Complet list of 1kdx con file
Complete list of 1kdx.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 314
C A 0586 GLY C 2.488 C A 0587 VAL CA
C A 0586 GLY C 2.975 C A 0587 VAL C
C A 0586 GLY C 3.285 C A 0587 VAL CB
C A 0586 GLY C 3.281 C A 0587 VAL CG2
C A 0587 VAL C 2.445 C A 0588 ARG CA
C A 0587 VAL C 3.124 C A 0588 ARG C
C A 0587 VAL C 3.679 C A 0588 ARG CB
C A 0588 ARG CA 3.682 C A 0589 LYS CE
C A 0588 ARG C 2.486 C A 0589 LYS CA
C A 0588 ARG C 3.072 C A 0589 LYS C
C A 0588 ARG C 3.185 C A 0589 LYS CB
C A 0588 ARG C 3.345 C A 0589 LYS CE
C A 0588 ARG CG 3.768 H A 0592 HIS CD2
C A 0588 ARG CD 3.583 H A 0592 HIS CD2
C A 0588 ARG CB 3.702 H A 0640 TYR CE1
C A 0588 ARG CD 3.647 H A 0640 TYR CD1
C A 0588 ARG CD 3.312 H A 0640 TYR CE1
C A 0589 LYS C 2.476 C A 0590 GLY CA
C A 0589 LYS C 3.205 C A 0590 GLY C
C A 0589 LYS CB 3.768 H A 0591 TRP CD1
C A 0590 GLY C 2.489 H A 0591 TRP CA
C A 0590 GLY C 3.067 H A 0591 TRP C
C A 0590 GLY C 3.754 H A 0591 TRP CB
H A 0591 TRP C 2.485 H A 0592 HIS CA
H A 0591 TRP C 2.955 H A 0592 HIS C
H A 0591 TRP C 3.689 H A 0592 HIS CB
H A 0591 TRP CZ3 3.621 C A 0595 VAL CG2
H A 0591 TRP CZ2 3.587 H A 0640 TYR CD1
H A 0591 TRP CZ3 3.663 H A 0640 TYR CE1
H A 0591 TRP CZ3 3.747 H A 0640 TYR CE2
H A 0591 TRP CZ3 3.609 H A 0640 TYR CZ
H A 0591 TRP CH2 3.451 H A 0640 TYR CG
H A 0591 TRP CH2 3.346 H A 0640 TYR CD1
H A 0591 TRP CH2 3.657 H A 0640 TYR CD2
H A 0591 TRP CH2 3.504 H A 0640 TYR CE1
H A 0591 TRP CD1 3.457 C A 0644 ASN C
H A 0591 TRP CD1 3.555 C A 0645 SER CA
H A 0591 TRP CH2 3.645 H A 0649 TYR CG
H A 0591 TRP CH2 3.738 H A 0649 TYR CD1
H A 0592 HIS C 2.450 H A 0593 GLU CA
H A 0592 HIS C 3.027 H A 0593 GLU C
H A 0592 HIS C 3.722 H A 0593 GLU CB
H A 0593 GLU C 2.456 H A 0594 HIS CA
H A 0593 GLU C 3.288 H A 0594 HIS C
H A 0593 GLU C 3.659 H A 0594 HIS CB
H A 0593 GLU CG 3.545 H A 0594 HIS CD2
H A 0594 HIS C 2.464 C A 0595 VAL CA
H A 0594 HIS C 3.572 C A 0595 VAL C
H A 0594 HIS C 3.398 C A 0595 VAL CB
H A 0594 HIS C 3.290 C A 0595 VAL CG2
C A 0595 VAL C 2.459 C A 0596 THR CA
C A 0595 VAL C 3.182 C A 0596 THR C
C A 0595 VAL C 3.664 C A 0596 THR CB
C A 0595 VAL CG1 3.681 H A 0640 TYR CE2
C A 0595 VAL CG2 3.666 H A 0646 ARG CG
C A 0595 VAL CG2 3.398 H A 0646 ARG CD
C A 0596 THR C 2.450 H A 0597 GLN CA
C A 0596 THR C 2.985 H A 0597 GLN C
C A 0596 THR C 3.733 H A 0597 GLN CB
H A 0597 GLN C 2.439 H A 0598 ASP CA
H A 0597 GLN C 2.962 H A 0598 ASP C
H A 0597 GLN C 3.721 H A 0598 ASP CB
H A 0598 ASP C 2.440 H A 0599 LEU CA
H A 0598 ASP C 3.005 H A 0599 LEU C
H A 0598 ASP C 3.713 H A 0599 LEU CB
H A 0599 LEU C 2.446 H A 0600 ARG CA
H A 0599 LEU C 2.937 H A 0600 ARG C
H A 0599 LEU C 3.748 H A 0600 ARG CB
H A 0600 ARG C 2.463 H A 0601 SER CA
H A 0600 ARG C 2.968 H A 0601 SER C
H A 0600 ARG C 3.723 H A 0601 SER CB
H A 0601 SER C 2.431 H A 0602 HIS CA
H A 0601 SER C 2.947 H A 0602 HIS C
H A 0601 SER C 3.734 H A 0602 HIS CB
H A 0602 HIS C 2.449 H A 0603 LEU CA
H A 0602 HIS C 2.998 H A 0603 LEU C
H A 0602 HIS C 3.733 H A 0603 LEU CB
H A 0603 LEU C 2.452 H A 0604 VAL CA
H A 0603 LEU C 2.928 H A 0604 VAL C
H A 0603 LEU C 3.753 H A 0604 VAL CB
H A 0603 LEU CD1 3.467 H A 0649 TYR CE2
H A 0603 LEU CD1 3.685 H A 0649 TYR CZ
H A 0604 VAL C 2.451 H A 0605 HIS CA
H A 0604 VAL C 2.971 H A 0605 HIS C
H A 0604 VAL C 3.739 H A 0605 HIS CB
H A 0604 VAL CG1 3.619 H A 0633 LYS CG
H A 0604 VAL CG2 3.759 H A 0636 GLU CG
H A 0605 HIS C 2.455 H A 0606 LYS CA
H A 0605 HIS C 3.006 H A 0606 LYS C
H A 0605 HIS C 3.723 H A 0606 LYS CB
H A 0606 LYS C 2.450 H A 0607 LEU CA
H A 0606 LYS C 2.946 H A 0607 LEU C
H A 0606 LYS C 3.756 H A 0607 LEU CB
H A 0607 LEU C 2.454 H A 0608 VAL CA
H A 0607 LEU C 2.940 H A 0608 VAL C
H A 0607 LEU C 3.736 H A 0608 VAL CB
H A 0608 VAL C 2.460 H A 0609 GLN CA
H A 0608 VAL C 3.014 H A 0609 GLN C
H A 0608 VAL C 3.723 H A 0609 GLN CB
H A 0608 VAL CG1 3.475 H A 0625 MET CE
H A 0608 VAL CG2 3.766 H A 0629 VAL CA
H A 0608 VAL CG2 3.467 H A 0632 ALA CB
H A 0609 GLN C 2.446 H A 0610 ALA CA
H A 0609 GLN C 3.048 H A 0610 ALA C
H A 0609 GLN C 3.721 H A 0610 ALA CB
H A 0610 ALA C 2.460 H A 0611 ILE CA
H A 0610 ALA C 3.120 H A 0611 ILE C
H A 0610 ALA C 3.725 H A 0611 ILE CB
H A 0610 ALA CB 3.762 H A 0657 ILE CG1
H A 0611 ILE C 2.489 C A 0612 PHE CA
H A 0611 ILE C 3.645 C A 0612 PHE C
H A 0611 ILE C 3.256 C A 0612 PHE CB
C A 0612 PHE CA 2.974 C A 0613 PRO CD
C A 0612 PHE C 2.450 C A 0613 PRO CA
C A 0612 PHE C 3.096 C A 0613 PRO C
C A 0612 PHE C 3.661 C A 0613 PRO CB
C A 0612 PHE C 3.671 C A 0613 PRO CG
C A 0612 PHE C 2.495 C A 0613 PRO CD
C A 0612 PHE CD1 3.667 H A 0625 MET CE
C A 0612 PHE CB 3.481 H A 0628 LEU CD1
C A 0612 PHE CD2 3.511 H A 0628 LEU CD1
C A 0613 PRO C 2.470 C A 0614 THR CA
C A 0613 PRO C 2.976 C A 0614 THR C
C A 0613 PRO C 3.710 C A 0614 THR CB
C A 0614 THR CA 2.924 C A 0615 PRO CD
C A 0614 THR C 2.459 C A 0615 PRO CA
C A 0614 THR C 3.148 C A 0615 PRO C
C A 0614 THR C 3.648 C A 0615 PRO CB
C A 0614 THR C 3.683 C A 0615 PRO CG
C A 0614 THR C 2.478 C A 0615 PRO CD
C A 0615 PRO C 2.481 C A 0616 ASP CA
C A 0615 PRO C 3.657 C A 0616 ASP C
C A 0615 PRO C 3.224 C A 0616 ASP CB
C A 0616 ASP CA 2.969 H A 0617 PRO CD
C A 0616 ASP C 2.478 H A 0617 PRO CA
C A 0616 ASP C 3.003 H A 0617 PRO C
C A 0616 ASP C 3.671 H A 0617 PRO CB
C A 0616 ASP C 3.686 H A 0617 PRO CG
C A 0616 ASP C 2.501 H A 0617 PRO CD
C A 0616 ASP CB 3.763 H A 0617 PRO CD
C A 0616 ASP CG 3.383 H A 0617 PRO CD
H A 0617 PRO C 2.461 H A 0618 ALA CA
H A 0617 PRO C 2.967 H A 0618 ALA C
H A 0617 PRO C 3.723 H A 0618 ALA CB
H A 0618 ALA C 2.461 H A 0619 ALA CA
H A 0618 ALA C 2.987 H A 0619 ALA C
H A 0618 ALA C 3.722 H A 0619 ALA CB
H A 0619 ALA C 2.472 H A 0620 LEU CA
H A 0619 ALA C 3.024 H A 0620 LEU C
H A 0619 ALA C 3.743 H A 0620 LEU CB
H A 0620 LEU C 2.461 H A 0621 LYS CA
H A 0620 LEU C 3.173 H A 0621 LYS C
H A 0620 LEU C 3.710 H A 0621 LYS CB
H A 0620 LEU CA 3.764 H A 0625 MET CG
H A 0620 LEU CD2 3.620 H A 0629 VAL CG2
H A 0621 LYS C 2.467 C A 0622 ASP CA
H A 0621 LYS C 3.150 C A 0622 ASP C
H A 0621 LYS C 3.706 C A 0622 ASP CB
C A 0622 ASP C 2.475 H A 0623 ARG CA
C A 0622 ASP C 2.968 H A 0623 ARG C
C A 0622 ASP C 3.751 H A 0623 ARG CB
C A 0622 ASP CG 3.748 H A 0624 ARG CB
C A 0622 ASP CG 3.789 H A 0624 ARG CG
H A 0623 ARG C 2.458 H A 0624 ARG CA
H A 0623 ARG C 2.951 H A 0624 ARG C
H A 0623 ARG C 3.734 H A 0624 ARG CB
H A 0623 ARG CA 3.758 H A 0626 GLU CB
H A 0624 ARG C 2.465 H A 0625 MET CA
H A 0624 ARG C 3.131 H A 0625 MET C
H A 0624 ARG C 3.683 H A 0625 MET CB
H A 0625 MET C 2.478 H A 0626 GLU CA
H A 0625 MET C 2.963 H A 0626 GLU C
H A 0625 MET C 3.715 H A 0626 GLU CB
H A 0626 GLU C 2.448 H A 0627 ASN CA
H A 0626 GLU C 3.019 H A 0627 ASN C
H A 0626 GLU C 3.718 H A 0627 ASN CB
H A 0627 ASN C 2.448 H A 0628 LEU CA
H A 0627 ASN C 3.024 H A 0628 LEU C
H A 0627 ASN C 3.748 H A 0628 LEU CB
H A 0628 LEU C 2.459 H A 0629 VAL CA
H A 0628 LEU C 2.988 H A 0629 VAL C
H A 0628 LEU C 3.723 H A 0629 VAL CB
H A 0629 VAL C 2.454 H A 0630 ALA CA
H A 0629 VAL C 2.979 H A 0630 ALA C
H A 0629 VAL C 3.725 H A 0630 ALA CB
H A 0630 ALA C 2.448 H A 0631 TYR CA
H A 0630 ALA C 2.969 H A 0631 TYR C
H A 0630 ALA C 3.723 H A 0631 TYR CB
H A 0631 TYR C 2.455 H A 0632 ALA CA
H A 0631 TYR C 2.987 H A 0632 ALA C
H A 0631 TYR C 3.723 H A 0632 ALA CB
H A 0631 TYR CE2 3.590 H A 0635 VAL CG2
H A 0631 TYR CZ 3.526 H A 0635 VAL CG2
H A 0632 ALA C 2.439 H A 0633 LYS CA
H A 0632 ALA C 2.995 H A 0633 LYS C
H A 0632 ALA C 3.734 H A 0633 LYS CB
H A 0633 LYS C 2.442 H A 0634 LYS CA
H A 0633 LYS C 2.960 H A 0634 LYS C
H A 0633 LYS C 3.745 H A 0634 LYS CB
H A 0634 LYS C 2.452 H A 0635 VAL CA
H A 0634 LYS C 2.967 H A 0635 VAL C
H A 0634 LYS C 3.737 H A 0635 VAL CB
H A 0635 VAL C 2.460 H A 0636 GLU CA
H A 0635 VAL C 2.953 H A 0636 GLU C
H A 0635 VAL C 3.710 H A 0636 GLU CB
H A 0636 GLU C 2.456 H A 0637 GLY CA
H A 0636 GLU C 3.015 H A 0637 GLY C
H A 0637 GLY C 2.461 H A 0638 ASP CA
H A 0637 GLY C 2.984 H A 0638 ASP C
H A 0637 GLY C 3.733 H A 0638 ASP CB
H A 0638 ASP C 2.451 H A 0639 MET CA
H A 0638 ASP C 2.964 H A 0639 MET C
H A 0638 ASP C 3.736 H A 0639 MET CB
H A 0639 MET C 2.450 H A 0640 TYR CA
H A 0639 MET C 2.944 H A 0640 TYR C
H A 0639 MET C 3.726 H A 0640 TYR CB
H A 0640 TYR C 2.463 C A 0641 GLU CA
H A 0640 TYR C 3.261 C A 0641 GLU C
H A 0640 TYR C 3.685 C A 0641 GLU CB
H A 0640 TYR CD2 3.697 H A 0649 TYR CE1
H A 0640 TYR CD2 3.717 H A 0649 TYR CZ
C A 0641 GLU C 2.452 C A 0642 SER CA
C A 0641 GLU C 3.568 C A 0642 SER C
C A 0641 GLU C 3.350 C A 0642 SER CB
C A 0642 SER C 2.451 C A 0643 ALA CA
C A 0642 SER C 3.081 C A 0643 ALA C
C A 0642 SER C 3.697 C A 0643 ALA CB
C A 0643 ALA C 2.465 C A 0644 ASN CA
C A 0643 ALA C 3.325 C A 0644 ASN C
C A 0643 ALA C 3.655 C A 0644 ASN CB
C A 0643 ALA CB 3.623 H A 0649 TYR CA
C A 0643 ALA CB 3.680 H A 0649 TYR CB
C A 0644 ASN C 2.463 C A 0645 SER CA
C A 0644 ASN C 3.691 C A 0645 SER C
C A 0644 ASN C 3.149 C A 0645 SER CB
C A 0645 SER CA 3.798 H A 0646 ARG CA
C A 0645 SER C 2.444 H A 0646 ARG CA
C A 0645 SER C 2.983 H A 0646 ARG C
C A 0645 SER C 3.731 H A 0646 ARG CB
H A 0646 ARG C 2.460 H A 0647 ASP CA
H A 0646 ARG C 3.017 H A 0647 ASP C
H A 0646 ARG C 3.749 H A 0647 ASP CB
H A 0647 ASP C 2.456 H A 0648 GLU CA
H A 0647 ASP C 2.980 H A 0648 GLU C
H A 0647 ASP C 3.715 H A 0648 GLU CB
H A 0648 GLU C 2.456 H A 0649 TYR CA
H A 0648 GLU C 2.934 H A 0649 TYR C
H A 0648 GLU C 3.690 H A 0649 TYR CB
H A 0649 TYR C 2.462 H A 0650 TYR CA
H A 0649 TYR C 2.999 H A 0650 TYR C
H A 0649 TYR C 3.748 H A 0650 TYR CB
H A 0649 TYR CE1 3.756 H A 0653 LEU CD1
H A 0649 TYR CZ 3.759 H A 0653 LEU CD1
H A 0650 TYR C 2.454 H A 0651 HIS CA
H A 0650 TYR C 2.907 H A 0651 HIS C
H A 0650 TYR C 3.762 H A 0651 HIS CB
H A 0651 HIS C 2.444 H A 0652 LEU CA
H A 0651 HIS C 3.023 H A 0652 LEU C
H A 0651 HIS C 3.722 H A 0652 LEU CB
H A 0652 LEU C 2.437 H A 0653 LEU CA
H A 0652 LEU C 3.037 H A 0653 LEU C
H A 0652 LEU C 3.723 H A 0653 LEU CB
H A 0653 LEU C 2.433 H A 0654 ALA CA
H A 0653 LEU C 3.011 H A 0654 ALA C
H A 0653 LEU C 3.705 H A 0654 ALA CB
H A 0654 ALA C 2.461 H A 0655 GLU CA
H A 0654 ALA C 2.968 H A 0655 GLU C
H A 0654 ALA C 3.714 H A 0655 GLU CB
H A 0655 GLU C 2.459 H A 0656 LYS CA
H A 0655 GLU C 2.943 H A 0656 LYS C
H A 0655 GLU C 3.733 H A 0656 LYS CB
H A 0656 LYS C 2.458 H A 0657 ILE CA
H A 0656 LYS C 2.934 H A 0657 ILE C
H A 0656 LYS C 3.742 H A 0657 ILE CB
H A 0657 ILE C 2.445 H A 0658 TYR CA
H A 0657 ILE C 2.932 H A 0658 TYR C
H A 0657 ILE C 3.724 H A 0658 TYR CB
H A 0658 TYR C 2.460 H A 0659 LYS CA
H A 0658 TYR C 2.961 H A 0659 LYS C
H A 0658 TYR C 3.750 H A 0659 LYS CB
H A 0658 TYR CD2 3.788 H A 0662 LYS CE
H A 0658 TYR CE1 3.446 H A 0662 LYS CB
H A 0658 TYR CZ 3.462 H A 0662 LYS CB
H A 0658 TYR CZ 3.626 H A 0662 LYS CG
H A 0659 LYS CA 3.792 H A 0660 ILE CA
H A 0659 LYS C 2.420 H A 0660 ILE CA
H A 0659 LYS C 2.982 H A 0660 ILE C
H A 0659 LYS C 3.724 H A 0660 ILE CB
H A 0659 LYS CA 3.745 C A 0663 GLU CB
H A 0659 LYS C 3.768 C A 0663 GLU CB
H A 0659 LYS CE 3.557 C A 0663 GLU CD
H A 0660 ILE C 2.425 H A 0661 GLN CA
H A 0660 ILE C 3.344 H A 0661 GLN C
H A 0660 ILE C 3.558 H A 0661 GLN CB
H A 0660 ILE C 3.737 H A 0661 GLN CG
H A 0660 ILE C 3.671 C A 0664 LEU CB
H A 0661 GLN C 2.456 H A 0662 LYS CA
H A 0661 GLN C 3.123 H A 0662 LYS C
H A 0661 GLN C 3.726 H A 0662 LYS CB
H A 0662 LYS C 2.439 C A 0663 GLU CA
H A 0662 LYS C 3.191 C A 0663 GLU C
H A 0662 LYS C 3.696 C A 0663 GLU CB
H A 0662 LYS CD 3.707 C A 0666 GLU CD
C A 0663 GLU CA 3.786 C A 0664 LEU CA
C A 0663 GLU C 2.459 C A 0664 LEU CA
C A 0663 GLU C 3.128 C A 0664 LEU C
C A 0663 GLU C 3.691 C A 0664 LEU CB
C A 0664 LEU C 2.433 C A 0665 GLU CA
C A 0664 LEU C 3.181 C A 0665 GLU C
C A 0664 LEU C 3.707 C A 0665 GLU CB
C A 0665 GLU CA 3.798 C A 0666 GLU CA
C A 0665 GLU C 2.420 C A 0666 GLU CA
C A 0665 GLU C 3.110 C A 0666 GLU C
C A 0665 GLU C 3.686 C A 0666 GLU CB
CHARGE_ATTR 2.00 12.00 122
H A 0593 GLU OE1 8.709 H A 0592 HIS ND1
H A 0593 GLU OE1 10.23 H A 0592 HIS NE2
H A 0593 GLU OE2 7.944 H A 0592 HIS ND1
H A 0593 GLU OE2 9.237 H A 0592 HIS NE2
H A 0593 GLU OE1 5.055 H A 0594 HIS ND1
H A 0593 GLU OE1 4.026 H A 0594 HIS NE2
H A 0593 GLU OE2 6.205 H A 0594 HIS ND1
H A 0593 GLU OE2 4.655 H A 0594 HIS NE2
H A 0593 GLU OE2 11.36 H A 0600 ARG NH2
H A 0593 GLU OE1 10.86 H A 0646 ARG NH1
H A 0593 GLU OE1 11.91 H A 0646 ARG NH2
H A 0593 GLU OE2 11.64 H A 0646 ARG NH1
H A 0598 ASP OD1 6.624 H A 0602 HIS ND1
H A 0598 ASP OD1 8.738 H A 0602 HIS NE2
H A 0598 ASP OD2 6.048 H A 0602 HIS ND1
H A 0598 ASP OD2 7.937 H A 0602 HIS NE2
H A 0598 ASP OD1 10.06 H A 0605 HIS ND1
H A 0598 ASP OD1 10.43 H A 0605 HIS NE2
H A 0598 ASP OD2 10.93 H A 0605 HIS ND1
H A 0598 ASP OD2 11.46 H A 0605 HIS NE2
H A 0598 ASP OD2 10.25 H A 0646 ARG NH1
C A 0616 ASP OD1 11.60 H A 0605 HIS ND1
C A 0616 ASP OD1 9.785 H A 0605 HIS NE2
C A 0616 ASP OD2 10.45 H A 0605 HIS NE2
C A 0616 ASP OD1 8.662 H A 0621 LYS NZ
C A 0616 ASP OD2 10.61 H A 0621 LYS NZ
C A 0622 ASP OD1 11.89 H A 0621 LYS NZ
C A 0622 ASP OD1 5.528 H A 0623 ARG NH1
C A 0622 ASP OD1 4.554 H A 0623 ARG NH2
C A 0622 ASP OD2 7.408 H A 0623 ARG NH1
C A 0622 ASP OD2 6.210 H A 0623 ARG NH2
C A 0622 ASP OD1 7.273 H A 0624 ARG NH1
C A 0622 ASP OD1 6.978 H A 0624 ARG NH2
C A 0622 ASP OD2 7.892 H A 0624 ARG NH1
C A 0622 ASP OD2 8.172 H A 0624 ARG NH2
H A 0626 GLU OE1 9.750 H A 0621 LYS NZ
H A 0626 GLU OE2 9.533 H A 0621 LYS NZ
H A 0626 GLU OE1 3.240 H A 0623 ARG NH1
H A 0626 GLU OE1 5.403 H A 0623 ARG NH2
H A 0626 GLU OE2 5.049 H A 0623 ARG NH1
H A 0626 GLU OE2 7.247 H A 0623 ARG NH2
H A 0626 GLU OE1 11.28 H A 0624 ARG NH1
H A 0626 GLU OE1 9.555 H A 0624 ARG NH2
H A 0626 GLU OE2 11.42 H A 0624 ARG NH2
H A 0626 GLU OE1 9.032 H A 0633 LYS NZ
H A 0626 GLU OE2 7.339 H A 0633 LYS NZ
H A 0636 GLU OE1 6.643 C A 0588 ARG NH1
H A 0636 GLU OE1 8.217 C A 0588 ARG NH2
H A 0636 GLU OE2 6.134 C A 0588 ARG NH1
H A 0636 GLU OE2 8.147 C A 0588 ARG NH2
H A 0636 GLU OE2 10.71 C A 0589 LYS NZ
H A 0636 GLU OE1 10.39 H A 0592 HIS ND1
H A 0636 GLU OE1 10.61 H A 0592 HIS NE2
H A 0636 GLU OE2 9.415 H A 0592 HIS ND1
H A 0636 GLU OE2 9.907 H A 0592 HIS NE2
H A 0636 GLU OE1 6.255 H A 0600 ARG NH1
H A 0636 GLU OE1 7.310 H A 0600 ARG NH2
H A 0636 GLU OE2 6.406 H A 0600 ARG NH1
H A 0636 GLU OE2 6.732 H A 0600 ARG NH2
H A 0636 GLU OE1 11.75 H A 0602 HIS ND1
H A 0636 GLU OE1 11.91 H A 0602 HIS NE2
H A 0636 GLU OE1 10.48 H A 0605 HIS ND1
H A 0636 GLU OE1 9.213 H A 0633 LYS NZ
H A 0636 GLU OE2 11.40 H A 0633 LYS NZ
H A 0636 GLU OE2 11.86 H A 0646 ARG NH1
H A 0638 ASP OD1 11.29 C A 0588 ARG NH1
H A 0638 ASP OD2 11.76 C A 0588 ARG NH1
H A 0638 ASP OD1 9.594 C A 0589 LYS NZ
H A 0638 ASP OD2 10.10 C A 0589 LYS NZ
H A 0638 ASP OD1 9.847 H A 0634 LYS NZ
H A 0638 ASP OD2 10.43 H A 0634 LYS NZ
H A 0638 ASP OD1 9.975 H A 0656 LYS NZ
H A 0638 ASP OD2 8.286 H A 0656 LYS NZ
C A 0641 GLU OE1 4.160 C A 0588 ARG NH1
C A 0641 GLU OE1 5.209 C A 0588 ARG NH2
C A 0641 GLU OE2 5.130 C A 0588 ARG NH1
C A 0641 GLU OE2 5.241 C A 0588 ARG NH2
C A 0641 GLU OE1 4.011 C A 0589 LYS NZ
C A 0641 GLU OE2 4.848 C A 0589 LYS NZ
C A 0641 GLU OE1 7.938 H A 0592 HIS ND1
C A 0641 GLU OE1 7.273 H A 0592 HIS NE2
C A 0641 GLU OE2 9.272 H A 0592 HIS ND1
C A 0641 GLU OE2 8.134 H A 0592 HIS NE2
C A 0641 GLU OE1 7.390 H A 0600 ARG NH1
C A 0641 GLU OE1 6.509 H A 0600 ARG NH2
C A 0641 GLU OE2 8.285 H A 0600 ARG NH1
C A 0641 GLU OE2 7.764 H A 0600 ARG NH2
H A 0647 ASP OD1 10.43 H A 0594 HIS ND1
H A 0647 ASP OD1 10.59 H A 0594 HIS NE2
H A 0647 ASP OD2 9.966 H A 0594 HIS ND1
H A 0647 ASP OD2 9.666 H A 0594 HIS NE2
H A 0647 ASP OD1 7.968 H A 0646 ARG NH1
H A 0647 ASP OD1 6.205 H A 0646 ARG NH2
H A 0647 ASP OD2 8.758 H A 0646 ARG NH1
H A 0647 ASP OD2 7.313 H A 0646 ARG NH2
H A 0647 ASP OD1 6.227 H A 0651 HIS ND1
H A 0647 ASP OD1 6.258 H A 0651 HIS NE2
H A 0647 ASP OD2 7.275 H A 0651 HIS ND1
H A 0647 ASP OD2 6.802 H A 0651 HIS NE2
H A 0648 GLU OE1 8.441 C A 0589 LYS NZ
H A 0648 GLU OE2 9.865 C A 0589 LYS NZ
H A 0648 GLU OE1 8.718 H A 0651 HIS ND1
H A 0648 GLU OE1 7.965 H A 0651 HIS NE2
H A 0648 GLU OE2 8.535 H A 0651 HIS ND1
H A 0648 GLU OE2 7.672 H A 0651 HIS NE2
H A 0655 GLU OE1 7.843 H A 0651 HIS ND1
H A 0655 GLU OE1 8.287 H A 0651 HIS NE2
H A 0655 GLU OE2 9.097 H A 0651 HIS ND1
H A 0655 GLU OE2 9.750 H A 0651 HIS NE2
H A 0655 GLU OE1 10.67 H A 0656 LYS NZ
H A 0655 GLU OE2 8.619 H A 0656 LYS NZ
H A 0655 GLU OE1 6.844 H A 0659 LYS NZ
H A 0655 GLU OE2 6.277 H A 0659 LYS NZ
C A 0663 GLU OE1 8.116 H A 0656 LYS NZ
C A 0663 GLU OE2 10.15 H A 0656 LYS NZ
C A 0663 GLU OE1 3.563 H A 0659 LYS NZ
C A 0663 GLU OE2 2.970 H A 0659 LYS NZ
C A 0663 GLU OE1 11.44 H A 0662 LYS NZ
C A 0665 GLU OE1 9.038 H A 0662 LYS NZ
C A 0665 GLU OE2 6.936 H A 0662 LYS NZ
C A 0666 GLU OE1 5.116 H A 0662 LYS NZ
C A 0666 GLU OE2 4.272 H A 0662 LYS NZ
CHARGE_REPU 2.00 12.00 98
C A 0588 ARG NH1 7.981 C A 0589 LYS NZ
C A 0588 ARG NH2 9.049 C A 0589 LYS NZ
C A 0588 ARG NH1 5.953 H A 0592 HIS ND1
C A 0588 ARG NH1 5.142 H A 0592 HIS NE2
C A 0588 ARG NH2 6.652 H A 0592 HIS ND1
C A 0588 ARG NH2 5.114 H A 0592 HIS NE2
C A 0588 ARG NH1 3.261 H A 0600 ARG NH1
C A 0588 ARG NH1 3.098 H A 0600 ARG NH2
C A 0588 ARG NH2 3.713 H A 0600 ARG NH1
C A 0588 ARG NH2 4.129 H A 0600 ARG NH2
C A 0589 LYS NZ 10.04 H A 0592 HIS ND1
C A 0589 LYS NZ 9.792 H A 0592 HIS NE2
C A 0589 LYS NZ 11.06 H A 0600 ARG NH1
C A 0589 LYS NZ 9.708 H A 0600 ARG NH2
H A 0592 HIS ND1 9.417 H A 0594 HIS ND1
H A 0592 HIS ND1 9.352 H A 0594 HIS NE2
H A 0592 HIS NE2 11.52 H A 0594 HIS ND1
H A 0592 HIS NE2 11.29 H A 0594 HIS NE2
H A 0592 HIS ND1 5.615 H A 0600 ARG NH1
H A 0592 HIS ND1 3.479 H A 0600 ARG NH2
H A 0592 HIS NE2 5.038 H A 0600 ARG NH1
H A 0592 HIS NE2 3.322 H A 0600 ARG NH2
H A 0592 HIS ND1 11.14 H A 0646 ARG NH1
H A 0594 HIS ND1 6.063 H A 0646 ARG NH1
H A 0594 HIS ND1 6.912 H A 0646 ARG NH2
H A 0594 HIS NE2 7.744 H A 0646 ARG NH1
H A 0594 HIS NE2 8.327 H A 0646 ARG NH2
H A 0598 ASP OD2 11.69 H A 0636 GLU OE1
H A 0598 ASP OD2 11.92 H A 0636 GLU OE2
H A 0600 ARG NH1 11.96 H A 0633 LYS NZ
H A 0602 HIS ND1 7.748 H A 0605 HIS ND1
H A 0602 HIS ND1 7.926 H A 0605 HIS NE2
H A 0602 HIS NE2 8.246 H A 0605 HIS ND1
H A 0602 HIS NE2 8.510 H A 0605 HIS NE2
H A 0602 HIS ND1 7.890 H A 0606 LYS NZ
H A 0602 HIS NE2 5.772 H A 0606 LYS NZ
H A 0602 HIS ND1 11.93 H A 0646 ARG NH1
H A 0602 HIS NE2 11.93 H A 0646 ARG NH1
H A 0605 HIS ND1 10.71 H A 0606 LYS NZ
H A 0605 HIS NE2 10.81 H A 0606 LYS NZ
H A 0605 HIS NE2 11.54 H A 0621 LYS NZ
H A 0605 HIS ND1 9.583 H A 0633 LYS NZ
H A 0605 HIS NE2 11.31 H A 0633 LYS NZ
H A 0606 LYS NZ 11.25 H A 0662 LYS NZ
C A 0616 ASP OD1 11.77 C A 0622 ASP OD2
H A 0621 LYS NZ 9.128 H A 0623 ARG NH1
H A 0621 LYS NZ 9.218 H A 0623 ARG NH2
C A 0622 ASP OD1 7.073 H A 0626 GLU OE1
C A 0622 ASP OD1 9.198 H A 0626 GLU OE2
C A 0622 ASP OD2 8.844 H A 0626 GLU OE1
C A 0622 ASP OD2 10.84 H A 0626 GLU OE2
H A 0623 ARG NH1 10.99 H A 0624 ARG NH1
H A 0623 ARG NH1 9.579 H A 0624 ARG NH2
H A 0623 ARG NH2 10.83 H A 0624 ARG NH1
H A 0623 ARG NH2 9.812 H A 0624 ARG NH2
H A 0633 LYS NZ 10.77 H A 0634 LYS NZ
H A 0634 LYS NZ 10.48 H A 0656 LYS NZ
H A 0636 GLU OE1 11.16 H A 0638 ASP OD1
H A 0636 GLU OE1 10.69 H A 0638 ASP OD2
H A 0636 GLU OE2 10.55 H A 0638 ASP OD1
H A 0636 GLU OE2 9.911 H A 0638 ASP OD2
H A 0636 GLU OE1 9.155 C A 0641 GLU OE1
H A 0636 GLU OE1 10.42 C A 0641 GLU OE2
H A 0636 GLU OE2 8.000 C A 0641 GLU OE1
H A 0636 GLU OE2 9.617 C A 0641 GLU OE2
H A 0638 ASP OD1 9.103 C A 0641 GLU OE1
H A 0638 ASP OD1 9.116 C A 0641 GLU OE2
H A 0638 ASP OD2 9.785 C A 0641 GLU OE1
H A 0638 ASP OD2 10.27 C A 0641 GLU OE2
H A 0638 ASP OD1 11.88 H A 0648 GLU OE2
H A 0638 ASP OD2 11.14 H A 0648 GLU OE1
H A 0638 ASP OD2 10.71 H A 0648 GLU OE2
H A 0638 ASP OD1 11.77 H A 0655 GLU OE2
H A 0638 ASP OD2 11.61 H A 0655 GLU OE1
H A 0638 ASP OD2 9.652 H A 0655 GLU OE2
C A 0641 GLU OE1 11.22 H A 0648 GLU OE1
H A 0646 ARG NH2 10.70 H A 0651 HIS ND1
H A 0646 ARG NH2 11.68 H A 0651 HIS NE2
H A 0647 ASP OD1 9.722 H A 0648 GLU OE1
H A 0647 ASP OD1 10.83 H A 0648 GLU OE2
H A 0647 ASP OD2 8.499 H A 0648 GLU OE1
H A 0647 ASP OD2 9.865 H A 0648 GLU OE2
H A 0648 GLU OE1 10.48 H A 0655 GLU OE1
H A 0648 GLU OE1 10.57 H A 0655 GLU OE2
H A 0648 GLU OE2 8.840 H A 0655 GLU OE1
H A 0648 GLU OE2 9.008 H A 0655 GLU OE2
H A 0655 GLU OE1 9.730 C A 0663 GLU OE1
H A 0655 GLU OE1 9.784 C A 0663 GLU OE2
H A 0655 GLU OE2 8.675 C A 0663 GLU OE1
H A 0655 GLU OE2 9.120 C A 0663 GLU OE2
H A 0656 LYS NZ 9.379 H A 0659 LYS NZ
C A 0663 GLU OE1 11.50 C A 0665 GLU OE2
C A 0663 GLU OE1 11.69 C A 0666 GLU OE1
C A 0663 GLU OE1 11.52 C A 0666 GLU OE2
C A 0665 GLU OE1 7.749 C A 0666 GLU OE1
C A 0665 GLU OE1 6.019 C A 0666 GLU OE2
C A 0665 GLU OE2 6.583 C A 0666 GLU OE1
C A 0665 GLU OE2 4.548 C A 0666 GLU OE2
HB_MM 2.00 3.20 173
C A 0587 VAL N 2.265 C A 0586 GLY O
C A 0588 ARG N 2.238 C A 0587 VAL O
C A 0589 LYS N 2.801 C A 0587 VAL O
C A 0589 LYS N 2.256 C A 0588 ARG O
C A 0590 GLY N 2.753 C A 0586 GLY O
C A 0590 GLY N 2.244 C A 0589 LYS O
H A 0591 TRP N 2.718 C A 0589 LYS O
H A 0591 TRP N 2.251 C A 0590 GLY O
H A 0592 HIS N 2.816 C A 0590 GLY O
H A 0592 HIS N 2.258 H A 0591 TRP O
H A 0593 GLU N 2.987 H A 0591 TRP O
H A 0593 GLU N 2.252 H A 0592 HIS O
H A 0594 HIS N 2.843 H A 0591 TRP O
H A 0594 HIS N 3.023 H A 0592 HIS O
H A 0594 HIS N 2.246 H A 0593 GLU O
C A 0595 VAL N 2.875 H A 0592 HIS O
C A 0595 VAL N 2.250 H A 0594 HIS O
C A 0596 THR N 2.251 C A 0595 VAL O
H A 0597 GLN N 2.253 C A 0596 THR O
H A 0598 ASP N 3.084 C A 0596 THR O
H A 0598 ASP N 2.239 H A 0597 GLN O
H A 0599 LEU N 2.932 C A 0596 THR O
H A 0599 LEU N 2.257 H A 0598 ASP O
H A 0600 ARG N 2.937 C A 0596 THR O
H A 0600 ARG N 2.252 H A 0599 LEU O
H A 0601 SER N 2.798 H A 0597 GLN O
H A 0601 SER N 2.249 H A 0600 ARG O
H A 0602 HIS N 2.881 H A 0598 ASP O
H A 0602 HIS N 3.168 H A 0599 LEU O
H A 0602 HIS N 2.253 H A 0601 SER O
H A 0603 LEU N 2.842 H A 0599 LEU O
H A 0603 LEU N 3.009 H A 0600 ARG O
H A 0603 LEU N 2.240 H A 0602 HIS O
H A 0604 VAL N 2.821 H A 0600 ARG O
H A 0604 VAL N 2.248 H A 0603 LEU O
H A 0605 HIS N 2.864 H A 0601 SER O
H A 0605 HIS N 2.993 H A 0602 HIS O
H A 0605 HIS N 2.250 H A 0604 VAL O
H A 0606 LYS N 2.758 H A 0602 HIS O
H A 0606 LYS N 3.073 H A 0603 LEU O
H A 0606 LYS N 2.240 H A 0605 HIS O
H A 0607 LEU N 2.836 H A 0603 LEU O
H A 0607 LEU N 3.123 H A 0604 VAL O
H A 0607 LEU N 2.252 H A 0606 LYS O
H A 0608 VAL N 2.875 H A 0604 VAL O
H A 0608 VAL N 2.254 H A 0607 LEU O
H A 0609 GLN N 2.786 H A 0605 HIS O
H A 0609 GLN N 2.247 H A 0608 VAL O
H A 0610 ALA N 2.834 H A 0606 LYS O
H A 0610 ALA N 3.047 H A 0607 LEU O
H A 0610 ALA N 2.246 H A 0609 GLN O
H A 0611 ILE N 2.864 H A 0607 LEU O
H A 0611 ILE N 3.094 H A 0608 VAL O
H A 0611 ILE N 2.253 H A 0610 ALA O
C A 0612 PHE N 2.761 H A 0608 VAL O
C A 0612 PHE N 2.248 H A 0611 ILE O
C A 0613 PRO N 3.143 H A 0609 GLN O
C A 0613 PRO N 2.241 C A 0612 PHE O
C A 0614 THR N 2.896 C A 0612 PHE O
C A 0614 THR N 2.248 C A 0613 PRO O
C A 0615 PRO N 3.171 C A 0613 PRO O
C A 0615 PRO N 2.245 C A 0614 THR O
C A 0616 ASP N 2.249 C A 0615 PRO O
H A 0617 PRO N 2.263 C A 0616 ASP O
H A 0618 ALA N 2.953 C A 0616 ASP O
H A 0618 ALA N 2.245 H A 0617 PRO O
H A 0619 ALA N 2.848 C A 0616 ASP O
H A 0619 ALA N 2.997 H A 0617 PRO O
H A 0619 ALA N 2.249 H A 0618 ALA O
H A 0620 LEU N 2.838 H A 0617 PRO O
H A 0620 LEU N 3.080 H A 0618 ALA O
H A 0620 LEU N 2.252 H A 0619 ALA O
H A 0621 LYS N 2.875 H A 0618 ALA O
H A 0621 LYS N 2.989 H A 0619 ALA O
H A 0621 LYS N 2.248 H A 0620 LEU O
C A 0622 ASP N 2.900 H A 0619 ALA O
C A 0622 ASP N 2.248 H A 0621 LYS O
H A 0623 ARG N 2.249 C A 0622 ASP O
H A 0624 ARG N 3.025 C A 0622 ASP O
H A 0624 ARG N 2.254 H A 0623 ARG O
H A 0625 MET N 2.779 C A 0622 ASP O
H A 0625 MET N 2.249 H A 0624 ARG O
H A 0626 GLU N 2.781 C A 0622 ASP O
H A 0626 GLU N 2.248 H A 0625 MET O
H A 0627 ASN N 2.845 H A 0623 ARG O
H A 0627 ASN N 3.144 H A 0625 MET O
H A 0627 ASN N 2.243 H A 0626 GLU O
H A 0628 LEU N 2.784 H A 0625 MET O
H A 0628 LEU N 2.245 H A 0627 ASN O
H A 0629 VAL N 2.825 H A 0625 MET O
H A 0629 VAL N 3.198 H A 0626 GLU O
H A 0629 VAL N 2.244 H A 0628 LEU O
H A 0630 ALA N 2.800 H A 0626 GLU O
H A 0630 ALA N 2.245 H A 0629 VAL O
H A 0631 TYR N 2.861 H A 0627 ASN O
H A 0631 TYR N 2.250 H A 0630 ALA O
H A 0632 ALA N 2.779 H A 0628 LEU O
H A 0632 ALA N 2.246 H A 0631 TYR O
H A 0633 LYS N 2.874 H A 0629 VAL O
H A 0633 LYS N 3.096 H A 0630 ALA O
H A 0633 LYS N 2.248 H A 0632 ALA O
H A 0634 LYS N 2.869 H A 0630 ALA O
H A 0634 LYS N 3.110 H A 0631 TYR O
H A 0634 LYS N 2.251 H A 0633 LYS O
H A 0635 VAL N 2.821 H A 0631 TYR O
H A 0635 VAL N 2.249 H A 0634 LYS O
H A 0636 GLU N 2.811 H A 0632 ALA O
H A 0636 GLU N 2.245 H A 0635 VAL O
H A 0637 GLY N 2.821 H A 0633 LYS O
H A 0637 GLY N 2.253 H A 0636 GLU O
H A 0638 ASP N 2.800 H A 0634 LYS O
H A 0638 ASP N 3.043 H A 0635 VAL O
H A 0638 ASP N 2.246 H A 0637 GLY O
H A 0639 MET N 2.816 H A 0635 VAL O
H A 0639 MET N 2.256 H A 0638 ASP O
H A 0640 TYR N 2.891 H A 0636 GLU O
H A 0640 TYR N 3.141 H A 0637 GLY O
H A 0640 TYR N 2.255 H A 0639 MET O
C A 0641 GLU N 2.809 H A 0637 GLY O
C A 0641 GLU N 3.141 H A 0638 ASP O
C A 0641 GLU N 2.244 H A 0640 TYR O
C A 0642 SER N 3.175 H A 0638 ASP O
C A 0642 SER N 2.974 H A 0639 MET O
C A 0642 SER N 3.071 H A 0640 TYR O
C A 0642 SER N 2.247 C A 0641 GLU O
C A 0643 ALA N 2.822 H A 0639 MET O
C A 0643 ALA N 2.247 C A 0642 SER O
C A 0644 ASN N 2.248 C A 0643 ALA O
C A 0645 SER N 2.243 C A 0644 ASN O
H A 0646 ARG N 2.267 C A 0645 SER O
H A 0647 ASP N 2.247 H A 0646 ARG O
H A 0648 GLU N 2.257 H A 0647 ASP O
H A 0649 TYR N 2.926 C A 0645 SER O
H A 0649 TYR N 2.247 H A 0648 GLU O
H A 0650 TYR N 2.804 H A 0646 ARG O
H A 0650 TYR N 3.149 H A 0647 ASP O
H A 0650 TYR N 2.246 H A 0649 TYR O
H A 0651 HIS N 2.846 H A 0647 ASP O
H A 0651 HIS N 3.055 H A 0648 GLU O
H A 0651 HIS N 2.267 H A 0650 TYR O
H A 0652 LEU N 2.848 H A 0648 GLU O
H A 0652 LEU N 2.251 H A 0651 HIS O
H A 0653 LEU N 2.859 H A 0649 TYR O
H A 0653 LEU N 2.235 H A 0652 LEU O
H A 0654 ALA N 2.914 H A 0650 TYR O
H A 0654 ALA N 2.243 H A 0653 LEU O
H A 0655 GLU N 2.755 H A 0651 HIS O
H A 0655 GLU N 2.246 H A 0654 ALA O
H A 0656 LYS N 2.780 H A 0652 LEU O
H A 0656 LYS N 3.098 H A 0653 LEU O
H A 0656 LYS N 2.244 H A 0655 GLU O
H A 0657 ILE N 2.988 H A 0653 LEU O
H A 0657 ILE N 2.259 H A 0656 LYS O
H A 0658 TYR N 2.869 H A 0654 ALA O
H A 0658 TYR N 3.051 H A 0655 GLU O
H A 0658 TYR N 2.258 H A 0657 ILE O
H A 0659 LYS N 2.823 H A 0655 GLU O
H A 0659 LYS N 3.178 H A 0656 LYS O
H A 0659 LYS N 2.252 H A 0658 TYR O
H A 0660 ILE N 2.864 H A 0656 LYS O
H A 0660 ILE N 2.248 H A 0659 LYS O
H A 0661 GLN N 3.012 H A 0658 TYR O
H A 0661 GLN N 2.942 H A 0659 LYS O
H A 0661 GLN N 2.244 H A 0660 ILE O
H A 0662 LYS N 2.733 H A 0658 TYR O
H A 0662 LYS N 2.247 H A 0661 GLN O
C A 0663 GLU N 2.783 H A 0659 LYS O
C A 0663 GLU N 2.245 H A 0662 LYS O
C A 0664 LEU N 2.891 H A 0659 LYS O
C A 0664 LEU N 2.255 C A 0663 GLU O
C A 0665 GLU N 2.245 C A 0664 LEU O
C A 0666 GLU N 2.921 H A 0661 GLN O
C A 0666 GLU N 2.243 C A 0665 GLU O
HB_MS 2.00 3.20 14
H A 0597 GLN O 2.860 H A 0601 SER OG
H A 0610 ALA O 2.808 H A 0661 GLN NE2
H A 0617 PRO N 3.074 C A 0616 ASP OD1
H A 0618 ALA N 2.821 C A 0616 ASP OD1
H A 0621 LYS O 2.724 H A 0623 ARG NH1
H A 0621 LYS O 2.757 H A 0623 ARG NH2
H A 0623 ARG N 2.827 C A 0622 ASP OD1
H A 0624 ARG N 3.032 C A 0622 ASP OD1
H A 0638 ASP O 2.748 C A 0642 SER OG
C A 0643 ALA O 2.784 H A 0591 TRP NE1
C A 0644 ASN N 2.782 H A 0648 GLU OE1
H A 0646 ARG N 2.876 C A 0645 SER OG
H A 0647 ASP N 2.978 C A 0645 SER OG
H A 0647 ASP O 3.082 H A 0651 HIS ND1
HB_SS 2.00 3.20 7
H A 0592 HIS ND1 3.018 H A 0640 TYR OH
H A 0597 GLN NE2 2.836 H A 0601 SER OG
H A 0600 ARG NH2 2.769 H A 0640 TYR OH
H A 0636 GLU OE2 2.709 H A 0649 TYR OH
H A 0647 ASP OD2 2.882 C A 0645 SER OG
H A 0656 LYS NZ 2.847 H A 0631 TYR OH
H A 0662 LYS NZ 2.964 H A 0661 GLN OE1
AROMATIC 0.00 8.00 9
C A 0589 LYS 7.224 H A 0640 TYR
H A 0592 HIS 5.725 H A 0640 TYR
H A 0634 LYS 6.460 H A 0631 TYR
H A 0656 LYS 4.942 H A 0631 TYR
H A 0600 ARG 3.536 H A 0592 HIS
H A 0606 LYS 6.955 H A 0602 HIS
H A 0646 ARG 6.562 H A 0594 HIS
H A 0659 LYS 7.901 H A 0658 TYR
H A 0640 TYR 5.207 H A 0649 TYR
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 22
H A 0599 LEU CD1 3.795 C B 0145 ALA CB
H A 0602 HIS CE1 3.676 H B 0144 ASP C
H A 0602 HIS CE1 3.704 H B 0144 ASP CG
H A 0602 HIS CD2 3.456 C B 0145 ALA CA
H A 0602 HIS CD2 3.409 C B 0145 ALA CB
H A 0603 LEU CD2 3.677 H B 0141 LEU CD1
H A 0603 LEU CD2 3.541 C B 0145 ALA CB
H A 0606 LYS CG 3.798 H B 0141 LEU CD1
H A 0650 TYR CD2 3.761 H B 0141 LEU CD2
H A 0650 TYR CE2 3.733 H B 0141 LEU C
H A 0650 TYR CE2 3.542 H B 0141 LEU CG
H A 0650 TYR CE2 3.699 H B 0141 LEU CD2
H A 0650 TYR CE2 3.731 H B 0142 SER CA
H A 0654 ALA CB 3.662 H B 0138 LEU CD1
H A 0654 ALA CB 3.572 H B 0138 LEU CD2
H A 0655 GLU CD 3.685 H B 0124 ARG CD
H A 0657 ILE CG2 3.547 H B 0137 ILE CG2
H A 0658 TYR CD1 3.709 H B 0128 LEU CG
H A 0658 TYR CD1 3.585 H B 0128 LEU CD2
H A 0658 TYR CE1 3.642 H B 0128 LEU CG
H A 0658 TYR CD2 3.606 H B 0134 TYR CA
H A 0658 TYR CD2 3.627 H B 0134 TYR CB
CHARGE_ATTR 2.00 12.00 58
H A 0602 HIS ND1 10.09 H B 0140 ASP OD1
H A 0602 HIS ND1 10.13 H B 0140 ASP OD2
H A 0602 HIS NE2 8.093 H B 0140 ASP OD1
H A 0602 HIS NE2 7.974 H B 0140 ASP OD2
H A 0602 HIS ND1 4.685 H B 0144 ASP OD1
H A 0602 HIS ND1 5.225 H B 0144 ASP OD2
H A 0602 HIS NE2 3.338 H B 0144 ASP OD1
H A 0602 HIS NE2 3.235 H B 0144 ASP OD2
H A 0605 HIS ND1 10.28 H B 0144 ASP OD1
H A 0605 HIS ND1 9.547 H B 0144 ASP OD2
H A 0605 HIS NE2 9.924 H B 0144 ASP OD1
H A 0605 HIS NE2 9.484 H B 0144 ASP OD2
H A 0606 LYS NZ 4.216 H B 0140 ASP OD1
H A 0606 LYS NZ 2.888 H B 0140 ASP OD2
H A 0606 LYS NZ 4.923 H B 0144 ASP OD1
H A 0606 LYS NZ 2.920 H B 0144 ASP OD2
H A 0638 ASP OD1 10.57 H B 0124 ARG NH1
H A 0638 ASP OD1 11.08 H B 0124 ARG NH2
H A 0638 ASP OD2 8.715 H B 0124 ARG NH1
H A 0638 ASP OD2 9.341 H B 0124 ARG NH2
H A 0647 ASP OD1 8.768 H B 0125 ARG NH1
H A 0647 ASP OD1 10.85 H B 0125 ARG NH2
H A 0647 ASP OD2 8.839 H B 0125 ARG NH1
H A 0647 ASP OD2 10.68 H B 0125 ARG NH2
H A 0648 GLU OE1 10.74 H B 0124 ARG NH1
H A 0648 GLU OE1 8.913 H B 0124 ARG NH2
H A 0648 GLU OE2 8.909 H B 0124 ARG NH1
H A 0648 GLU OE2 6.917 H B 0124 ARG NH2
H A 0648 GLU OE1 8.547 H B 0125 ARG NH1
H A 0648 GLU OE1 9.431 H B 0125 ARG NH2
H A 0648 GLU OE2 7.684 H B 0125 ARG NH1
H A 0648 GLU OE2 8.248 H B 0125 ARG NH2
H A 0655 GLU OE1 4.487 H B 0124 ARG NH1
H A 0655 GLU OE1 4.356 H B 0124 ARG NH2
H A 0655 GLU OE2 3.092 H B 0124 ARG NH1
H A 0655 GLU OE2 3.860 H B 0124 ARG NH2
H A 0655 GLU OE1 8.409 H B 0125 ARG NH1
H A 0655 GLU OE1 9.069 H B 0125 ARG NH2
H A 0655 GLU OE2 10.18 H B 0125 ARG NH1
H A 0655 GLU OE2 10.90 H B 0125 ARG NH2
H A 0656 LYS NZ 11.52 H B 0120 ASP OD2
H A 0659 LYS NZ 6.346 H B 0120 ASP OD1
H A 0659 LYS NZ 6.961 H B 0120 ASP OD2
H A 0662 LYS NZ 11.60 H B 0140 ASP OD1
H A 0662 LYS NZ 9.889 H B 0140 ASP OD2
C A 0663 GLU OE1 8.600 H B 0124 ARG NH1
C A 0663 GLU OE1 10.72 H B 0124 ARG NH2
C A 0663 GLU OE2 8.813 H B 0124 ARG NH1
C A 0663 GLU OE2 10.71 H B 0124 ARG NH2
C A 0663 GLU OE2 11.23 C B 0131 ARG NH1
C A 0663 GLU OE2 11.64 C B 0131 ARG NH2
C A 0665 GLU OE2 11.97 C B 0131 ARG NH2
C A 0666 GLU OE1 7.720 C B 0131 ARG NH1
C A 0666 GLU OE1 5.771 C B 0131 ARG NH2
C A 0666 GLU OE2 9.688 C B 0131 ARG NH1
C A 0666 GLU OE2 7.723 C B 0131 ARG NH2
C A 0666 GLU OE1 11.61 H B 0136 LYS NZ
C A 0666 GLU OE2 11.47 H B 0136 LYS NZ
CHARGE_REPU 2.00 12.00 39
H A 0598 ASP OD1 11.02 H B 0144 ASP OD1
H A 0598 ASP OD1 11.85 H B 0144 ASP OD2
H A 0598 ASP OD2 10.26 H B 0144 ASP OD1
H A 0598 ASP OD2 11.10 H B 0144 ASP OD2
H A 0606 LYS NZ 11.04 H B 0136 LYS NZ
H A 0638 ASP OD1 11.96 H B 0120 ASP OD2
H A 0638 ASP OD2 10.52 H B 0120 ASP OD2
H A 0648 GLU OE1 11.97 H B 0120 ASP OD2
H A 0648 GLU OE2 11.02 H B 0120 ASP OD1
H A 0648 GLU OE2 9.889 H B 0120 ASP OD2
H A 0651 HIS ND1 11.42 H B 0124 ARG NH1
H A 0651 HIS ND1 10.27 H B 0124 ARG NH2
H A 0651 HIS NE2 11.66 H B 0124 ARG NH1
H A 0651 HIS NE2 10.13 H B 0124 ARG NH2
H A 0651 HIS ND1 5.202 H B 0125 ARG NH1
H A 0651 HIS ND1 7.462 H B 0125 ARG NH2
H A 0651 HIS NE2 3.200 H B 0125 ARG NH1
H A 0651 HIS NE2 5.510 H B 0125 ARG NH2
H A 0651 HIS ND1 11.72 H B 0135 ARG NH1
H A 0651 HIS ND1 11.08 H B 0135 ARG NH2
H A 0651 HIS NE2 11.09 H B 0135 ARG NH2
H A 0655 GLU OE1 6.812 H B 0120 ASP OD1
H A 0655 GLU OE1 6.780 H B 0120 ASP OD2
H A 0655 GLU OE2 6.742 H B 0120 ASP OD1
H A 0655 GLU OE2 6.122 H B 0120 ASP OD2
H A 0655 GLU OE1 11.64 H B 0126 GLU OE1
H A 0656 LYS NZ 9.009 H B 0124 ARG NH1
H A 0656 LYS NZ 10.98 H B 0124 ARG NH2
H A 0659 LYS NZ 11.84 H B 0123 LYS NZ
H A 0659 LYS NZ 6.174 H B 0124 ARG NH1
H A 0659 LYS NZ 7.941 H B 0124 ARG NH2
H A 0659 LYS NZ 11.82 C B 0131 ARG NH1
H A 0662 LYS NZ 9.908 C B 0131 ARG NH1
H A 0662 LYS NZ 7.881 C B 0131 ARG NH2
H A 0662 LYS NZ 8.582 H B 0136 LYS NZ
C A 0663 GLU OE1 9.389 H B 0120 ASP OD1
C A 0663 GLU OE1 9.594 H B 0120 ASP OD2
C A 0663 GLU OE2 8.493 H B 0120 ASP OD1
C A 0663 GLU OE2 9.177 H B 0120 ASP OD2
HB_MS 2.00 3.20 1
H A 0650 TYR OH 2.954 H B 0141 LEU O
AROMATIC 0.00 8.00 2
H A 0658 TYR 6.717 C B 0131 ARG
H A 0651 HIS 4.105 H B 0125 ARG
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 91
C B 0119 THR C 2.450 H B 0120 ASP CA
C B 0119 THR C 2.995 H B 0120 ASP C
C B 0119 THR C 3.722 H B 0120 ASP CB
H B 0120 ASP C 2.480 H B 0121 SER CA
H B 0120 ASP C 2.957 H B 0121 SER C
H B 0120 ASP C 3.685 H B 0121 SER CB
H B 0120 ASP CG 3.611 H B 0124 ARG CZ
H B 0121 SER C 2.474 H B 0122 GLN CA
H B 0121 SER C 2.973 H B 0122 GLN C
H B 0121 SER C 3.750 H B 0122 GLN CB
H B 0122 GLN C 2.453 H B 0123 LYS CA
H B 0122 GLN C 2.993 H B 0123 LYS C
H B 0122 GLN C 3.731 H B 0123 LYS CB
H B 0123 LYS C 2.457 H B 0124 ARG CA
H B 0123 LYS C 2.968 H B 0124 ARG C
H B 0123 LYS C 3.727 H B 0124 ARG CB
H B 0124 ARG C 2.436 H B 0125 ARG CA
H B 0124 ARG C 2.981 H B 0125 ARG C
H B 0124 ARG C 3.711 H B 0125 ARG CB
H B 0125 ARG C 2.474 H B 0126 GLU CA
H B 0125 ARG C 3.035 H B 0126 GLU C
H B 0125 ARG C 3.726 H B 0126 GLU CB
H B 0126 GLU C 2.440 H B 0127 ILE CA
H B 0126 GLU C 3.067 H B 0127 ILE C
H B 0126 GLU C 3.714 H B 0127 ILE CB
H B 0127 ILE C 2.447 H B 0128 LEU CA
H B 0127 ILE C 3.052 H B 0128 LEU C
H B 0127 ILE C 3.719 H B 0128 LEU CB
H B 0128 LEU C 2.453 H B 0129 SER CA
H B 0128 LEU C 3.038 H B 0129 SER C
H B 0128 LEU C 3.731 H B 0129 SER CB
H B 0128 LEU CB 3.720 H B 0134 TYR CG
H B 0128 LEU CB 3.496 H B 0134 TYR CD1
H B 0128 LEU CB 3.624 H B 0134 TYR CE1
H B 0128 LEU CD2 3.668 H B 0134 TYR CD1
H B 0128 LEU CD2 3.587 H B 0134 TYR CE1
H B 0129 SER C 2.475 C B 0130 ARG CA
H B 0129 SER C 3.284 C B 0130 ARG C
H B 0129 SER C 3.646 C B 0130 ARG CB
C B 0130 ARG C 2.496 C B 0131 ARG CA
C B 0130 ARG C 3.576 C B 0131 ARG C
C B 0130 ARG C 3.382 C B 0131 ARG CB
C B 0130 ARG C 3.357 C B 0131 ARG CG
C B 0130 ARG C 3.739 H B 0132 PRO CD
C B 0131 ARG CA 2.919 H B 0132 PRO CD
C B 0131 ARG C 2.469 H B 0132 PRO CA
C B 0131 ARG C 3.135 H B 0132 PRO C
C B 0131 ARG C 3.687 H B 0132 PRO CB
C B 0131 ARG C 3.663 H B 0132 PRO CG
C B 0131 ARG C 2.497 H B 0132 PRO CD
H B 0134 TYR C 2.446 H B 0135 ARG CA
H B 0134 TYR C 2.997 H B 0135 ARG C
H B 0134 TYR C 3.755 H B 0135 ARG CB
H B 0134 TYR CD2 3.680 H B 0138 LEU CD2
H B 0134 TYR CE2 3.696 H B 0138 LEU CD2
H B 0135 ARG C 2.427 H B 0136 LYS CA
H B 0135 ARG C 2.945 H B 0136 LYS C
H B 0135 ARG C 3.735 H B 0136 LYS CB
H B 0136 LYS C 2.444 H B 0137 ILE CA
H B 0136 LYS C 3.000 H B 0137 ILE C
H B 0136 LYS C 3.744 H B 0137 ILE CB
H B 0137 ILE C 2.456 H B 0138 LEU CA
H B 0137 ILE C 2.930 H B 0138 LEU C
H B 0137 ILE C 3.773 H B 0138 LEU CB
H B 0138 LEU C 2.451 H B 0139 ASN CA
H B 0138 LEU C 2.949 H B 0139 ASN C
H B 0138 LEU C 3.736 H B 0139 ASN CB
H B 0139 ASN C 2.442 H B 0140 ASP CA
H B 0139 ASN C 2.990 H B 0140 ASP C
H B 0139 ASN C 3.720 H B 0140 ASP CB
H B 0140 ASP C 2.456 H B 0141 LEU CA
H B 0140 ASP C 3.000 H B 0141 LEU C
H B 0140 ASP C 3.734 H B 0141 LEU CB
H B 0141 LEU C 2.453 H B 0142 SER CA
H B 0141 LEU C 3.069 H B 0142 SER C
H B 0141 LEU C 3.716 H B 0142 SER CB
H B 0142 SER C 2.445 H B 0143 SER CA
H B 0142 SER C 3.091 H B 0143 SER C
H B 0142 SER C 3.706 H B 0143 SER CB
H B 0143 SER C 2.453 H B 0144 ASP CA
H B 0143 SER C 3.213 H B 0144 ASP C
H B 0143 SER C 3.672 H B 0144 ASP CB
H B 0144 ASP C 2.437 C B 0145 ALA CA
H B 0144 ASP C 3.217 C B 0145 ALA C
H B 0144 ASP C 3.653 C B 0145 ALA CB
C B 0145 ALA CA 2.957 C B 0146 PRO CD
C B 0145 ALA C 2.473 C B 0146 PRO CA
C B 0145 ALA C 2.964 C B 0146 PRO C
C B 0145 ALA C 3.671 C B 0146 PRO CB
C B 0145 ALA C 3.693 C B 0146 PRO CG
C B 0145 ALA C 2.497 C B 0146 PRO CD
CHARGE_ATTR 2.00 12.00 21
H B 0120 ASP OD1 7.318 H B 0123 LYS NZ
H B 0120 ASP OD2 9.186 H B 0123 LYS NZ
H B 0120 ASP OD1 4.615 H B 0124 ARG NH1
H B 0120 ASP OD1 4.740 H B 0124 ARG NH2
H B 0120 ASP OD2 3.306 H B 0124 ARG NH1
H B 0120 ASP OD2 3.574 H B 0124 ARG NH2
H B 0120 ASP OD1 11.69 H B 0125 ARG NH2
H B 0126 GLU OE1 6.892 H B 0123 LYS NZ
H B 0126 GLU OE2 8.660 H B 0123 LYS NZ
H B 0126 GLU OE1 11.37 H B 0125 ARG NH1
H B 0126 GLU OE1 9.764 H B 0125 ARG NH2
H B 0126 GLU OE2 10.74 H B 0125 ARG NH1
H B 0126 GLU OE2 9.031 H B 0125 ARG NH2
H B 0126 GLU OE1 6.945 C B 0130 ARG NH1
H B 0126 GLU OE1 5.235 C B 0130 ARG NH2
H B 0126 GLU OE2 6.590 C B 0130 ARG NH1
H B 0126 GLU OE2 5.053 C B 0130 ARG NH2
H B 0126 GLU OE1 11.63 H B 0135 ARG NH2
H B 0126 GLU OE2 10.77 H B 0135 ARG NH2
H B 0140 ASP OD1 8.230 H B 0136 LYS NZ
H B 0140 ASP OD2 8.285 H B 0136 LYS NZ
CHARGE_REPU 2.00 12.00 23
H B 0120 ASP OD1 10.46 H B 0126 GLU OE1
H B 0123 LYS NZ 11.76 H B 0124 ARG NH1
H B 0123 LYS NZ 11.11 H B 0124 ARG NH2
H B 0123 LYS NZ 11.72 C B 0130 ARG NH2
H B 0124 ARG NH1 11.52 H B 0125 ARG NH1
H B 0124 ARG NH1 11.75 H B 0125 ARG NH2
H B 0124 ARG NH2 9.700 H B 0125 ARG NH1
H B 0124 ARG NH2 9.800 H B 0125 ARG NH2
H B 0125 ARG NH2 11.46 C B 0130 ARG NH2
H B 0125 ARG NH1 10.68 H B 0135 ARG NH2
H B 0125 ARG NH2 11.16 H B 0135 ARG NH2
C B 0130 ARG NH1 11.88 C B 0131 ARG NH1
C B 0130 ARG NH2 11.77 C B 0131 ARG NH1
C B 0130 ARG NH1 9.025 H B 0135 ARG NH1
C B 0130 ARG NH1 8.427 H B 0135 ARG NH2
C B 0130 ARG NH2 8.490 H B 0135 ARG NH1
C B 0130 ARG NH2 7.754 H B 0135 ARG NH2
C B 0131 ARG NH2 11.82 H B 0135 ARG NH1
H B 0135 ARG NH1 11.58 H B 0136 LYS NZ
H B 0140 ASP OD1 5.882 H B 0144 ASP OD1
H B 0140 ASP OD1 5.257 H B 0144 ASP OD2
H B 0140 ASP OD2 6.464 H B 0144 ASP OD1
H B 0140 ASP OD2 5.067 H B 0144 ASP OD2
HB_MM 2.00 3.20 53
H B 0120 ASP N 2.246 C B 0119 THR O
H B 0121 SER N 2.248 H B 0120 ASP O
H B 0122 GLN N 3.150 C B 0119 THR O
H B 0122 GLN N 2.261 H B 0121 SER O
H B 0123 LYS N 2.835 C B 0119 THR O
H B 0123 LYS N 2.246 H B 0122 GLN O
H B 0124 ARG N 2.862 H B 0120 ASP O
H B 0124 ARG N 2.251 H B 0123 LYS O
H B 0125 ARG N 2.822 H B 0121 SER O
H B 0125 ARG N 2.240 H B 0124 ARG O
H B 0126 GLU N 2.763 H B 0122 GLN O
H B 0126 GLU N 2.240 H B 0125 ARG O
H B 0127 ILE N 2.862 H B 0123 LYS O
H B 0127 ILE N 2.246 H B 0126 GLU O
H B 0128 LEU N 2.814 H B 0124 ARG O
H B 0128 LEU N 2.236 H B 0127 ILE O
H B 0129 SER N 2.747 H B 0125 ARG O
H B 0129 SER N 2.231 H B 0128 LEU O
C B 0130 ARG N 2.826 H B 0127 ILE O
C B 0130 ARG N 3.041 H B 0128 LEU O
C B 0130 ARG N 2.241 H B 0129 SER O
C B 0131 ARG N 2.799 H B 0128 LEU O
C B 0131 ARG N 2.251 C B 0130 ARG O
H B 0132 PRO N 2.250 C B 0131 ARG O
H B 0134 TYR N 2.989 C B 0131 ARG O
H B 0134 TYR N 3.125 H B 0132 PRO O
H B 0135 ARG N 2.849 H B 0132 PRO O
H B 0135 ARG N 2.245 H B 0134 TYR O
H B 0136 LYS N 2.864 H B 0132 PRO O
H B 0136 LYS N 2.248 H B 0135 ARG O
H B 0137 ILE N 3.060 H B 0134 TYR O
H B 0137 ILE N 2.248 H B 0136 LYS O
H B 0138 LEU N 2.818 H B 0134 TYR O
H B 0138 LEU N 3.082 H B 0135 ARG O
H B 0138 LEU N 2.246 H B 0137 ILE O
H B 0139 ASN N 2.823 H B 0135 ARG O
H B 0139 ASN N 2.251 H B 0138 LEU O
H B 0140 ASP N 2.799 H B 0136 LYS O
H B 0140 ASP N 3.188 H B 0137 ILE O
H B 0140 ASP N 2.248 H B 0139 ASN O
H B 0141 LEU N 2.771 H B 0137 ILE O
H B 0141 LEU N 3.062 H B 0138 LEU O
H B 0141 LEU N 2.243 H B 0140 ASP O
H B 0142 SER N 2.873 H B 0138 LEU O
H B 0142 SER N 3.150 H B 0139 ASN O
H B 0142 SER N 2.245 H B 0141 LEU O
H B 0143 SER N 2.810 H B 0139 ASN O
H B 0143 SER N 2.240 H B 0142 SER O
H B 0144 ASP N 2.751 H B 0140 ASP O
H B 0144 ASP N 2.250 H B 0143 SER O
C B 0145 ALA N 2.887 H B 0141 LEU O
C B 0145 ALA N 2.247 H B 0144 ASP O
C B 0146 PRO N 2.249 C B 0145 ALA O
HB_MS 2.00 3.20 7
C B 0119 THR N 2.907 H B 0121 SER OG
H B 0122 GLN N 2.890 H B 0121 SER OG
H B 0125 ARG O 2.698 H B 0129 SER OG
H B 0126 GLU O 2.789 C B 0130 ARG NH2
H B 0129 SER O 2.678 H B 0135 ARG NH1
H B 0138 LEU O 3.053 H B 0142 SER OG
H B 0139 ASN O 2.893 H B 0143 SER OG
HB_SS 2.00 3.20 2
H B 0121 SER OG 2.702 H B 0122 GLN OE1
H B 0139 ASN ND2 2.948 H B 0143 SER OG
AROMATIC 0.00 8.00 1
H B 0135 ARG 7.344 H B 0134 TYR