Complet list of 1va1 con file
Complete list of 1va1.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 141
C A 0001 MET C 2.434 C A 0530 ASP CA
C A 0001 MET C 3.073 C A 0530 ASP C
C A 0001 MET C 3.707 C A 0530 ASP CB
C A 0530 ASP CA 2.911 C A 0531 PRO CD
C A 0530 ASP C 2.465 C A 0531 PRO CA
C A 0530 ASP C 3.153 C A 0531 PRO C
C A 0530 ASP C 3.643 C A 0531 PRO CB
C A 0530 ASP C 3.647 C A 0531 PRO CG
C A 0530 ASP C 2.508 C A 0531 PRO CD
C A 0530 ASP CB 2.991 C A 0531 PRO CD
C A 0531 PRO CA 3.790 C A 0532 GLY CA
C A 0531 PRO C 2.417 C A 0532 GLY CA
C A 0531 PRO C 3.223 C A 0532 GLY C
C A 0532 GLY CA 3.797 C A 0533 LYS CA
C A 0532 GLY C 2.434 C A 0533 LYS CA
C A 0532 GLY C 3.037 C A 0533 LYS C
C A 0532 GLY C 3.711 C A 0533 LYS CB
C A 0533 LYS C 2.433 C A 0534 LYS CA
C A 0533 LYS C 3.256 C A 0534 LYS C
C A 0533 LYS C 3.647 C A 0534 LYS CB
C A 0534 LYS C 2.434 C A 0535 LYS CA
C A 0534 LYS C 3.564 C A 0535 LYS C
C A 0534 LYS C 3.394 C A 0535 LYS CB
C A 0535 LYS C 2.435 C A 0536 GLN CA
C A 0535 LYS C 3.316 C A 0536 GLN C
C A 0535 LYS C 3.615 C A 0536 GLN CB
C A 0536 GLN C 2.435 E A 0537 HIS CA
C A 0536 GLN C 3.302 E A 0537 HIS C
C A 0536 GLN C 3.623 E A 0537 HIS CB
E A 0537 HIS C 2.434 E A 0538 ILE CA
E A 0537 HIS C 3.440 E A 0538 ILE C
E A 0537 HIS C 3.555 E A 0538 ILE CB
E A 0537 HIS C 3.581 E A 0538 ILE CG1
E A 0537 HIS C 3.669 E A 0538 ILE CD1
E A 0537 HIS CB 3.545 E A 0548 TYR C
E A 0537 HIS CB 3.377 E A 0548 TYR CB
E A 0537 HIS CD2 3.448 H A 0550 LYS C
E A 0537 HIS CD2 3.727 H A 0551 THR CA
E A 0537 HIS CB 3.673 H A 0554 LEU CD1
E A 0537 HIS CD2 3.794 H A 0554 LEU CD1
E A 0538 ILE C 2.433 C A 0539 CYS CA
E A 0538 ILE C 3.047 C A 0539 CYS C
E A 0538 ILE C 3.710 C A 0539 CYS CB
C A 0539 CYS C 2.434 C A 0540 HIS CA
C A 0539 CYS C 2.992 C A 0540 HIS C
C A 0539 CYS C 3.715 C A 0540 HIS CB
C A 0539 CYS CB 3.346 C A 0544 CYS CB
C A 0540 HIS C 2.434 C A 0541 ILE CA
C A 0540 HIS C 3.014 C A 0541 ILE C
C A 0540 HIS C 3.737 C A 0541 ILE CB
C A 0541 ILE C 2.433 C A 0542 GLN CA
C A 0541 ILE C 3.025 C A 0542 GLN C
C A 0541 ILE C 3.712 C A 0542 GLN CB
C A 0542 GLN CA 3.790 C A 0543 GLY CA
C A 0542 GLN C 2.416 C A 0543 GLY CA
C A 0542 GLN C 3.681 C A 0543 GLY C
C A 0543 GLY CA 3.797 C A 0544 CYS CA
C A 0543 GLY C 2.433 C A 0544 CYS CA
C A 0543 GLY C 3.192 C A 0544 CYS C
C A 0543 GLY C 3.673 C A 0544 CYS CB
C A 0544 CYS CA 3.792 C A 0545 GLY CA
C A 0544 CYS C 2.419 C A 0545 GLY CA
C A 0544 CYS C 3.714 C A 0545 GLY C
C A 0544 CYS CB 3.775 H A 0561 HIS CE1
C A 0545 GLY CA 3.794 C A 0546 LYS CA
C A 0545 GLY C 2.433 C A 0546 LYS CA
C A 0545 GLY C 3.310 C A 0546 LYS C
C A 0545 GLY C 3.619 C A 0546 LYS CB
C A 0546 LYS C 2.435 E A 0547 VAL CA
C A 0546 LYS C 3.558 E A 0547 VAL C
C A 0546 LYS C 3.432 E A 0547 VAL CB
C A 0546 LYS C 3.332 E A 0547 VAL CG2
C A 0546 LYS CD 3.563 E A 0548 TYR CE2
C A 0546 LYS CE 3.386 E A 0548 TYR CE2
C A 0546 LYS CE 3.774 E A 0548 TYR CZ
E A 0547 VAL C 2.434 E A 0548 TYR CA
E A 0547 VAL C 3.598 E A 0548 TYR C
E A 0547 VAL C 3.346 E A 0548 TYR CB
E A 0547 VAL C 3.686 E A 0548 TYR CG
E A 0548 TYR CA 3.792 C A 0549 GLY CA
E A 0548 TYR C 2.418 C A 0549 GLY CA
E A 0548 TYR C 3.476 C A 0549 GLY C
E A 0548 TYR CD1 3.633 H A 0553 HIS CB
E A 0548 TYR CE1 3.560 H A 0553 HIS CB
E A 0548 TYR CE2 3.666 H A 0557 HIS CD2
C A 0549 GLY CA 3.799 H A 0550 LYS CA
C A 0549 GLY C 2.434 H A 0550 LYS CA
C A 0549 GLY C 3.413 H A 0550 LYS C
C A 0549 GLY C 3.551 H A 0550 LYS CB
H A 0550 LYS C 2.435 H A 0551 THR CA
H A 0550 LYS C 3.088 H A 0551 THR C
H A 0550 LYS C 3.705 H A 0551 THR CB
H A 0551 THR C 2.434 H A 0552 SER CA
H A 0551 THR C 2.972 H A 0552 SER C
H A 0551 THR C 3.716 H A 0552 SER CB
H A 0552 SER C 2.433 H A 0553 HIS CA
H A 0552 SER C 3.111 H A 0553 HIS C
H A 0552 SER C 3.698 H A 0553 HIS CB
H A 0553 HIS C 2.435 H A 0554 LEU CA
H A 0553 HIS C 2.968 H A 0554 LEU C
H A 0553 HIS C 3.719 H A 0554 LEU CB
H A 0554 LEU C 2.433 H A 0555 ARG CA
H A 0554 LEU C 2.990 H A 0555 ARG C
H A 0554 LEU C 3.711 H A 0555 ARG CB
H A 0555 ARG CA 3.799 H A 0556 ALA CA
H A 0555 ARG C 2.428 H A 0556 ALA CA
H A 0555 ARG C 2.998 H A 0556 ALA C
H A 0555 ARG C 3.704 H A 0556 ALA CB
H A 0556 ALA CA 3.796 H A 0557 HIS CA
H A 0556 ALA C 2.430 H A 0557 HIS CA
H A 0556 ALA C 3.163 H A 0557 HIS C
H A 0556 ALA C 3.680 H A 0557 HIS CB
H A 0556 ALA C 3.563 H A 0559 ARG CG
H A 0557 HIS C 2.434 H A 0558 LEU CA
H A 0557 HIS C 3.038 H A 0558 LEU C
H A 0557 HIS C 3.713 H A 0558 LEU CB
H A 0557 HIS CE1 3.255 H A 0561 HIS CD2
H A 0558 LEU C 2.434 H A 0559 ARG CA
H A 0558 LEU C 2.992 H A 0559 ARG C
H A 0558 LEU C 3.717 H A 0559 ARG CB
H A 0559 ARG C 2.434 H A 0560 TRP CA
H A 0559 ARG C 3.113 H A 0560 TRP C
H A 0559 ARG C 3.700 H A 0560 TRP CB
H A 0560 TRP C 2.433 H A 0561 HIS CA
H A 0560 TRP C 3.096 H A 0561 HIS C
H A 0560 TRP C 3.703 H A 0561 HIS CB
H A 0561 HIS C 2.434 H A 0562 THR CA
H A 0561 HIS C 3.146 H A 0562 THR C
H A 0561 HIS C 3.689 H A 0562 THR CB
H A 0561 HIS C 3.753 C A 0564 GLU CG
H A 0562 THR CA 3.791 H A 0563 GLY CA
H A 0562 THR C 2.417 H A 0563 GLY CA
H A 0562 THR C 3.145 H A 0563 GLY C
H A 0563 GLY CA 3.796 C A 0564 GLU CA
H A 0563 GLY C 2.434 C A 0564 GLU CA
H A 0563 GLY C 3.552 C A 0564 GLU C
H A 0563 GLY C 3.409 C A 0564 GLU CB
H A 0563 GLY C 3.438 C A 0564 GLU CG
C A 0564 GLU C 2.434 C A 0565 ARG CA
C A 0564 GLU C 3.598 C A 0565 ARG C
C A 0564 GLU C 3.343 C A 0565 ARG CB
CHARGE_ATTR 2.00 12.00 22
C A 0530 ASP OD1 11.52 C A 0534 LYS NZ
C A 0530 ASP OD2 10.33 C A 0534 LYS NZ
C A 0530 ASP OD1 9.699 H A 0550 LYS NZ
C A 0530 ASP OD2 10.07 H A 0550 LYS NZ
C A 0564 GLU OE1 11.67 C A 0546 LYS NZ
C A 0564 GLU OE2 10.37 C A 0546 LYS NZ
C A 0564 GLU OE1 9.557 H A 0557 HIS ND1
C A 0564 GLU OE1 10.54 H A 0557 HIS NE2
C A 0564 GLU OE2 8.114 H A 0557 HIS ND1
C A 0564 GLU OE2 8.776 H A 0557 HIS NE2
C A 0564 GLU OE1 9.357 H A 0559 ARG NH1
C A 0564 GLU OE1 7.675 H A 0559 ARG NH2
C A 0564 GLU OE2 10.09 H A 0559 ARG NH1
C A 0564 GLU OE2 8.559 H A 0559 ARG NH2
C A 0564 GLU OE1 7.218 H A 0561 HIS ND1
C A 0564 GLU OE1 8.694 H A 0561 HIS NE2
C A 0564 GLU OE2 5.092 H A 0561 HIS ND1
C A 0564 GLU OE2 6.662 H A 0561 HIS NE2
C A 0564 GLU OE1 10.34 C A 0565 ARG NH1
C A 0564 GLU OE1 11.06 C A 0565 ARG NH2
C A 0564 GLU OE2 10.36 C A 0565 ARG NH1
C A 0564 GLU OE2 10.87 C A 0565 ARG NH2
CHARGE_REPU 2.00 12.00 47
C A 0533 LYS NZ 8.897 C A 0534 LYS NZ
C A 0533 LYS NZ 8.535 C A 0535 LYS NZ
C A 0534 LYS NZ 11.98 E A 0537 HIS ND1
C A 0535 LYS NZ 8.921 E A 0537 HIS ND1
C A 0535 LYS NZ 10.30 E A 0537 HIS NE2
C A 0535 LYS NZ 8.196 C A 0540 HIS ND1
C A 0535 LYS NZ 7.006 C A 0540 HIS NE2
E A 0537 HIS ND1 8.327 C A 0540 HIS ND1
E A 0537 HIS ND1 9.489 C A 0540 HIS NE2
E A 0537 HIS NE2 9.696 C A 0540 HIS ND1
E A 0537 HIS NE2 10.95 C A 0540 HIS NE2
E A 0537 HIS ND1 10.07 H A 0550 LYS NZ
E A 0537 HIS NE2 8.373 H A 0550 LYS NZ
E A 0537 HIS ND1 10.11 H A 0553 HIS ND1
E A 0537 HIS ND1 11.01 H A 0553 HIS NE2
E A 0537 HIS NE2 8.705 H A 0553 HIS ND1
E A 0537 HIS NE2 9.884 H A 0553 HIS NE2
E A 0537 HIS ND1 11.48 H A 0557 HIS NE2
E A 0537 HIS NE2 11.86 H A 0557 HIS NE2
C A 0540 HIS ND1 10.20 H A 0557 HIS NE2
C A 0540 HIS ND1 11.58 H A 0561 HIS ND1
C A 0540 HIS ND1 10.41 H A 0561 HIS NE2
C A 0546 LYS NZ 10.34 H A 0553 HIS ND1
C A 0546 LYS NZ 9.901 H A 0553 HIS NE2
C A 0546 LYS NZ 4.202 H A 0557 HIS ND1
C A 0546 LYS NZ 4.344 H A 0557 HIS NE2
C A 0546 LYS NZ 8.407 H A 0561 HIS ND1
C A 0546 LYS NZ 6.611 H A 0561 HIS NE2
H A 0550 LYS NZ 7.927 H A 0553 HIS ND1
H A 0550 LYS NZ 8.483 H A 0553 HIS NE2
H A 0553 HIS ND1 10.64 H A 0555 ARG NH1
H A 0553 HIS ND1 10.23 H A 0557 HIS ND1
H A 0553 HIS ND1 10.99 H A 0557 HIS NE2
H A 0553 HIS NE2 10.64 H A 0557 HIS ND1
H A 0553 HIS NE2 11.40 H A 0557 HIS NE2
H A 0555 ARG NH1 10.83 H A 0559 ARG NH1
H A 0555 ARG NH1 11.69 H A 0559 ARG NH2
H A 0557 HIS ND1 9.905 H A 0559 ARG NH1
H A 0557 HIS ND1 9.991 H A 0559 ARG NH2
H A 0557 HIS NE2 11.93 H A 0559 ARG NH2
H A 0557 HIS ND1 5.573 H A 0561 HIS ND1
H A 0557 HIS ND1 3.975 H A 0561 HIS NE2
H A 0557 HIS NE2 5.108 H A 0561 HIS ND1
H A 0557 HIS NE2 2.992 H A 0561 HIS NE2
H A 0559 ARG NH1 11.96 H A 0561 HIS ND1
H A 0559 ARG NH2 10.92 H A 0561 HIS ND1
H A 0559 ARG NH2 11.51 H A 0561 HIS NE2
HB_MM 2.00 3.20 54
C A 0530 ASP N 2.250 C A 0001 MET O
C A 0531 PRO N 2.252 C A 0530 ASP O
C A 0532 GLY N 2.250 C A 0531 PRO O
C A 0533 LYS N 2.250 C A 0532 GLY O
C A 0534 LYS N 2.249 C A 0533 LYS O
C A 0535 LYS N 2.250 C A 0534 LYS O
C A 0536 GLN N 2.250 C A 0535 LYS O
E A 0537 HIS N 2.250 C A 0536 GLN O
E A 0537 HIS N 2.961 E A 0548 TYR O
E A 0538 ILE N 2.250 E A 0537 HIS O
C A 0539 CYS N 2.250 E A 0538 ILE O
C A 0540 HIS N 2.836 E A 0538 ILE O
C A 0540 HIS N 2.251 C A 0539 CYS O
C A 0541 ILE N 3.139 C A 0539 CYS O
C A 0541 ILE N 2.250 C A 0540 HIS O
C A 0542 GLN N 2.250 C A 0541 ILE O
C A 0543 GLY N 2.953 C A 0541 ILE O
C A 0543 GLY N 2.250 C A 0542 GLN O
C A 0544 CYS N 2.250 C A 0543 GLY O
C A 0545 GLY N 2.252 C A 0544 CYS O
C A 0546 LYS N 2.251 C A 0545 GLY O
E A 0547 VAL N 2.250 C A 0546 LYS O
E A 0548 TYR N 2.781 E A 0537 HIS O
E A 0548 TYR N 2.250 E A 0547 VAL O
C A 0549 GLY N 2.250 E A 0548 TYR O
H A 0550 LYS N 2.251 C A 0549 GLY O
H A 0551 THR N 2.251 H A 0550 LYS O
H A 0552 SER N 2.249 H A 0551 THR O
H A 0553 HIS N 3.080 H A 0551 THR O
H A 0553 HIS N 2.251 H A 0552 SER O
H A 0554 LEU N 2.822 H A 0551 THR O
H A 0554 LEU N 2.251 H A 0553 HIS O
H A 0555 ARG N 2.251 H A 0554 LEU O
H A 0556 ALA N 2.249 H A 0555 ARG O
H A 0557 HIS N 2.869 H A 0553 HIS O
H A 0557 HIS N 3.126 H A 0554 LEU O
H A 0557 HIS N 2.249 H A 0556 ALA O
H A 0558 LEU N 2.580 H A 0554 LEU O
H A 0558 LEU N 3.096 H A 0555 ARG O
H A 0558 LEU N 2.250 H A 0557 HIS O
H A 0559 ARG N 3.116 H A 0555 ARG O
H A 0559 ARG N 2.250 H A 0558 LEU O
H A 0560 TRP N 3.172 H A 0557 HIS O
H A 0560 TRP N 3.127 H A 0558 LEU O
H A 0560 TRP N 2.250 H A 0559 ARG O
H A 0561 HIS N 2.972 H A 0558 LEU O
H A 0561 HIS N 2.250 H A 0560 TRP O
H A 0562 THR N 3.036 H A 0558 LEU O
H A 0562 THR N 2.250 H A 0561 HIS O
H A 0563 GLY N 2.701 H A 0559 ARG O
H A 0563 GLY N 2.250 H A 0562 THR O
C A 0564 GLU N 2.817 H A 0562 THR O
C A 0564 GLU N 2.250 H A 0563 GLY O
C A 0565 ARG N 2.250 C A 0564 GLU O
HB_MS 2.00 3.20 1
H A 0563 GLY N 2.812 H A 0562 THR OG1
HB_SS 2.00 3.20 1
E A 0537 HIS NE2 3.142 H A 0551 THR OG1
AROMATIC 0.00 8.00 3
E A 0548 TYR 5.720 H A 0553 HIS
C A 0546 LYS 4.316 H A 0557 HIS
C A 0546 LYS 5.114 E A 0548 TYR