Complet list of 1ruu con file
Complete list of 1ruu.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 133
C A 0001 TYR CA 2.927 C A 0002 PRO CD
C A 0001 TYR C 2.489 C A 0002 PRO CA
C A 0001 TYR C 3.206 C A 0002 PRO C
C A 0001 TYR C 3.667 C A 0002 PRO CB
C A 0001 TYR C 3.714 C A 0002 PRO CG
C A 0001 TYR C 2.490 C A 0002 PRO CD
C A 0001 TYR CB 3.479 C A 0002 PRO CD
C A 0002 PRO C 2.496 C A 0003 ALA CA
C A 0002 PRO C 3.740 C A 0003 ALA C
C A 0002 PRO C 3.190 C A 0003 ALA CB
C A 0003 ALA C 2.560 C A 0004 LYS CA
C A 0003 ALA C 3.062 C A 0004 LYS CB
C A 0003 ALA C 3.596 C A 0004 LYS CG
C A 0004 LYS CA 3.017 C A 0005 PRO CD
C A 0004 LYS C 2.472 C A 0005 PRO CA
C A 0004 LYS C 3.181 C A 0005 PRO C
C A 0004 LYS C 3.665 C A 0005 PRO CB
C A 0004 LYS C 3.727 C A 0005 PRO CG
C A 0004 LYS C 2.517 C A 0005 PRO CD
C A 0004 LYS CB 3.264 C A 0005 PRO CD
C A 0005 PRO C 2.478 C A 0006 GLU CA
C A 0005 PRO C 3.229 C A 0006 GLU C
C A 0005 PRO C 3.709 C A 0006 GLU CB
C A 0006 GLU C 2.476 C A 0007 ALA CA
C A 0006 GLU C 3.749 C A 0007 ALA C
C A 0006 GLU C 3.150 C A 0007 ALA CB
C A 0007 ALA CA 2.960 C A 0008 PRO CD
C A 0007 ALA C 2.468 C A 0008 PRO CA
C A 0007 ALA C 3.164 C A 0008 PRO C
C A 0007 ALA C 3.669 C A 0008 PRO CB
C A 0007 ALA C 3.716 C A 0008 PRO CG
C A 0007 ALA C 2.498 C A 0008 PRO CD
C A 0007 ALA CB 3.493 C A 0008 PRO CD
C A 0008 PRO C 2.481 C A 0009 GLY CA
C A 0008 PRO C 3.738 C A 0009 GLY C
C A 0009 GLY C 2.477 C A 0010 GLU CA
C A 0009 GLY C 3.712 C A 0010 GLU C
C A 0009 GLY C 3.265 C A 0010 GLU CB
C A 0010 GLU C 2.501 C A 0011 ASP CA
C A 0010 GLU C 3.533 C A 0011 ASP C
C A 0010 GLU C 3.538 C A 0011 ASP CB
C A 0011 ASP C 2.451 C A 0012 ALA CA
C A 0011 ASP C 3.669 C A 0012 ALA C
C A 0011 ASP C 3.175 C A 0012 ALA CB
C A 0012 ALA C 2.473 C A 0013 SER CA
C A 0012 ALA C 3.389 C A 0013 SER C
C A 0012 ALA C 3.616 C A 0013 SER CB
C A 0012 ALA CB 3.424 H A 0017 LEU CD2
C A 0013 SER CA 3.015 C A 0014 PRO CD
C A 0013 SER C 2.450 C A 0014 PRO CA
C A 0013 SER C 3.119 C A 0014 PRO C
C A 0013 SER C 3.649 C A 0014 PRO CB
C A 0013 SER C 3.707 C A 0014 PRO CG
C A 0013 SER C 2.510 C A 0014 PRO CD
C A 0013 SER CB 3.677 C A 0014 PRO CD
C A 0014 PRO C 2.494 C A 0015 GLU CA
C A 0014 PRO C 3.194 C A 0015 GLU C
C A 0014 PRO C 3.056 C A 0015 GLU CB
C A 0014 PRO C 3.255 C A 0015 GLU CG
C A 0015 GLU C 2.503 H A 0016 GLU CA
C A 0015 GLU C 3.237 H A 0016 GLU C
C A 0015 GLU C 3.047 H A 0016 GLU CB
H A 0016 GLU C 2.476 H A 0017 LEU CA
H A 0016 GLU C 3.077 H A 0017 LEU C
H A 0016 GLU C 3.710 H A 0017 LEU CB
H A 0016 GLU CA 3.722 H A 0019 ARG CB
H A 0016 GLU C 3.616 H A 0019 ARG CB
H A 0017 LEU C 2.443 H A 0018 SER CA
H A 0017 LEU C 3.043 H A 0018 SER C
H A 0017 LEU C 3.755 H A 0018 SER CB
H A 0017 LEU CA 3.785 H A 0020 TYR CD2
H A 0017 LEU CA 3.720 H A 0020 TYR CE2
H A 0018 SER C 2.473 H A 0019 ARG CA
H A 0018 SER C 3.074 H A 0019 ARG C
H A 0018 SER C 3.735 H A 0019 ARG CB
H A 0019 ARG C 2.465 H A 0020 TYR CA
H A 0019 ARG C 3.109 H A 0020 TYR C
H A 0019 ARG C 3.716 H A 0020 TYR CB
H A 0020 TYR C 2.466 H A 0021 TYR CA
H A 0020 TYR C 3.076 H A 0021 TYR C
H A 0020 TYR C 3.744 H A 0021 TYR CB
H A 0021 TYR C 2.475 H A 0022 ALA CA
H A 0021 TYR C 3.113 H A 0022 ALA C
H A 0021 TYR C 3.719 H A 0022 ALA CB
H A 0022 ALA C 2.481 H A 0023 SER CA
H A 0022 ALA C 3.112 H A 0023 SER C
H A 0022 ALA C 3.748 H A 0023 SER CB
H A 0023 SER C 2.472 H A 0024 LEU CA
H A 0023 SER C 3.058 H A 0024 LEU C
H A 0023 SER C 3.724 H A 0024 LEU CB
H A 0024 LEU C 2.497 H A 0025 ARG CA
H A 0024 LEU C 3.079 H A 0025 ARG C
H A 0024 LEU C 3.786 H A 0025 ARG CB
H A 0025 ARG C 2.457 H A 0026 HIS CA
H A 0025 ARG C 3.019 H A 0026 HIS C
H A 0025 ARG C 3.728 H A 0026 HIS CB
H A 0025 ARG CA 3.596 H A 0028 LEU CD2
H A 0026 HIS C 2.465 H A 0027 TYR CA
H A 0026 HIS C 3.005 H A 0027 TYR C
H A 0026 HIS C 3.731 H A 0027 TYR CB
H A 0026 HIS CD2 3.443 H A 0030 LEU CD2
H A 0027 TYR C 2.465 H A 0028 LEU CA
H A 0027 TYR C 3.086 H A 0028 LEU C
H A 0027 TYR C 3.721 H A 0028 LEU CB
H A 0027 TYR CD2 3.652 H A 0031 VAL CG2
H A 0027 TYR CE2 3.471 H A 0031 VAL CG2
H A 0028 LEU C 2.488 H A 0029 ASN CA
H A 0028 LEU C 3.214 H A 0029 ASN C
H A 0028 LEU C 3.724 H A 0029 ASN CB
H A 0028 LEU CD1 3.677 H A 0032 THR CG2
H A 0029 ASN C 2.447 H A 0030 LEU CA
H A 0029 ASN C 3.127 H A 0030 LEU C
H A 0029 ASN C 3.720 H A 0030 LEU CB
H A 0030 LEU C 2.494 H A 0031 VAL CA
H A 0030 LEU C 3.295 H A 0031 VAL C
H A 0030 LEU C 3.687 H A 0031 VAL CB
H A 0031 VAL C 2.455 H A 0032 THR CA
H A 0031 VAL C 3.100 H A 0032 THR C
H A 0031 VAL C 3.747 H A 0032 THR CB
H A 0032 THR C 2.500 H A 0033 ARG CA
H A 0032 THR C 3.020 H A 0033 ARG C
H A 0032 THR C 3.780 H A 0033 ARG CB
H A 0032 THR C 3.765 C A 0036 TYR CB
H A 0033 ARG C 2.493 H A 0034 GLN CA
H A 0033 ARG C 3.034 H A 0034 GLN C
H A 0033 ARG C 3.739 H A 0034 GLN CB
H A 0034 GLN C 2.504 C A 0035 ARG CA
H A 0034 GLN C 3.682 C A 0035 ARG C
H A 0034 GLN C 3.347 C A 0035 ARG CB
H A 0034 GLN C 3.530 C A 0035 ARG CG
C A 0035 ARG C 2.480 C A 0036 TYR CA
C A 0035 ARG C 3.470 C A 0036 TYR C
C A 0035 ARG C 3.516 C A 0036 TYR CB
CHARGE_ATTR 2.00 12.00 13
C A 0006 GLU OE1 7.807 C A 0004 LYS NZ
C A 0006 GLU OE2 9.478 C A 0004 LYS NZ
C A 0010 GLU OE1 9.105 H A 0025 ARG NH1
C A 0010 GLU OE1 10.24 H A 0025 ARG NH2
C A 0010 GLU OE2 10.45 H A 0025 ARG NH1
C A 0010 GLU OE2 11.25 H A 0025 ARG NH2
C A 0015 GLU OE1 10.69 H A 0019 ARG NH1
C A 0015 GLU OE2 9.873 H A 0019 ARG NH1
C A 0015 GLU OE2 11.52 H A 0019 ARG NH2
H A 0016 GLU OE1 7.810 H A 0019 ARG NH1
H A 0016 GLU OE1 9.943 H A 0019 ARG NH2
H A 0016 GLU OE2 9.124 H A 0019 ARG NH1
H A 0016 GLU OE2 11.10 H A 0019 ARG NH2
CHARGE_REPU 2.00 12.00 26
C A 0006 GLU OE1 11.59 C A 0011 ASP OD1
C A 0006 GLU OE1 11.14 C A 0011 ASP OD2
C A 0006 GLU OE2 9.976 C A 0011 ASP OD1
C A 0006 GLU OE2 9.286 C A 0011 ASP OD2
C A 0010 GLU OE1 8.159 C A 0011 ASP OD1
C A 0010 GLU OE1 10.00 C A 0011 ASP OD2
C A 0010 GLU OE2 6.983 C A 0011 ASP OD1
C A 0010 GLU OE2 8.592 C A 0011 ASP OD2
C A 0015 GLU OE1 8.707 H A 0016 GLU OE1
C A 0015 GLU OE1 10.13 H A 0016 GLU OE2
C A 0015 GLU OE2 9.653 H A 0016 GLU OE1
C A 0015 GLU OE2 11.16 H A 0016 GLU OE2
H A 0019 ARG NH1 11.66 H A 0026 HIS ND1
H A 0019 ARG NH2 9.795 H A 0026 HIS ND1
H A 0019 ARG NH2 11.18 H A 0026 HIS NE2
H A 0025 ARG NH1 10.70 H A 0026 HIS ND1
H A 0025 ARG NH2 9.577 H A 0026 HIS ND1
H A 0025 ARG NH2 11.55 H A 0026 HIS NE2
H A 0025 ARG NH1 11.81 H A 0033 ARG NH1
H A 0025 ARG NH1 11.07 H A 0033 ARG NH2
H A 0025 ARG NH2 11.79 H A 0033 ARG NH1
H A 0025 ARG NH2 10.91 H A 0033 ARG NH2
H A 0026 HIS ND1 7.421 H A 0033 ARG NH1
H A 0026 HIS ND1 7.751 H A 0033 ARG NH2
H A 0026 HIS NE2 6.768 H A 0033 ARG NH1
H A 0026 HIS NE2 7.552 H A 0033 ARG NH2
HB_MM 2.00 3.20 59
C A 0002 PRO N 2.265 C A 0001 TYR O
C A 0003 ALA N 2.826 C A 0001 TYR O
C A 0003 ALA N 2.257 C A 0002 PRO O
C A 0004 LYS N 2.292 C A 0003 ALA O
C A 0005 PRO N 2.259 C A 0004 LYS O
C A 0006 GLU N 2.858 C A 0004 LYS O
C A 0006 GLU N 2.243 C A 0005 PRO O
C A 0007 ALA N 2.937 C A 0005 PRO O
C A 0007 ALA N 2.243 C A 0006 GLU O
C A 0008 PRO N 2.251 C A 0007 ALA O
C A 0009 GLY N 2.255 C A 0008 PRO O
C A 0010 GLU N 2.267 C A 0009 GLY O
C A 0011 ASP N 2.255 C A 0010 GLU O
C A 0012 ALA N 2.242 C A 0011 ASP O
C A 0013 SER N 2.250 C A 0012 ALA O
C A 0014 PRO N 2.236 C A 0013 SER O
C A 0015 GLU N 2.254 C A 0014 PRO O
H A 0016 GLU N 2.234 C A 0015 GLU O
H A 0017 LEU N 2.822 C A 0015 GLU O
H A 0017 LEU N 2.236 H A 0016 GLU O
H A 0018 SER N 2.244 H A 0017 LEU O
H A 0019 ARG N 3.023 H A 0017 LEU O
H A 0019 ARG N 2.242 H A 0018 SER O
H A 0020 TYR N 2.919 H A 0017 LEU O
H A 0020 TYR N 2.243 H A 0019 ARG O
H A 0021 TYR N 3.170 H A 0018 SER O
H A 0021 TYR N 2.251 H A 0020 TYR O
H A 0022 ALA N 2.723 H A 0018 SER O
H A 0022 ALA N 2.231 H A 0021 TYR O
H A 0023 SER N 3.191 H A 0019 ARG O
H A 0023 SER N 2.255 H A 0022 ALA O
H A 0024 LEU N 2.844 H A 0020 TYR O
H A 0024 LEU N 2.246 H A 0023 SER O
H A 0025 ARG N 2.694 H A 0021 TYR O
H A 0025 ARG N 2.257 H A 0024 LEU O
H A 0026 HIS N 3.124 H A 0022 ALA O
H A 0026 HIS N 3.004 H A 0023 SER O
H A 0026 HIS N 2.246 H A 0025 ARG O
H A 0027 TYR N 2.251 H A 0026 HIS O
H A 0028 LEU N 3.092 H A 0024 LEU O
H A 0028 LEU N 2.241 H A 0027 TYR O
H A 0029 ASN N 2.783 H A 0025 ARG O
H A 0029 ASN N 2.929 H A 0026 HIS O
H A 0029 ASN N 3.067 H A 0027 TYR O
H A 0029 ASN N 2.217 H A 0028 LEU O
H A 0030 LEU N 2.241 H A 0029 ASN O
H A 0031 VAL N 2.991 H A 0027 TYR O
H A 0031 VAL N 2.254 H A 0030 LEU O
H A 0032 THR N 2.938 H A 0028 LEU O
H A 0032 THR N 2.237 H A 0031 VAL O
H A 0033 ARG N 3.051 H A 0029 ASN O
H A 0033 ARG N 2.262 H A 0032 THR O
H A 0034 GLN N 3.011 H A 0032 THR O
H A 0034 GLN N 2.263 H A 0033 ARG O
C A 0035 ARG N 2.778 H A 0032 THR O
C A 0035 ARG N 3.126 H A 0033 ARG O
C A 0035 ARG N 2.257 H A 0034 GLN O
C A 0036 TYR N 3.008 H A 0032 THR O
C A 0036 TYR N 2.253 C A 0035 ARG O
HB_MS 2.00 3.20 3
C A 0003 ALA O 3.179 C A 0004 LYS NZ
H A 0028 LEU O 2.678 H A 0032 THR OG1
H A 0029 ASN O 2.893 H A 0032 THR OG1
AROMATIC 0.00 8.00 3
C A 0004 LYS 7.827 C A 0001 TYR
H A 0025 ARG 6.493 H A 0021 TYR
H A 0033 ARG 7.015 H A 0026 HIS