.2	-164.7	-0.3	114
586	S	39	Very low	37.9	Very low	110 Å²	110	157.3 Å²	157.3	77%	0.769	84%	0.839	S	S	*	*			cis	-171.8	173.5	-23.1	-85.4	0	0	0	0	106.8
587	S	39.9	Very low	38.1	Very low	118 Å²	118	159 Å²	159	83%	0.825	85%	0.846	S	S	*	*			cis	-159.2	165.5	4.7	-145.2	0	0	0	0	111.5
588	G	37.2	Very low	37.7	Very low	79 Å²	79	154 Å²	154	81%	0.814	84%	0.84	S	S	*	*			trans	79.8	151.9	164.2	0	0	0	0	0	116.7
589	G	37.8	Very low	37.7	Very low	82 Å²	82	152.5 Å²	152.5	85%	0.845	83%	0.833	S	S	*	*			cis	-158.4	167.6	-5	0	0	0	0	0	111.5
590	R	33.8	Very low	37.9	Very low	247 Å²	247	152.5 Å²	152.5	93%	0.932	83%	0.833	S	S	*	*			trans	-117.9	141.4	-176.3	-65.2	-179	179.3	179.4	1	112.6
591	I	43.3	Very low	37.8	Very low	172 Å²	172	153.9 Å²	153.9	88%	0.882	83%	0.83	S	S	*	*			trans	-138.2	128.4	154.5	-57	-178.5	0	0	0	108.6
592	P	38.3	Very low	38.1	Very low	107 Å²	107	158.9 Å²	158.9	70%	0.695	84%	0.842	S	S	*	*			trans	-112.7	148	-176.4	38.6	-31.1	0	0	0	115.7
593	R	33.7	Very low	37.9	Very low	246 Å²	246	151.3 Å²	151.3	93%	0.928	84%	0.838	S	S	*	*			trans	40.2	125	147.5	-65.8	-178.8	173.8	172.8	-1.8	120.5
594	Q	40	Very low	37.7	Very low	206 Å²	206	151.5 Å²	151.5	96%	0.963	84%	0.839	S	S	*	*			trans	-126.4	159.8	139.1	-111.5	-176.5	8.6	0	0	110
595	S	35.7	Very low	37.6	Very low	121 Å²	121	149.9 Å²	149.9	85%	0.846	85%	0.847	S	S	*	*			trans	-134.3	132.2	179.6	66.8	0	0	0	0	112
596	G	39	Very low	37.6	Very low	82 Å²	82	142.4 Å²	142.4	85%	0.845	84%	0.839	S	S	*	*			trans	-110.7	139.4	169.4	0	0	0	0	0	111.7
597	R	39.3	Very low	37.4	Very low	259 Å²	259	148.8 Å²	148.8	98%	0.977	85%	0.847	S	S	*	*			trans	-113	135.7	173.3	-88	-179.1	163.9	-171.8	-3.3	110.4
598	G	36.7	Very low	37.3	Very low	76 Å²	76	150.6 Å²	150.6	78%	0.784	85%	0.847	S	S	*	*			trans	176.4	106.8	170.4	0	0	0	0	0	108.8
599	S	39.5	Very low	37.6	Very low	96 Å²	96	151.9 Å²	151.9	67%	0.671	84%	0.841	S	S	*	*			cis	111.4	114	17.9	-167.3	0	0	0	0	110.8
600	R	37.6	Very low	37.6	Very low	229 Å²	229	154.3 Å²	154.3	86%	0.864	84%	0.835	S	S	*	*			trans	74	155.2	173.5	-47.7	165.3	-167	-168.1	2.8	115
601	R	35.8	Very low	37.8	Very low	220 Å²	220	153.4 Å²	153.4	83%	0.83	83%	0.832	S	S	*	*			cis	-164.2	169.1	-26.9	-110.9	-170.1	179.7	-172.4	-0.5	107.1
602	M	40.5	Very low	37.5	Very low	182 Å²	182	151.2 Å²	151.2	90%	0.897	82%	0.821	S	S	*	*			trans	68.8	151.4	-178.2	-37.7	-49.8	-145.7	0	0	113.6
603	G	34.1	Very low	37.4	Very low	82 Å²	82	152.3 Å²	152.3	85%	0.845	82%	0.822	S	S	*	*			cis	143.7	98.2	-9.2	0	0	0	0	0	112.6
604	G	34.5	Very low	37.4	Very low	78 Å²	78	149 Å²	149	80%	0.804	82%	0.816	S	S	*	*			trans	173.6	145.6	176.2	0	0	0	0	0	112.7
605	S	38.5	Very low	37.4	Very low	130 Å²	130	146.7 Å²	146.7	91%	0.909	81%	0.809	S	S	*	*			trans	-77.6	158.1	170.4	-55.3	0	0	0	0	110.7
606	G	35.2	Very low	37.4	Very low	68 Å²	68	147.5 Å²	147.5	70%	0.701	80%	0.804	S	S	*	*			cis	121.6	96.1	-3.2	0	0	0	0	0	113.2
607	R	35.4	Very low	37.3	Very low	245 Å²	245	150.9 Å²	150.9	93%	0.925	80%	0.803	S	S	*	*			trans	-174.4	87.9	159.3	-102.9	178.7	-159.6	-151	5.8	109.9
608	D	36.8	Very low	37.3	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	80%	0.8	S	S	*	*			trans	-106.1	114.6	167.3	-68.4	-54	0	0	0	109.5	N610	D608-N610 PolarHBondContact O-N 3.41Å
609	P	44.4	Very low	37.3	Very low	107 Å²	107	146.3 Å²	146.3	70%	0.695	80%	0.795	S	S	*	*			trans	-81.6	80.8	176.1	33.2	-33.5	0	0	0	110.4	W611	P609-W611 VanDerWaalsContact C-N 3.3Å; P609-W611 PolarHBondContact O-N 3.49Å
610	N	38.5	Very low	37.1	Very low	133 Å²	133	146.7 Å²	146.7	71%	0.711	79%	0.79	S	S	*	*			trans	-72.1	76.7	-179.6	-173.1	8.7	0	0	0	112.7	D608 N612	D608-N610 PolarHBondContact O-N 3.41Å; N610-N612 VanDerWaalsContact C-N 3.25Å; N610-N612 PolarHBondContact O-N 2.88Å
611	W	36.8	Very low	37.3	Very low	228 Å²	228	142.2 Å²	142.2	86%	0.864	79%	0.788	S	S	*	*			trans	-70.2	68.2	176.5	-87.4	80.5	0	0	0	112.8	P609	P609-W611 VanDerWaalsContact C-N 3.3Å; P609-W611 PolarHBondContact O-N 3.49Å
612	N	38.2	Very low	37.7	Very low	125 Å²	125	136.2 Å²	136.2	67%	0.668	79%	0.785	S	S	*	*			trans	-159.3	49.5	164	-114.7	-49.2	0	0	0	114.6	N610	N610-N612 VanDerWaalsContact C-N 3.25Å; N610-N612 PolarHBondContact O-N 2.88Å
613	N	35.9	Very low	37.7	Very low	130 Å²	130	135 Å²	135	70%	0.695	78%	0.783	S	S	*	*	S	Bend	trans	-144.8	153.2	159.9	-87	-64.1	0	0	0	110.1
614	H	34	Very low	37.9	Very low	177 Å²	177	141 Å²	141	82%	0.819	78%	0.779	S	S	*	*	S	Bend	trans	66.8	75.4	-179.8	-45.8	-75.8	0	0	0	116.1
615	I	38.8	Very low	38.1	Very low	157 Å²	157	149 Å²	149	81%	0.805	79%	0.786	S	S	*	*	S	Bend	trans	-167.2	-36	148.9	-104.2	152.7	0	0	0	110.6	N617	I615-N617 PolarHBondContact O-N 2.94Å
616	N	35.4	Very low	38.1	Very low	138 Å²	138	154.9 Å²	154.9	74%	0.738	79%	0.788	S	S	*	*			trans	-73.6	44.6	-172.1	-68.1	-34	0	0	0	116
617	N	37.8	Very low	37.9	Very low	154 Å²	154	155.6 Å²	155.6	82%	0.824	80%	0.795	S	S	*	*			trans	-139	47.1	-178.6	-110.4	-6.2	0	0	0	113.6	I615	I615-N617 PolarHBondContact O-N 2.94Å
618	N	38.5	Very low	38	Very low	172 Å²	172	149.6 Å²	149.6	92%	0.92	79%	0.791	S	S	*	*	S	Bend	trans	-155.3	129.4	159.4	-92.5	-39.9	0	0	0	108.6
619	G	36.9	Very low	38.1	Very low	67 Å²	67	148.4 Å²	148.4	69%	0.691	78%	0.784	S	S	*	*			trans	138.3	-20.6	172.3	0	0	0	0	0	118	V621	G619-V621 VanDerWaalsContact C-N 3.28Å; G619-V621 PolarHBondContact O-N 3.27Å
620	D	36.9	Very low	37.8	Very low	103 Å²	103	150.6 Å²	150.6	55%	0.551	79%	0.79	S	S	*	*			trans	-73.9	72.9	177.8	-93.7	22.8	0	0	0	111.4	K384 R624	K384-D620 IonicContact NZ-OD1 3.07Å; K384-D620 PolarHBondContact NZ-OD1 3.08Å; D620-R624 IonicContact OD2-NH2 2.72Å; D620-R624 PolarHBondContact OD2-NH2 2.77Å
621	V	41.5	Very low	37.9	Very low	136 Å²	136	148.9 Å²	148.9	82%	0.824	79%	0.789	S	S	*	*			trans	-121.9	33.4	-179.8	-160.1	0	0	0	0	112.3	G619	G619-V621 VanDerWaalsContact C-N 3.28Å; G619-V621 PolarHBondContact O-N 3.27Å
622	A	43.1	Very low	38.1	Very low	94 Å²	94	145.2 Å²	145.2	78%	0.777	79%	0.786	S	S	*	*	S	Bend	trans	-157.7	70	172.9	0	0	0	0	0	112.6
623	D	41.2	Very low	38	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	79%	0.791	S	S	*	*			trans	-175.4	-8.1	154.3	-123.4	-20.5	0	0	0	115.7	R625	D623-R625 PolarHBondContact O-N 3.22Å
624	R	37	Very low	38.2	Very low	206 Å²	206	147.1 Å²	147.1	78%	0.777	80%	0.8	S	S	*	*			trans	-78.2	54.2	-173	-62.9	-172.3	-168.4	153.4	10.2	114.7	D620	D620-R624 IonicContact OD2-NH2 2.72Å; D620-R624 PolarHBondContact OD2-NH2 2.77Å
625	R	39.2	Very low	38.3	Very low	248 Å²	248	144.4 Å²	144.4	94%	0.936	79%	0.787	S	S	*	*			trans	-137.3	64.7	165.4	-74.7	-162.7	174.9	-163.8	-0.7	112.9	D623	D623-R625 PolarHBondContact O-N 3.22Å
626	R	38.3	Very low	38.3	Very low	252 Å²	252	141.4 Å²	141.4	95%	0.951	78%	0.781	S	S	*	*	S	Bend	trans	-132.2	114.4	156.8	-96.1	-169.8	176.4	-148	0.2	111
627	G	31.8	Very low	38.3	Very low	84 Å²	84	141.1 Å²	141.1	87%	0.866	78%	0.779	S	S	*	*			trans	92.3	79.3	160.3	0	0	0	0	0	117.4
628	S	38.2	Very low	38.4	Very low	118 Å²	118	141.5 Å²	141.5	83%	0.825	78%	0.781	S	S	*	*			trans	-153.4	149.3	137.1	-160.1	0	0	0	0	108.9
629	N	38.8	Very low	38.4	Very low	130 Å²	130	140.7 Å²	140.7	70%	0.695	78%	0.776	S	S	*	*			trans	-101.1	-174.1	173.8	-79.6	-20	0	0	0	110.3
630	D	38.4	Very low	38.6	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	77%	0.774	S	S	*	*			trans	84.6	136.3	167.1	-42.2	-24.1	0	0	0	114.4
631	S	40.3	Very low	38.6	Very low	98 Å²	98	145 Å²	145	69%	0.685	79%	0.789	S	S	*	*			cis	-167.2	165.1	-31.2	52.2	0	0	0	0	108.4
632	D	40.8	Very low	38.5	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	79%	0.786	S	S	*	*			trans	134.4	158.5	148.2	-63.7	-0.7	0	0	0	114.3
633	V	36	Very low	38.4	Very low	129 Å²	129	145.8 Å²	145.8	78%	0.782	79%	0.792	S	S	*	*			trans	-151.3	149.7	-154	170.3	0	0	0	0	110.8
634	L	40.2	Very low	38.4	Very low	167 Å²	167	142.9 Å²	142.9	87%	0.874	78%	0.784	S	S	*	*			trans	-166.2	173.2	143.5	-102.7	163.4	0	0	0	110.8
635	E	34.7	Very low	38.6	Very low	119 Å²	119	138 Å²	138	56%	0.556	78%	0.781	S	S	*	*			trans	-149.4	171.8	-142.2	-170.9	163.9	-123.3	0	0	114.5	Y571	Y571-E635 PolarHBondContact OH-OE1 2.7Å
636	S	39.2	Very low	38.7	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	78%	0.776	S	S	*	*			trans	127.2	99	151.2	-67.8	0	0	0	0	119.9
637	D	36.8	Very low	38.7	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	77%	0.773	S	S	*	*				39.1	129.3	127.5	-45.1	-40.9	0	0	0	124.1
638	N	37.9	Very low	39.1	Very low	161 Å²	161	133.4 Å²	133.4	86%	0.861	76%	0.762	S	S	*	*				-177.7	169.1	97.7	-95.7	-75.3	0	0	0	114.1
639	L	38.9	Very low	39.2	Very low	155 Å²	155	135.5 Å²	135.5	81%	0.812	76%	0.764	S	S	*	*			trans	-137.3	176.7	-173.5	-104.4	170.2	0	0	0	109.5
640	P	41.3	Very low	39.3	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	77%	0.765	S	S	*	*			cis	-157.5	-175	45.3	46.4	-23.5	0	0	0	120.8
641	D	37.8	Very low	39.2	Very low	160 Å²	160	129.7 Å²	129.7	86%	0.856	76%	0.763	S	S	*	*			trans	66.3	135.6	147.7	-66	-23.1	0	0	0	125.1
642	G	38.3	Very low	39.2	Very low	75 Å²	75	134.3 Å²	134.3	77%	0.773	77%	0.771	S	S	*	*			trans	162.9	75.3	167.7	0	0	0	0	0	118.6
643	L	42.3	Very low	39.1	Very low	171 Å²	171	135.1 Å²	135.1	90%	0.895	77%	0.769	S	S	*	*			trans	7	151.3	148.3	-58	178.4	0	0	0	121.3
644	S	40.6	Very low	39.2	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	77%	0.772	S	S	*	*			cis	-172.5	136.8	-2.1	48.2	0	0	0	0	114.7
645	S	40.6	Very low	38.9	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	77%	0.771	S	S	*	*			trans	52.8	128.3	132.9	69.6	0	0	0	0	125.2
646	E	40.8	Very low	39.1	Very low	177 Å²	177	141.6 Å²	141.6	83%	0.827	79%	0.786	S	S	*	*				-174.3	135.5	100.4	-88.2	-166.9	124	0	0	108.4
647	R	38.4	Very low	38.9	Very low	234 Å²	234	140 Å²	140	88%	0.883	79%	0.785	S	S	*	*				71.8	138.3	57.7	-80.6	-172.3	165.2	172.4	-2.8	114.3
648	A	42	Very low	38.6	Very low	78 Å²	78	144.7 Å²	144.7	65%	0.645	79%	0.792	S	S	*	*			cis	-159.6	160.5	-16.1	0	0	0	0	0	107.6
649	N	40.3	Very low	38.3	Very low	161 Å²	161	145.5 Å²	145.5	86%	0.861	79%	0.791	S	S	*	*				148.7	168.9	79.7	-117	-4.8	0	0	0	106.7
650	A	39.4	Very low	38.2	Very low	87 Å²	87	143.9 Å²	143.9	72%	0.719	79%	0.792	S	S	*	*			cis	-169.7	138.6	-48.2	0	0	0	0	0	111.2
651	G	36.6	Very low	38.2	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	80%	0.8	S	S	*	*			trans	88.9	160.9	162.1	0	0	0	0	0	117.3
652	K	40.8	Very low	37.9	Very low	195 Å²	195	141.9 Å²	141.9	85%	0.848	80%	0.795	S	S	*	*			cis	-150	162.2	-6.3	-100.5	-179.8	-175.3	173.9	0	110.6
653	H	38.1	Very low	38.2	Very low	167 Å²	167	144.3 Å²	144.3	77%	0.773	80%	0.798	S	S	*	*			trans	-17.8	145.2	165.2	-47.3	-81.2	0	0	0	116.7
654	N	39.4	Very low	37.9	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	80%	0.798	S	S	*	*				-159	172.6	61	-141.5	-14	0	0	0	116.1
655	R	32.6	Very low	37.5	Very low	222 Å²	222	143 Å²	143	84%	0.838	80%	0.801	S	S	*	*			trans	-79.4	150.7	175.4	-60.8	172.9	176.2	164.3	-1.9	111.8
656	I	40.1	Very low	37.2	Very low	171 Å²	171	148 Å²	148	88%	0.877	81%	0.81	S	S	*	*				174.7	140.2	119.4	-90.8	155.5	0	0	0	111.4
657	G	33.1	Very low	37	Very low	62 Å²	62	150.3 Å²	150.3	64%	0.639	81%	0.813	S	S	*	*			trans	81.3	96	135.6	0	0	0	0	0	122
658	R	32.1	Very low	37	Very low	230 Å²	230	143.3 Å²	143.3	87%	0.868	80%	0.8	S	S	*	*			trans	62.7	128.7	135.1	-64	-174.1	176.1	-155.3	-1.3	121.4
659	H	31.7	Very low	36.8	Very low	178 Å²	178	144.7 Å²	144.7	82%	0.824	80%	0.796	S	S	*	*			trans	24.9	129.5	138.7	-48.6	-76.6	0	0	0	120.8
660	S	35.6	Very low	36.7	Very low	120 Å²	120	147 Å²	147	84%	0.839	79%	0.793	S	S	*	*			trans	-138.3	155.7	149	-75.9	0	0	0	0	110.9
661	P	41.6	Very low	36.9	Very low	127 Å²	127	152.5 Å²	152.5	83%	0.825	80%	0.804	S	S	*	*			trans	-113.9	-170.9	-168	32.8	-13.4	0	0	0	113.1
662	A	32.2	Very low	36.9	Very low	92 Å²	92	161 Å²	161	76%	0.76	81%	0.812	S	S	*	*			trans	-68	149.7	175.7	0	0	0	0	0	112.9
663	P	44.6	Very low	37.1	Very low	127 Å²	127	155.5 Å²	155.5	83%	0.825	81%	0.811	S	S	*	*			trans	-85.9	142.4	173.8	34.5	-33.1	0	0	0	111.9
664	N	35	Very low	37.3	Very low	167 Å²	167	154.9 Å²	154.9	89%	0.893	81%	0.813	S	S	*	*			trans	-143.9	146.4	150.6	-139	-5.2	0	0	0	107.8
665	G	32.4	Very low	37.4	Very low	71 Å²	71	155.7 Å²	155.7	73%	0.732	81%	0.812	S	S	*	*			trans	-67.3	167.4	-152.2	0	0	0	0	0	117.7
666	F	35.3	Very low	38	Very low	208 Å²	208	149.7 Å²	149.7	91%	0.912	80%	0.804	S	S	*	*			trans	-135.8	129.6	168.3	-121.8	-99.2	0	0	0	110.6
667	Y	36	Very low	38.2	Very low	226 Å²	226	149.8 Å²	149.8	89%	0.886	80%	0.801	S	S	*	*			trans	-78.3	150.8	156	-90.8	-103.6	0	0	0	108.8
668	S	37.6	Very low	38.6	Very low	87 Å²	87	153.7 Å²	153.7	61%	0.608	81%	0.807	S	S	*	*				-174.6	165.5	121	62.1	0	0	0	0	112.6
669	D	39.4	Very low	39.2	Very low	108 Å²	108	147.7 Å²	147.7	58%	0.578	80%	0.796	S	S	*	*			trans	73.1	143.6	149.9	-62	-41.6	0	0	0	119.8
670	R	36.3	Very low	39.8	Very low	209 Å²	209	146.6 Å²	146.6	79%	0.789	80%	0.796	S	S	*	*			cis	-177.1	139.8	-24.8	-121.4	175.2	-177	124.5	-11.3	106
671	E	45.1	Very low	40.2	Very low	203 Å²	203	147.6 Å²	147.6	95%	0.949	79%	0.792	S	S	*	*			trans	-173.2	179.1	138.4	-110.6	165	-162.1	0	0	113
672	R	35.2	Very low	40.5	Very low	253 Å²	253	146.2 Å²	146.2	96%	0.955	78%	0.782	S	S	*	*			trans	-114.9	152.4	-169.9	-63.1	174	176.6	161.2	-4.2	111.8
673	G	46.8	Very low	41	Very low	79 Å²	79	148.8 Å²	148.8	81%	0.814	78%	0.783	S	S	*	*			trans	-146.6	157.7	163.4	0	0	0	0	0	108.5
674	D	41.1	Very low	40.9	Very low	154 Å²	154	149.1 Å²	149.1	82%	0.824	78%	0.778	S	S	*	*			trans	-136.5	173.2	-161.2	-144.3	-28.3	0	0	0	112.1
675	E	42.4	Very low	41.4	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	77%	0.769	S	S	*	*			trans	68.1	147.6	167.5	-62.3	174.2	165.2	0	0	116.9
676	S	44.3	Very low	42	Very low	95 Å²	95	150.6 Å²	150.6	66%	0.664	76%	0.764	S	S	*	*			cis	-166.1	-178.6	-13.1	51.6	0	0	0	0	110.7
677	E	44.1	Very low	42.4	Very low	174 Å²	174	145.8 Å²	145.8	81%	0.813	75%	0.749	S	S	*	*			trans	68.3	119.4	167.4	-65.8	-178.1	-178.2	0	0	116.2
678	D	41.9	Very low	42.7	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	75%	0.745	S	S	*	*			cis	111.9	148.2	50	-95.9	-8.8	0	0	0	109.3
679	T	44.6	Very low	43.1	Very low	104 Å²	104	145 Å²	145	64%	0.638	75%	0.75	S	S	*	*			cis	-153.8	149.3	3.7	8	0	0	0	0	111
680	L	43.7	Very low	43.1	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	76%	0.764	S	S	*	*			trans	60	153.9	150	-57.3	167.1	0	0	0	119.1
681	N	44.7	Very low	43.3	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	77%	0.765	S	S	*	*			cis	-148.6	155.2	3.3	-147.4	24.7	0	0	0	109.9
682	P	47.3	Very low	43.1	Very low	97 Å²	97	137.7 Å²	137.7	63%	0.63	76%	0.761	S	S	*	*			trans	-102.3	179.7	-173.2	40.6	-35.2	0	0	0	114.2
683	N	43.4	Very low	43.4	Very low	146 Å²	146	129.5 Å²	129.5	78%	0.781	75%	0.748	S	S	*	*			trans	-171.6	141.6	131.3	-96.9	-23	0	0	0	114.1
684	N	42.9	Very low	43.1	Very low	135 Å²	135	131.2 Å²	131.2	72%	0.722	75%	0.747	S	S	*	*			trans	57.8	150.9	158.7	-69.7	19.2	0	0	0	122
685	E	44.5	Very low	43.3	Very low	147 Å²	147	128 Å²	128	69%	0.687	74%	0.736	S	S	*	*			cis	-176.2	164.6	-41.1	-127.9	-170.7	-161.5	0	0	109.9
686	N	45.7	Very low	43.4	Very low	121 Å²	121	127.6 Å²	127.6	65%	0.647	73%	0.734	S	S	*	*			trans	69.2	140.5	162.1	-67	-59.4	0	0	0	119.6
687	N	42.7	Very low	43.3	Very low	108 Å²	108	130.6 Å²	130.6	58%	0.578	74%	0.743	S	S	*	*			cis	-165.6	168	-26.6	-143.5	-37.8	0	0	0	112.1
688	F	42.4	Very low	43.1	Very low	183 Å²	183	126.1 Å²	126.1	80%	0.803	74%	0.743	S	S	*	*			trans	71.5	120.3	162.7	-64.4	-63.2	0	0	0	122
689	P	46.4	Very low	42.9	Very low	112 Å²	112	123.2 Å²	123.2	73%	0.727	75%	0.748	S	S	*	*			trans	-118.1	-164.5	171.1	43.1	-32.5	0	0	0	114.2
690	C	40.1	Very low	42.3	Very low	128 Å²	128	122 Å²	122	87%	0.865	76%	0.755	S	S	*	*			trans	84.7	141.4	165.1	-62.5	0	0	0	0	119.2
691	G	40.8	Very low	42	Very low	79 Å²	79	121 Å²	121	81%	0.814	76%	0.76	S	S	*	*			trans	160.8	76.3	-179.5	0	0	0	0	0	112.6
692	D	39.9	Very low	41.5	Very low	160 Å²	160	119.8 Å²	119.8	86%	0.856	76%	0.763	S	S	*	*			trans	-81.9	166.7	-172.9	-85.1	-61.2	0	0	0	116.1
693	A	41.7	Very low	41.2	Very low	82 Å²	82	121.7 Å²	121.7	68%	0.678	77%	0.772	S	S	*	*			trans	108.1	124.5	136.4	0	0	0	0	0	120.7
694	S	41	Very low	40.8	Very low	114 Å²	114	121.1 Å²	121.1	80%	0.797	77%	0.769	S	S	*	*			trans	63.8	147.2	141.8	52.2	0	0	0	0	120.9
695	S	44.8	Very low	40.5	Very low	87 Å²	87	121.8 Å²	121.8	61%	0.608	77%	0.773	S	S	*	*			cis	-164.1	165.9	-18.6	53	0	0	0	0	111.4
696	E	43.9	Very low	40.1	Very low	167 Å²	167	124.1 Å²	124.1	78%	0.78	79%	0.786	S	S	*	*			trans	74.3	139.9	149	-74.1	149.7	145.2	0	0	123.7
697	D	43.4	Very low	39.8	Very low	159 Å²	159	129.2 Å²	129.2	85%	0.85	80%	0.796	S	S	*	*			trans	60.5	101.9	146.2	-67.7	6.3	0	0	0	123.5
698	G	39.4	Very low	39.4	Very low	79 Å²	79	129.1 Å²	129.1	81%	0.814	80%	0.804	S	S	*	*				121.9	145.8	86.4	0	0	0	0	0	118.6
699	G	37.3	Very low	39.1	Very low	84 Å²	84	132 Å²	132	87%	0.866	81%	0.81	S	S	*	*			trans	97.6	85.8	159.6	0	0	0	0	0	117.4
700	G	32.4	Very low	38.8	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	82%	0.815	S	S	*	*			trans	-89.2	139.1	161.2	0	0	0	0	0	111.9
701	C	37.4	Very low	38.7	Very low	135 Å²	135	134.7 Å²	134.7	91%	0.912	81%	0.808	S	S	*	*			trans	-146.9	138.6	170.3	-88.5	0	0	0	0	111.1
702	S	34.4	Very low	38.6	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	81%	0.807	S	S	*	*			trans	-104.1	135.6	173.4	178.7	0	0	0	0	110.2
703	V	41.5	Very low	38.5	Very low	137 Å²	137	142 Å²	142	83%	0.83	81%	0.806	S	S	*	*			trans	-150	142.4	162.6	-146.4	0	0	0	0	111.6
704	D	34.4	Very low	38.4	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	81%	0.81	S	S	*	*			trans	-75.4	179.8	176.3	-59.2	-90.3	0	0	0	115.4
705	N	35.8	Very low	38.1	Very low	150 Å²	150	147.3 Å²	147.3	80%	0.802	81%	0.812	S	S	*	*			trans	72.1	103.6	157.4	-69.7	-65.6	0	0	0	118.6
706	M	37.5	Very low	37.7	Very low	196 Å²	196	149 Å²	149	97%	0.966	82%	0.824	S	S	*	*			trans	-108.4	115.1	144.2	-71	-159.3	-172.4	0	0	110.9
707	R	37.9	Very low	37.2	Very low	228 Å²	228	152.2 Å²	152.2	86%	0.86	83%	0.829	S	S	*	*			trans	-111	126.1	158.9	-96	-171.5	169.4	-146	-2.2	109.3
708	S	35.7	Very low	36.9	Very low	105 Å²	105	156.7 Å²	156.7	73%	0.734	83%	0.834	S	S	*	*			trans	15	118.7	154.8	60.7	0	0	0	0	118.6
709	R	36.5	Very low	36.6	Very low	245 Å²	245	160.7 Å²	160.7	93%	0.925	84%	0.837	S	S	*	*			trans	-126	112.8	153	-76.1	-170.6	171.9	-170.8	-1.3	110.5
710	L	38.2	Very low	36.7	Very low	161 Å²	161	162.5 Å²	162.5	84%	0.843	84%	0.836	S	S	*	*			trans	-65	137.9	158.8	-90.3	70.1	0	0	0	108.3
711	N	38.1	Very low	37	Very low	135 Å²	135	168.7 Å²	168.7	72%	0.722	84%	0.841	S	S	*	*			trans	-98	121.1	174.5	-146.7	4.9	0	0	0	109.8
712	K	39.1	Very low	37.2	Very low	183 Å²	183	168.2 Å²	168.2	80%	0.796	84%	0.839	S	S	*	*			trans	-111.3	107.7	173.1	-78.4	-172.5	175.8	-176.8	0	109.1	V714	K712-V714 PolarHBondContact O-N 2.98Å
713	Y	37.7	Very low	37.4	Very low	208 Å²	208	174.1 Å²	174.1	82%	0.816	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-75.4	122.9	171	-91.5	-88.6	0	0	0	110.8
714	V	39.2	Very low	37.6	Very low	129 Å²	129	173.1 Å²	173.1	78%	0.782	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-102.3	141.6	175.7	176.3	0	0	0	0	109.1	K712	K712-V714 PolarHBondContact O-N 2.98Å
715	H	36.3	Very low	38.3	Very low	180 Å²	180	172.9 Å²	172.9	83%	0.833	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-64.2	143.7	178.4	-67.9	9.2	0	0	0	112.7
716	S	36.3	Very low	38.3	Very low	122 Å²	122	177.4 Å²	177.4	85%	0.853	85%	0.851	S	S	*	*			trans	-142.2	128	153.4	-168.3	0	0	0	0	110
717	R	32.5	Very low	38.5	Very low	234 Å²	234	180.1 Å²	180.1	88%	0.883	85%	0.851	S	S	*	*			trans	-101.1	143.7	177.4	-71.9	177.7	170.3	178.8	-3.8	109.9
718	R	37.2	Very low	38.5	Very low	254 Å²	254	173.7 Å²	173.7	96%	0.958	84%	0.841	S	S	*	*			trans	-154.8	151.2	144.8	-111	163.5	-166	-152.6	1.1	111.9
719	N	33.2	Very low	38.8	Very low	163 Å²	163	175.7 Å²	175.7	87%	0.872	84%	0.838	S	S	*	*			trans	-94.5	147.9	-171.3	-78.9	-31.9	0	0	0	112.8
720	S	39.4	Very low	39	Very low	121 Å²	121	171 Å²	171	85%	0.846	83%	0.827	S	S	*	*			trans	-154.4	98.9	145.2	55.3	0	0	0	0	113.6
721	K	39.8	Very low	39.1	Very low	208 Å²	208	170 Å²	170	90%	0.904	82%	0.822	S	S	*	*			trans	-23.2	139.6	164.6	-52.4	161.8	-179.9	174.7	0	118.3
722	S	41.6	Very low	39	Very low	125 Å²	125	173.9 Å²	173.9	87%	0.874	83%	0.827	S	S	*	*			trans	-161.8	176.3	130.7	60.3	0	0	0	0	110.8
723	R	37.6	Very low	39	Very low	239 Å²	239	170.6 Å²	170.6	90%	0.902	82%	0.824	S	S	*	*			trans	-110	150.9	-162.2	-81.6	175.8	159.2	-174.3	-5.7	114.8
724	P	46.2	Very low	39	Very low	116 Å²	116	168.5 Å²	168.5	75%	0.753	82%	0.822	S	S	*	*			trans	-99.8	172.5	161.6	40.2	-34.3	0	0	0	113
725	P	49.5	Very low	38.9	Very low	128 Å²	128	170 Å²	170	83%	0.831	83%	0.826	S	S	*	*			trans	-117	155.4	154.5	36.6	-26.5	0	0	0	113.3
726	R	35.2	Very low	38.7	Very low	245 Å²	245	165.8 Å²	165.8	93%	0.925	82%	0.816	S	S	*	*			trans	-96.2	159.4	172	-67.2	173.9	169.2	177.5	-5.9	111.3
727	R	40.4	Very low	38.7	Very low	254 Å²	254	165.6 Å²	165.6	96%	0.958	81%	0.806	S	S	*	*			trans	-141	167.5	139.5	-102.5	-179.5	-176.6	-168.4	-0.8	110.4
728	S	38	Very low	38.8	Very low	93 Å²	93	162.6 Å²	162.6	65%	0.65	80%	0.802	S	S	*	*			trans	-136.7	-168.4	-157	48.5	0	0	0	0	112.8
729	H	42	Very low	38.7	Very low	147 Å²	147	161.4 Å²	161.4	68%	0.681	80%	0.797	S	S	*	*			trans	93.9	109.6	177.6	-57.5	-77.1	0	0	0	113.1
730	Q	41.9	Very low	38.6	Very low	147 Å²	147	161 Å²	161	69%	0.687	80%	0.795	S	S	*	*				86.1	139.4	77.6	-81.7	-169.4	-87.5	0	0	111.2
731	D	40.4	Very low	38.5	Very low	139 Å²	139	160.8 Å²	160.8	74%	0.743	79%	0.789	S	S	*	*			cis	-142.1	-174.2	6.7	-93.9	-40.8	0	0	0	112.3
732	R	35.1	Very low	38.2	Very low	216 Å²	216	157.6 Å²	157.6	82%	0.815	78%	0.782	S	S	*	*			trans	-130	137.1	177.3	-160.5	-168.1	-166.7	-170.9	5.3	109.4
733	P	40.6	Very low	37.8	Very low	114 Å²	114	157 Å²	157	74%	0.74	78%	0.776	S	S	*	*				-139.5	153.2	107.4	40.1	-27.8	0	0	0	111.1
734	Q	36.8	Very low	37.5	Very low	164 Å²	164	153.2 Å²	153.2	77%	0.766	77%	0.769	S	S	*	*				53.8	100.3	66.8	-101.3	-173.4	-30.4	0	0	114.7
735	N	36.1	Very low	37	Very low	161 Å²	161	156.7 Å²	156.7	86%	0.861	77%	0.772	S	S	*	*			trans	-151	168.6	138.7	-135.7	21.9	0	0	0	110.4
736	S	33	Very low	36.4	Very low	91 Å²	91	157.1 Å²	157.1	64%	0.636	77%	0.768	S	S	*	*			trans	-93.2	-161.6	-174.2	56.7	0	0	0	0	113.7
737	D	37.2	Very low	36.3	Very low	118 Å²	118	152.4 Å²	152.4	63%	0.631	76%	0.761	S	S	*	*			trans	95.2	99.3	169.4	-48.2	-0.7	0	0	0	111.2
738	Q	33.5	Very low	36.3	Very low	171 Å²	171	147 Å²	147	80%	0.799	76%	0.756	S	S	*	*			cis	68.4	73.3	39.5	-158.7	-173.3	14.4	0	0	114.1
739	W	35.1	Very low	36.2	Very low	229 Å²	229	149 Å²	149	87%	0.867	76%	0.759	S	S	*	*			trans	-127.6	105.8	160	-70.4	-29.3	0	0	0	111.3
740	D	31.3	Very low	36	Very low	154 Å²	154	147.9 Å²	147.9	82%	0.824	77%	0.768	S	S	*	*			trans	-75.6	118.3	155	-73.3	-68	0	0	0	108.7
741	T	37.8	Very low	35.7	Very low	118 Å²	118	145.7 Å²	145.7	72%	0.724	77%	0.769	S	S	*	*			trans	-129.6	92.7	166.9	53.4	0	0	0	0	110.8
742	N	32.5	Very low	35.7	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	78%	0.78	S	S	*	*			trans	-66.3	122.9	170.1	179.4	18.1	0	0	0	110.4
743	C	34.6	Very low	35.8	Very low	111 Å²	111	141.1 Å²	141.1	75%	0.75	78%	0.778	S	S	*	*			trans	-126.5	93.1	179.3	-81.6	0	0	0	0	111.4
744	Q	31	Very low	35.5	Very low	161 Å²	161	141.7 Å²	141.7	75%	0.752	78%	0.784	S	S	*	*			trans	-86.4	113.9	167.3	-67.6	178.9	-17	0	0	110.6
745	F	35.3	Very low	35.6	Very low	188 Å²	188	143.5 Å²	143.5	83%	0.825	79%	0.793	S	S	*	*			trans	-161.2	142.7	158	-75.2	-58	0	0	0	107.4
746	N	37.5	Very low	35.5	Very low	137 Å²	137	145.2 Å²	145.2	73%	0.733	79%	0.792	S	S	*	*			cis	-151.4	154.4	-4	-126.3	-24.4	0	0	0	109.6
747	N	32.3	Very low	35.7	Very low	146 Å²	146	148.8 Å²	148.8	78%	0.781	80%	0.804	S	S	*	*			trans	-72.3	148.9	169	-77.6	-15.1	0	0	0	110.9
748	V	40.7	Very low	35.6	Very low	140 Å²	140	153.7 Å²	153.7	85%	0.848	81%	0.813	S	S	*	*			trans	-134	117.6	155.8	-176.7	0	0	0	0	107.9
749	D	35	Very low	35.5	Very low	135 Å²	135	151.2 Å²	151.2	72%	0.722	81%	0.814	S	S	*	*			trans	-71.3	152.7	-179.8	-81.8	-71.4	0	0	0	113.1
750	S	38.5	Very low	35.5	Very low	125 Å²	125	145.4 Å²	145.4	87%	0.874	82%	0.815	S	S	*	*			trans	-151.5	66.9	163.3	-76.6	0	0	0	0	109.9
751	S	36.3	Very low	35.5	Very low	100 Å²	100	142 Å²	142	70%	0.699	82%	0.817	S	S	*	*			trans	-74	138.8	178	61	0	0	0	0	112.7
752	L	40.1	Very low	35.3	Very low	185 Å²	185	139.5 Å²	139.5	97%	0.969	82%	0.815	S	S	*	*			trans	-174.6	153.4	142.2	-103.3	161	0	0	0	110.7
753	G	35.9	Very low	35.3	Very low	75 Å²	75	140.6 Å²	140.6	77%	0.773	82%	0.821	S	S	*	*			trans	101.9	32.6	159.1	0	0	0	0	0	120
754	S	35.1	Very low	35.3	Very low	125 Å²	125	146.4 Å²	146.4	87%	0.874	83%	0.828	S	S	*	*			trans	-81	119.1	167.3	-80.7	0	0	0	0	113
755	Q	38.6	Very low	35.4	Very low	203 Å²	203	144.3 Å²	144.3	95%	0.949	83%	0.831	S	S	*	*			trans	-133.1	153.4	154.5	-78.4	-158.5	-6.7	0	0	111.3
756	K	34.7	Very low	35.5	Very low	196 Å²	196	140.1 Å²	140.1	85%	0.852	83%	0.832	S	S	*	*			trans	-150	91.9	-149.5	-176.4	-178.5	-179.1	175.5	0	113.3
757	L	36.8	Very low	35.3	Very low	167 Å²	167	143.6 Å²	143.6	87%	0.874	83%	0.834	S	S	*	*			trans	-135.2	107	168	-69.3	172.1	0	0	0	108
758	R	34.7	Very low	35.4	Very low	221 Å²	221	143 Å²	143	83%	0.834	83%	0.827	S	S	*	*				73.3	77.5	78	-77.6	-164.5	168.8	-149.1	-0.8	115.1
759	S	31.4	Very low	35.1	Very low	118 Å²	118	143.5 Å²	143.5	83%	0.825	82%	0.82	S	S	*	*				39	93.7	128.2	62.4	0	0	0	0	119.7
760	A	36.3	Very low	35.2	Very low	107 Å²	107	139.1 Å²	139.1	88%	0.884	80%	0.8	S	S	*	*			trans	-146.8	150.2	135.8	0	0	0	0	0	106.5
761	G	30.7	Very low	35	Very low	84 Å²	84	139.3 Å²	139.3	87%	0.866	80%	0.795	S	S	*	*			cis	120.4	66.1	12.5	0	0	0	0	0	110.2
762	G	32.9	Very low	34.9	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	78%	0.782	S	S	*	*			trans	-177.5	120.4	-178.2	0	0	0	0	0	113.3
763	N	32.8	Very low	34.7	Very low	164 Å²	164	135 Å²	135	88%	0.877	77%	0.766	S	S	*	*			trans	-78.2	135.7	173.8	-62.1	-36.2	0	0	0	110.1
764	Y	34.7	Very low	34.6	Very low	233 Å²	233	134.8 Å²	134.8	91%	0.914	75%	0.75	S	S	*	*			trans	-132.6	120.7	163.6	-86.3	-78.2	0	0	0	111.9
765	S	34.2	Very low	34.5	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	74%	0.735	S	S	*	*			trans	-85.5	120.6	177.5	177.6	0	0	0	0	110.4	R767	S765-R767 PolarHBondContact O-N 3.35Å
766	A	35.7	Very low	34.2	Very low	101 Å²	101	131.6 Å²	131.6	84%	0.835	72%	0.716	S	S	*	*			trans	-76	89.8	177.6	0	0	0	0	0	111.6	Q768	A766-Q768 PolarHBondContact O-N 3.07Å
767	R	33.2	Very low	34	Very low	210 Å²	210	135 Å²	135	79%	0.792	74%	0.735	S	S	*	*			trans	-83.9	82.5	-178.2	-166.1	-177.8	-167.2	-175.8	4	111.5	S765 Q769	S765-R767 PolarHBondContact O-N 3.35Å; R767-Q769 PolarHBondContact O-N 3.34Å
768	Q	36.1	Very low	33.9	Very low	133 Å²	133	133.5 Å²	133.5	62%	0.621	73%	0.728	S	S	*	*			trans	-64.3	119.2	167.8	-74.9	-164.5	0.4	0	0	110.2	A766	A766-Q768 PolarHBondContact O-N 3.07Å
769	Q	34.3	Very low	33.8	Very low	151 Å²	151	128.8 Å²	128.8	71%	0.706	72%	0.723	S	S	*	*			trans	-94.8	111.3	167.6	-75.2	178.7	-50.6	0	0	109.9	R767	R767-Q769 PolarHBondContact O-N 3.34Å
770	S	35.8	Very low	33.9	Very low	42 Å²	42	129.4 Å²	129.4	29%	0.294	72%	0.717	S	S	.	*			trans	-83.6	123.2	160.4	63.6	0	0	0	0	109.4	G271 Q772	G271-S770 PolarHBondContact N-OG 3.05Å; G271-S770 VanDerWaalsContact O-CB 3.22Å; G271-S770 WeakPolarHBondContact O-CB 3.17Å; G271-S770 PolarHBondContact O-OG 3.22Å; G271-S770 VanDerWaalsContact O-OG 3.11Å; S770-Q772 PolarHBondContact O-N 3.32Å
771	V	34.8	Very low	33.8	Very low	129 Å²	129	130.8 Å²	130.8	78%	0.782	71%	0.707	S	S	*	*			trans	-79	106	164.2	179.3	0	0	0	0	107.2	V773	V771-V773 HydrophobicContact CG1-CG2 4.32Å
772	Q	33.8	Very low	34	Very low	88 Å²	88	133.7 Å²	133.7	41%	0.411	70%	0.697	S	S	.	*			trans	-86.4	125.6	155.3	-90.6	-164.7	-21.1	0	0	108.2	G270 S770	G270-Q772 VanDerWaalsContact CA-CD 3.43Å; S770-Q772 PolarHBondContact O-N 3.32Å
773	V	36.6	Very low	34.1	Very low	106 Å²	106	138.3 Å²	138.3	64%	0.642	70%	0.699	S	S	*	*			trans	-86.8	110.4	156.6	-177.5	0	0	0	0	105.9	V771 Y775	V771-V773 HydrophobicContact CG1-CG2 4.32Å; V773-Y775 HydrophobicContact CG1-CD2 3.87Å; V773-Y775 HydrophobicContact CG1-CE2 3.59Å
774	V	34.4	Very low	34.2	Very low	71 Å²	71	136.4 Å²	136.4	43%	0.43	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-84.3	122	167.6	175.7	0	0	0	0	106.6	Q776	V774-Q776 HydrophobicContact CG1-CG 4.12Å
775	Y	32.9	Very low	34.1	Very low	143 Å²	143	129 Å²	129	56%	0.561	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-93	127.2	156.5	-81.5	-93.3	0	0	0	107.3	N34 V773	N34-Y775 PolarHBondContact OD1-OH 3.21Å; V773-Y775 HydrophobicContact CG1-CD2 3.87Å; V773-Y775 HydrophobicContact CG1-CE2 3.59Å
776	Q	31.5	Very low	34.1	Very low	118 Å²	118	130.1 Å²	130.1	55%	0.551	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-103.6	134.7	164.4	-82.6	175.1	-98.9	0	0	107.4	V266 V774	V266-Q776 HydrophobicContact CG1-CG 4.12Å; V774-Q776 HydrophobicContact CG1-CG 4.12Å
777	E	30.4	Very low	34	Very low	269 Å²	269	132.7 Å²	132.7	100%	1.257	64%	0.641	S	S	*	*			trans	67.6	0	-178.6	-50.9	-163.1	135.6	0	0	116

Retrieved 777 of 777 residues in 719 ms (Link to these results)

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