Complet list of 1klr con file
Complete list of 1klr.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 127
C A 0001 LYS C 2.459 C A 0002 THR CA
C A 0001 LYS C 3.452 C A 0002 THR C
C A 0001 LYS C 3.488 C A 0002 THR CB
C A 0002 THR C 2.439 C A 0003 TYR CA
C A 0002 THR C 3.429 C A 0003 TYR C
C A 0002 THR C 3.507 C A 0003 TYR CB
C A 0002 THR C 3.619 C A 0003 TYR CG
C A 0003 TYR C 2.447 C A 0004 GLN CA
C A 0003 TYR C 3.525 C A 0004 GLN C
C A 0003 TYR C 3.432 C A 0004 GLN CB
C A 0003 TYR CD2 3.574 C A 0014 ASP C
C A 0003 TYR CB 3.166 H A 0018 LEU CD2
C A 0004 GLN C 2.445 C A 0005 CYS CA
C A 0004 GLN C 3.245 C A 0005 CYS C
C A 0004 GLN C 3.598 C A 0005 CYS CB
C A 0005 CYS C 2.437 C A 0006 GLN CA
C A 0005 CYS C 3.405 C A 0006 GLN C
C A 0005 CYS C 3.551 C A 0006 GLN CB
C A 0005 CYS C 3.585 C A 0006 GLN CG
C A 0005 CYS C 3.447 C A 0006 GLN CD
C A 0005 CYS CB 3.594 C A 0010 PHE CB
C A 0006 GLN C 2.454 C A 0007 TYR CA
C A 0006 GLN C 3.567 C A 0007 TYR C
C A 0006 GLN C 3.340 C A 0007 TYR CB
C A 0006 GLN C 3.222 C A 0007 TYR CG
C A 0006 GLN C 3.799 C A 0007 TYR CD1
C A 0006 GLN C 3.393 C A 0007 TYR CD2
C A 0007 TYR C 2.462 C A 0008 CYS CA
C A 0007 TYR C 3.557 C A 0008 CYS C
C A 0007 TYR C 3.449 C A 0008 CYS CB
C A 0007 TYR CE2 3.334 H A 0022 ILE CG2
C A 0007 TYR CB 3.478 H A 0026 HIS CG
C A 0007 TYR CB 3.273 H A 0026 HIS CD2
C A 0007 TYR CB 3.330 H A 0026 HIS CE1
C A 0007 TYR CG 3.640 H A 0026 HIS CG
C A 0007 TYR CG 3.526 H A 0026 HIS CD2
C A 0007 TYR CD2 3.597 H A 0026 HIS CD2
C A 0008 CYS C 2.450 C A 0009 GLU CA
C A 0008 CYS C 3.362 C A 0009 GLU C
C A 0008 CYS C 3.588 C A 0009 GLU CB
C A 0009 GLU C 2.444 C A 0010 PHE CA
C A 0009 GLU C 3.361 C A 0010 PHE C
C A 0009 GLU C 3.578 C A 0010 PHE CB
C A 0010 PHE CA 3.775 C A 0011 ARG CA
C A 0010 PHE C 2.432 C A 0011 ARG CA
C A 0010 PHE C 3.418 C A 0011 ARG C
C A 0010 PHE C 3.509 C A 0011 ARG CB
C A 0010 PHE CE2 3.372 C A 0012 SER CB
C A 0010 PHE CZ 3.568 C A 0012 SER CB
C A 0010 PHE CD2 3.435 H A 0018 LEU CD1
C A 0010 PHE CE2 3.672 H A 0018 LEU CD1
C A 0010 PHE CG 3.714 H A 0021 HIS CD2
C A 0010 PHE CG 3.687 H A 0021 HIS CE1
C A 0010 PHE CD2 3.705 H A 0021 HIS CG
C A 0010 PHE CD2 3.610 H A 0021 HIS CD2
C A 0011 ARG CA 3.787 C A 0012 SER CA
C A 0011 ARG C 2.445 C A 0012 SER CA
C A 0011 ARG C 3.434 C A 0012 SER C
C A 0011 ARG C 3.432 C A 0012 SER CB
C A 0012 SER C 2.441 C A 0013 ALA CA
C A 0012 SER C 3.331 C A 0013 ALA C
C A 0012 SER C 3.579 C A 0013 ALA CB
C A 0013 ALA CA 3.785 C A 0014 ASP CA
C A 0013 ALA C 2.440 C A 0014 ASP CA
C A 0013 ALA C 3.546 C A 0014 ASP C
C A 0013 ALA C 3.333 C A 0014 ASP CB
C A 0014 ASP C 2.432 H A 0015 SER CA
C A 0014 ASP C 3.303 H A 0015 SER C
C A 0014 ASP C 3.540 H A 0015 SER CB
C A 0014 ASP CG 3.773 H A 0017 ASN CG
H A 0015 SER C 2.449 H A 0016 SER CA
H A 0015 SER C 2.971 H A 0016 SER C
H A 0015 SER C 3.721 H A 0016 SER CB
H A 0016 SER C 2.456 H A 0017 ASN CA
H A 0016 SER C 3.413 H A 0017 ASN C
H A 0016 SER C 3.600 H A 0017 ASN CB
H A 0016 SER C 3.699 H A 0017 ASN CG
H A 0017 ASN C 2.451 H A 0018 LEU CA
H A 0017 ASN C 3.340 H A 0018 LEU C
H A 0017 ASN C 3.575 H A 0018 LEU CB
H A 0018 LEU CA 3.799 H A 0019 LYS CA
H A 0018 LEU C 2.417 H A 0019 LYS CA
H A 0018 LEU C 2.952 H A 0019 LYS C
H A 0018 LEU C 3.698 H A 0019 LYS CB
H A 0018 LEU C 3.782 H A 0021 HIS CB
H A 0019 LYS C 2.427 H A 0020 THR CA
H A 0019 LYS C 2.880 H A 0020 THR C
H A 0019 LYS C 3.718 H A 0020 THR CB
H A 0020 THR C 2.433 H A 0021 HIS CA
H A 0020 THR C 2.865 H A 0021 HIS C
H A 0020 THR C 3.724 H A 0021 HIS CB
H A 0021 HIS C 2.452 H A 0022 ILE CA
H A 0021 HIS C 2.964 H A 0022 ILE C
H A 0021 HIS C 3.702 H A 0022 ILE CB
H A 0021 HIS CA 3.673 H A 0025 LYS CD
H A 0021 HIS C 3.689 H A 0025 LYS CD
H A 0021 HIS CE1 3.700 H A 0025 LYS CB
H A 0021 HIS CE1 3.709 H A 0025 LYS CG
H A 0022 ILE C 2.442 H A 0023 LYS CA
H A 0022 ILE C 3.134 H A 0023 LYS C
H A 0022 ILE C 3.673 H A 0023 LYS CB
H A 0023 LYS C 2.444 H A 0024 THR CA
H A 0023 LYS C 3.256 H A 0024 THR C
H A 0023 LYS C 3.650 H A 0024 THR CB
H A 0024 THR C 2.446 H A 0025 LYS CA
H A 0024 THR C 3.543 H A 0025 LYS C
H A 0024 THR C 3.514 H A 0025 LYS CB
H A 0024 THR C 3.688 H A 0025 LYS CG
H A 0024 THR C 3.384 H A 0025 LYS CD
H A 0024 THR CB 3.794 H A 0025 LYS CD
H A 0025 LYS C 2.445 H A 0026 HIS CA
H A 0025 LYS C 3.535 H A 0026 HIS C
H A 0025 LYS C 3.473 H A 0026 HIS CB
H A 0025 LYS C 3.452 H A 0026 HIS CG
H A 0026 HIS C 2.460 C A 0027 SER CA
H A 0026 HIS C 3.453 C A 0027 SER C
H A 0026 HIS C 3.520 C A 0027 SER CB
C A 0027 SER C 2.445 C A 0028 LYS CA
C A 0027 SER C 3.369 C A 0028 LYS C
C A 0027 SER C 3.565 C A 0028 LYS CB
C A 0028 LYS C 2.447 C A 0029 GLU CA
C A 0028 LYS C 3.656 C A 0029 GLU C
C A 0028 LYS C 3.320 C A 0029 GLU CB
C A 0028 LYS C 3.218 C A 0029 GLU CG
C A 0029 GLU C 2.444 C A 0030 LYS CA
C A 0029 GLU C 3.513 C A 0030 LYS C
C A 0029 GLU C 3.486 C A 0030 LYS CB
CHARGE_ATTR 2.00 12.00 20
C A 0009 GLU OE1 4.783 C A 0011 ARG NH1
C A 0009 GLU OE1 6.311 C A 0011 ARG NH2
C A 0009 GLU OE2 6.316 C A 0011 ARG NH1
C A 0009 GLU OE2 8.164 C A 0011 ARG NH2
C A 0009 GLU OE1 10.84 H A 0021 HIS NE2
C A 0009 GLU OE2 11.09 H A 0021 HIS ND1
C A 0009 GLU OE2 10.14 H A 0021 HIS NE2
C A 0009 GLU OE1 11.00 H A 0026 HIS NE2
C A 0009 GLU OE2 11.34 H A 0026 HIS ND1
C A 0009 GLU OE2 10.33 H A 0026 HIS NE2
C A 0014 ASP OD1 8.578 H A 0019 LYS NZ
C A 0014 ASP OD2 10.58 H A 0019 LYS NZ
C A 0014 ASP OD1 11.04 H A 0021 HIS ND1
C A 0029 GLU OE1 8.174 H A 0023 LYS NZ
C A 0029 GLU OE2 6.507 H A 0023 LYS NZ
C A 0029 GLU OE2 11.14 H A 0025 LYS NZ
C A 0029 GLU OE1 8.067 C A 0028 LYS NZ
C A 0029 GLU OE2 6.047 C A 0028 LYS NZ
C A 0029 GLU OE1 11.70 C A 0030 LYS NZ
C A 0029 GLU OE2 11.79 C A 0030 LYS NZ
CHARGE_REPU 2.00 12.00 26
C A 0001 LYS NZ 10.86 H A 0019 LYS NZ
C A 0011 ARG NH1 11.49 H A 0021 HIS ND1
C A 0011 ARG NH1 10.33 H A 0021 HIS NE2
C A 0011 ARG NH1 11.28 H A 0026 HIS NE2
H A 0019 LYS NZ 11.82 H A 0021 HIS NE2
H A 0021 HIS ND1 10.31 H A 0023 LYS NZ
H A 0021 HIS NE2 11.35 H A 0023 LYS NZ
H A 0021 HIS ND1 5.648 H A 0025 LYS NZ
H A 0021 HIS NE2 7.257 H A 0025 LYS NZ
H A 0021 HIS ND1 6.636 H A 0026 HIS ND1
H A 0021 HIS ND1 4.980 H A 0026 HIS NE2
H A 0021 HIS NE2 5.182 H A 0026 HIS ND1
H A 0021 HIS NE2 3.203 H A 0026 HIS NE2
H A 0021 HIS ND1 9.739 C A 0028 LYS NZ
H A 0021 HIS NE2 10.67 C A 0028 LYS NZ
H A 0023 LYS NZ 8.066 H A 0025 LYS NZ
H A 0023 LYS NZ 11.93 H A 0026 HIS ND1
H A 0023 LYS NZ 11.92 H A 0026 HIS NE2
H A 0023 LYS NZ 6.001 C A 0028 LYS NZ
H A 0025 LYS NZ 8.836 H A 0026 HIS ND1
H A 0025 LYS NZ 8.456 H A 0026 HIS NE2
H A 0025 LYS NZ 5.427 C A 0028 LYS NZ
H A 0026 HIS ND1 9.850 C A 0028 LYS NZ
H A 0026 HIS NE2 10.50 C A 0028 LYS NZ
H A 0026 HIS ND1 11.37 C A 0030 LYS NZ
C A 0028 LYS NZ 11.43 C A 0030 LYS NZ
HB_MM 2.00 3.20 45
C A 0002 THR N 2.235 C A 0001 LYS O
C A 0003 TYR N 2.228 C A 0002 THR O
C A 0003 TYR N 3.009 C A 0012 SER O
C A 0004 GLN N 2.231 C A 0003 TYR O
C A 0005 CYS N 2.223 C A 0004 GLN O
C A 0005 CYS N 2.850 C A 0010 PHE O
C A 0006 GLN N 2.220 C A 0005 CYS O
C A 0007 TYR N 2.233 C A 0006 GLN O
C A 0008 CYS N 2.241 C A 0007 TYR O
C A 0009 GLU N 2.226 C A 0008 CYS O
C A 0010 PHE N 2.233 C A 0009 GLU O
C A 0011 ARG N 2.236 C A 0010 PHE O
C A 0012 SER N 2.229 C A 0011 ARG O
C A 0013 ALA N 2.222 C A 0012 SER O
C A 0014 ASP N 2.236 C A 0013 ALA O
H A 0015 SER N 2.222 C A 0014 ASP O
H A 0016 SER N 2.224 H A 0015 SER O
H A 0017 ASN N 3.031 H A 0015 SER O
H A 0017 ASN N 2.226 H A 0016 SER O
H A 0018 LEU N 2.871 H A 0015 SER O
H A 0018 LEU N 2.225 H A 0017 ASN O
H A 0019 LYS N 2.956 H A 0015 SER O
H A 0019 LYS N 2.218 H A 0018 LEU O
H A 0020 THR N 2.222 H A 0019 LYS O
H A 0021 HIS N 2.239 H A 0020 THR O
H A 0022 ILE N 2.958 H A 0018 LEU O
H A 0022 ILE N 3.200 H A 0019 LYS O
H A 0022 ILE N 2.223 H A 0021 HIS O
H A 0023 LYS N 3.107 H A 0019 LYS O
H A 0023 LYS N 3.089 H A 0020 THR O
H A 0023 LYS N 3.051 H A 0021 HIS O
H A 0023 LYS N 2.215 H A 0022 ILE O
H A 0024 THR N 2.915 H A 0020 THR O
H A 0024 THR N 3.130 H A 0021 HIS O
H A 0024 THR N 2.209 H A 0023 LYS O
H A 0025 LYS N 2.800 H A 0021 HIS O
H A 0025 LYS N 2.218 H A 0024 THR O
H A 0026 HIS N 2.920 H A 0022 ILE O
H A 0026 HIS N 2.221 H A 0025 LYS O
C A 0027 SER N 2.997 H A 0022 ILE O
C A 0027 SER N 2.231 H A 0026 HIS O
C A 0028 LYS N 3.198 H A 0023 LYS O
C A 0028 LYS N 2.234 C A 0027 SER O
C A 0029 GLU N 2.222 C A 0028 LYS O
C A 0030 LYS N 2.226 C A 0029 GLU O
HB_MS 2.00 3.20 14
C A 0003 TYR N 2.693 C A 0002 THR OG1
C A 0004 GLN O 2.976 C A 0006 GLN NE2
C A 0005 CYS N 2.923 C A 0004 GLN OE1
C A 0005 CYS O 2.614 C A 0004 GLN NE2
C A 0005 CYS O 3.103 C A 0006 GLN NE2
C A 0008 CYS O 3.165 C A 0004 GLN NE2
C A 0010 PHE N 3.119 C A 0004 GLN OE1
C A 0011 ARG N 3.169 C A 0004 GLN OE1
C A 0012 SER O 2.651 C A 0002 THR OG1
H A 0015 SER N 2.792 C A 0014 ASP OD1
H A 0016 SER N 2.804 C A 0014 ASP OD1
H A 0016 SER O 2.876 H A 0020 THR OG1
H A 0017 ASN N 2.916 C A 0014 ASP OD1
H A 0024 THR O 2.856 C A 0028 LYS NZ
HB_SS 2.00 3.20 4
C A 0014 ASP OD1 3.170 H A 0017 ASN ND2
C A 0014 ASP OD2 2.984 H A 0017 ASN ND2
H A 0019 LYS NZ 3.158 H A 0015 SER OG
H A 0023 LYS NZ 3.086 H A 0024 THR OG1
AROMATIC 0.00 8.00 4
C A 0010 PHE 3.849 H A 0021 HIS
C A 0001 LYS 6.707 C A 0003 TYR
H A 0019 LYS 6.631 C A 0003 TYR
H A 0021 HIS 5.071 H A 0026 HIS