Complet list of 2ezy con file
Complete list of 2ezy.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 341
C A 0001 MET C 2.438 C A 0002 THR CA
C A 0001 MET C 3.262 C A 0002 THR C
C A 0001 MET C 3.636 C A 0002 THR CB
C A 0002 THR C 2.423 C A 0003 THR CA
C A 0002 THR C 3.056 C A 0003 THR C
C A 0002 THR C 3.686 C A 0003 THR CB
C A 0003 THR C 2.425 C A 0004 SER CA
C A 0003 THR C 3.039 C A 0004 SER C
C A 0003 THR C 3.692 C A 0004 SER CB
C A 0004 SER C 2.427 H A 0005 GLN CA
C A 0004 SER C 2.947 H A 0005 GLN C
C A 0004 SER C 3.695 H A 0005 GLN CB
H A 0005 GLN C 2.425 H A 0006 LYS CA
H A 0005 GLN C 2.983 H A 0006 LYS C
H A 0005 GLN C 3.701 H A 0006 LYS CB
H A 0006 LYS C 2.419 H A 0007 HIS CA
H A 0006 LYS C 2.947 H A 0007 HIS C
H A 0006 LYS C 3.695 H A 0007 HIS CB
H A 0007 HIS C 2.431 H A 0008 ARG CA
H A 0007 HIS C 3.074 H A 0008 ARG C
H A 0007 HIS C 3.683 H A 0008 ARG CB
H A 0007 HIS CE1 3.618 H A 0083 GLU CD
H A 0008 ARG C 2.419 H A 0009 ASP CA
H A 0008 ARG C 3.079 H A 0009 ASP C
H A 0008 ARG C 3.685 H A 0009 ASP CB
H A 0008 ARG CA 3.719 H A 0011 VAL CG2
H A 0008 ARG C 3.767 H A 0011 VAL CG2
H A 0009 ASP C 2.427 H A 0010 PHE CA
H A 0009 ASP C 3.043 H A 0010 PHE C
H A 0009 ASP C 3.687 H A 0010 PHE CB
H A 0010 PHE C 2.424 H A 0011 VAL CA
H A 0010 PHE C 3.187 H A 0011 VAL C
H A 0010 PHE C 3.654 H A 0011 VAL CB
H A 0010 PHE CE1 3.727 C A 0015 MET CB
H A 0010 PHE CZ 3.769 C A 0015 MET CB
H A 0010 PHE CE1 3.628 C A 0023 LEU CD2
H A 0010 PHE CZ 3.413 C A 0023 LEU CD2
H A 0010 PHE CD2 3.672 H A 0084 TRP CD1
H A 0010 PHE CE2 3.661 H A 0084 TRP CG
H A 0010 PHE CE2 3.283 H A 0084 TRP CD1
H A 0011 VAL C 2.449 H A 0012 ALA CA
H A 0011 VAL C 3.504 H A 0012 ALA C
H A 0011 VAL C 3.489 H A 0012 ALA CB
H A 0012 ALA C 2.423 C A 0013 GLU CA
H A 0012 ALA C 3.659 C A 0013 GLU C
H A 0012 ALA C 3.186 C A 0013 GLU CB
H A 0012 ALA C 3.523 C A 0013 GLU CG
C A 0013 GLU CA 2.936 C A 0014 PRO CD
C A 0013 GLU C 2.454 C A 0014 PRO CA
C A 0013 GLU C 2.912 C A 0014 PRO C
C A 0013 GLU C 3.617 C A 0014 PRO CB
C A 0013 GLU C 3.669 C A 0014 PRO CG
C A 0013 GLU C 2.498 C A 0014 PRO CD
C A 0013 GLU CB 3.502 C A 0014 PRO CD
C A 0013 GLU C 3.707 C A 0088 PHE CZ
C A 0014 PRO C 2.429 C A 0015 MET CA
C A 0014 PRO C 3.247 C A 0015 MET C
C A 0014 PRO C 3.634 C A 0015 MET CB
C A 0014 PRO CA 3.740 C A 0088 PHE CZ
C A 0015 MET C 2.427 C A 0016 GLY CA
C A 0015 MET C 2.898 C A 0016 GLY C
C A 0015 MET CE 3.250 H A 0046 LEU CD2
C A 0015 MET CE 3.690 H A 0084 TRP CD2
C A 0015 MET CE 3.456 H A 0084 TRP CE2
C A 0015 MET CE 3.463 H A 0084 TRP CZ2
C A 0015 MET CE 3.685 H A 0084 TRP CH2
C A 0016 GLY C 2.450 C A 0017 GLU CA
C A 0016 GLY C 3.416 C A 0017 GLU C
C A 0016 GLY C 3.571 C A 0017 GLU CB
C A 0016 GLY C 3.762 C A 0017 GLU CG
C A 0017 GLU C 2.416 C A 0018 LYS CA
C A 0017 GLU C 2.946 C A 0018 LYS C
C A 0017 GLU C 3.685 C A 0018 LYS CB
C A 0018 LYS CA 2.921 C A 0019 PRO CD
C A 0018 LYS C 2.464 C A 0019 PRO CA
C A 0018 LYS C 3.106 C A 0019 PRO C
C A 0018 LYS C 3.662 C A 0019 PRO CB
C A 0018 LYS C 3.632 C A 0019 PRO CG
C A 0018 LYS C 2.491 C A 0019 PRO CD
C A 0018 LYS CB 3.532 C A 0019 PRO CD
C A 0019 PRO C 2.433 H A 0020 VAL CA
C A 0019 PRO C 2.938 H A 0020 VAL C
C A 0019 PRO C 3.696 H A 0020 VAL CB
H A 0020 VAL C 2.431 H A 0021 GLY CA
H A 0020 VAL C 2.952 H A 0021 GLY C
H A 0020 VAL CG2 3.716 H A 0045 VAL CG2
H A 0021 GLY C 2.421 H A 0022 SER CA
H A 0021 GLY C 3.152 H A 0022 SER C
H A 0021 GLY C 3.662 H A 0022 SER CB
H A 0022 SER C 2.421 C A 0023 LEU CA
H A 0022 SER C 2.984 C A 0023 LEU C
H A 0022 SER C 3.696 C A 0023 LEU CB
C A 0023 LEU C 2.415 C A 0024 ALA CA
C A 0023 LEU C 2.998 C A 0024 ALA C
C A 0023 LEU C 3.688 C A 0024 ALA CB
C A 0024 ALA C 2.440 C A 0025 GLY CA
C A 0024 ALA C 3.343 C A 0025 GLY C
C A 0025 GLY C 2.438 C A 0026 ILE CA
C A 0025 GLY C 3.297 C A 0026 ILE C
C A 0025 GLY C 3.622 C A 0026 ILE CB
C A 0025 GLY C 3.775 C A 0026 ILE CG1
C A 0025 GLY C 3.727 C A 0026 ILE CD1
C A 0026 ILE C 2.425 C A 0027 GLY CA
C A 0026 ILE C 3.237 C A 0027 GLY C
C A 0026 ILE CG2 3.768 H A 0030 LEU CB
C A 0027 GLY C 2.424 H A 0028 GLU CA
C A 0027 GLY C 2.966 H A 0028 GLU C
C A 0027 GLY C 3.695 H A 0028 GLU CB
H A 0028 GLU C 2.420 H A 0029 VAL CA
H A 0028 GLU C 3.025 H A 0029 VAL C
H A 0028 GLU C 3.686 H A 0029 VAL CB
H A 0029 VAL C 2.422 H A 0030 LEU CA
H A 0029 VAL C 3.007 H A 0030 LEU C
H A 0029 VAL C 3.691 H A 0030 LEU CB
H A 0030 LEU C 2.419 H A 0031 GLY CA
H A 0030 LEU C 2.966 H A 0031 GLY C
H A 0030 LEU CD1 3.649 H A 0073 GLN CD
H A 0031 GLY C 2.433 H A 0032 LYS CA
H A 0031 GLY C 3.043 H A 0032 LYS C
H A 0031 GLY C 3.702 H A 0032 LYS CB
H A 0032 LYS C 2.416 H A 0033 LYS CA
H A 0032 LYS C 3.006 H A 0033 LYS C
H A 0032 LYS C 3.687 H A 0033 LYS CB
H A 0033 LYS C 2.423 H A 0034 LEU CA
H A 0033 LYS C 2.980 H A 0034 LEU C
H A 0033 LYS C 3.696 H A 0034 LEU CB
H A 0034 LEU C 2.413 H A 0035 GLU CA
H A 0034 LEU C 2.944 H A 0035 GLU C
H A 0034 LEU C 3.698 H A 0035 GLU CB
H A 0034 LEU CD2 3.687 H A 0066 THR CG2
H A 0035 GLU C 2.417 H A 0036 GLU CA
H A 0035 GLU C 3.013 H A 0036 GLU C
H A 0035 GLU C 3.686 H A 0036 GLU CB
H A 0036 GLU C 2.428 H A 0037 ARG CA
H A 0036 GLU C 3.259 H A 0037 ARG C
H A 0036 GLU C 3.635 H A 0037 ARG CB
H A 0037 ARG C 2.444 C A 0038 GLY CA
H A 0037 ARG C 3.399 C A 0038 GLY C
H A 0037 ARG CD 3.530 H A 0066 THR CG2
C A 0038 GLY C 2.433 C A 0039 PHE CA
C A 0038 GLY C 3.335 C A 0039 PHE C
C A 0038 GLY C 3.584 C A 0039 PHE CB
C A 0038 GLY C 3.740 C A 0039 PHE CG
C A 0039 PHE C 2.425 C A 0040 ASP CA
C A 0039 PHE C 3.163 C A 0040 ASP C
C A 0039 PHE C 3.663 C A 0040 ASP CB
C A 0039 PHE CD1 3.353 H A 0044 VAL CG1
C A 0039 PHE CE1 3.650 H A 0044 VAL CG1
C A 0039 PHE CB 3.798 H A 0045 VAL CG2
C A 0039 PHE CD1 3.639 H A 0045 VAL CG2
C A 0040 ASP C 2.442 C A 0041 LYS CA
C A 0040 ASP C 3.541 C A 0041 LYS C
C A 0040 ASP C 3.417 C A 0041 LYS CB
C A 0040 ASP C 3.395 C A 0041 LYS CG
C A 0040 ASP CG 3.734 C A 0041 LYS CG
C A 0041 LYS C 2.431 H A 0042 ALA CA
C A 0041 LYS C 3.052 H A 0042 ALA C
C A 0041 LYS C 3.692 H A 0042 ALA CB
C A 0041 LYS CB 3.500 H A 0043 TYR CD2
C A 0041 LYS CB 3.059 H A 0043 TYR CE2
C A 0041 LYS CB 3.527 H A 0043 TYR CZ
C A 0041 LYS CG 3.478 H A 0043 TYR CE2
H A 0042 ALA C 2.425 H A 0043 TYR CA
H A 0042 ALA C 2.995 H A 0043 TYR C
H A 0042 ALA C 3.720 H A 0043 TYR CB
H A 0043 TYR C 2.421 H A 0044 VAL CA
H A 0043 TYR C 3.083 H A 0044 VAL C
H A 0043 TYR C 3.693 H A 0044 VAL CB
H A 0043 TYR CD1 3.546 H A 0044 VAL CG2
H A 0043 TYR CE1 3.240 H A 0044 VAL CG2
H A 0044 VAL C 2.429 H A 0045 VAL CA
H A 0044 VAL C 3.083 H A 0045 VAL C
H A 0044 VAL C 3.688 H A 0045 VAL CB
H A 0045 VAL C 2.418 H A 0046 LEU CA
H A 0045 VAL C 2.911 H A 0046 LEU C
H A 0045 VAL C 3.700 H A 0046 LEU CB
H A 0046 LEU C 2.430 H A 0047 GLY CA
H A 0046 LEU C 2.980 H A 0047 GLY C
H A 0047 GLY C 2.421 H A 0048 GLN CA
H A 0047 GLY C 2.950 H A 0048 GLN C
H A 0047 GLY C 3.696 H A 0048 GLN CB
H A 0048 GLN C 2.436 H A 0049 PHE CA
H A 0048 GLN C 2.960 H A 0049 PHE C
H A 0048 GLN C 3.693 H A 0049 PHE CB
H A 0049 PHE C 2.418 H A 0050 LEU CA
H A 0049 PHE C 3.019 H A 0050 LEU C
H A 0049 PHE C 3.689 H A 0050 LEU CB
H A 0049 PHE CE1 3.606 C A 0054 LYS CA
H A 0049 PHE CE2 3.642 C A 0054 LYS CG
H A 0049 PHE CZ 3.747 C A 0054 LYS CA
H A 0049 PHE CZ 3.664 C A 0054 LYS CB
H A 0049 PHE CZ 3.573 C A 0054 LYS CG
H A 0049 PHE CD1 3.656 H A 0059 PHE CD1
H A 0050 LEU C 2.433 H A 0051 VAL CA
H A 0050 LEU C 3.029 H A 0051 VAL C
H A 0050 LEU C 3.702 H A 0051 VAL CB
H A 0050 LEU CD2 3.500 C A 0089 LEU CD2
H A 0051 VAL C 2.431 C A 0052 LEU CA
H A 0051 VAL C 3.247 C A 0052 LEU C
H A 0051 VAL C 3.637 C A 0052 LEU CB
C A 0052 LEU C 2.416 C A 0053 LYS CA
C A 0052 LEU C 2.877 C A 0053 LYS C
C A 0052 LEU C 3.057 C A 0053 LYS CB
C A 0052 LEU C 3.650 C A 0053 LYS CG
C A 0052 LEU CD1 3.462 H A 0059 PHE CA
C A 0053 LYS C 2.459 C A 0054 LYS CA
C A 0053 LYS C 3.055 C A 0054 LYS C
C A 0053 LYS C 2.996 C A 0054 LYS CB
C A 0053 LYS C 3.351 C A 0054 LYS CG
C A 0054 LYS C 2.406 C A 0055 ASP CA
C A 0054 LYS C 2.980 C A 0055 ASP C
C A 0054 LYS C 3.682 C A 0055 ASP CB
C A 0055 ASP C 2.444 H A 0056 GLU CA
C A 0055 ASP C 3.092 H A 0056 GLU C
C A 0055 ASP C 3.697 H A 0056 GLU CB
C A 0055 ASP CB 3.739 H A 0058 LEU CD1
H A 0056 GLU C 2.428 H A 0057 ASP CA
H A 0056 GLU C 3.066 H A 0057 ASP C
H A 0056 GLU C 3.694 H A 0057 ASP CB
H A 0056 GLU CA 3.766 H A 0078 PHE CD1
H A 0056 GLU CA 3.450 H A 0078 PHE CE1
H A 0056 GLU CB 3.481 H A 0078 PHE CE1
H A 0056 GLU CG 3.687 H A 0078 PHE CD1
H A 0057 ASP CA 3.799 H A 0058 LEU CA
H A 0057 ASP C 2.399 H A 0058 LEU CA
H A 0057 ASP C 3.020 H A 0058 LEU C
H A 0057 ASP C 3.680 H A 0058 LEU CB
H A 0058 LEU C 2.416 H A 0059 PHE CA
H A 0058 LEU C 3.013 H A 0059 PHE C
H A 0058 LEU C 3.690 H A 0059 PHE CB
H A 0059 PHE C 2.424 H A 0060 ARG CA
H A 0059 PHE C 2.996 H A 0060 ARG C
H A 0059 PHE C 3.711 H A 0060 ARG CB
H A 0059 PHE CE1 3.525 H A 0081 LEU CD1
H A 0059 PHE CZ 3.310 H A 0081 LEU CD1
H A 0060 ARG C 2.412 H A 0061 GLU CA
H A 0060 ARG C 2.975 H A 0061 GLU C
H A 0060 ARG C 3.699 H A 0061 GLU CB
H A 0060 ARG CG 3.771 H A 0074 SER CB
H A 0061 GLU C 2.407 H A 0062 TRP CA
H A 0061 GLU C 2.979 H A 0062 TRP C
H A 0061 GLU C 3.693 H A 0062 TRP CB
H A 0062 TRP C 2.415 H A 0063 LEU CA
H A 0062 TRP C 3.049 H A 0063 LEU C
H A 0062 TRP C 3.676 H A 0063 LEU CB
H A 0062 TRP CE3 3.467 H A 0063 LEU CA
H A 0062 TRP CE3 3.768 H A 0063 LEU CB
H A 0063 LEU C 2.424 H A 0064 LYS CA
H A 0063 LEU C 2.977 H A 0064 LYS C
H A 0063 LEU C 3.703 H A 0064 LYS CB
H A 0063 LEU CG 3.754 C A 0069 ALA CB
H A 0064 LYS C 2.421 H A 0065 ASP CA
H A 0064 LYS C 3.042 H A 0065 ASP C
H A 0064 LYS C 3.690 H A 0065 ASP CB
H A 0065 ASP C 2.425 H A 0066 THR CA
H A 0065 ASP C 3.172 H A 0066 THR C
H A 0065 ASP C 3.673 H A 0066 THR CB
H A 0066 THR C 2.441 H A 0067 CYS CA
H A 0066 THR C 3.609 H A 0067 CYS C
H A 0066 THR C 3.367 H A 0067 CYS CB
H A 0067 CYS C 2.441 C A 0068 GLY CA
H A 0067 CYS C 3.360 C A 0068 GLY C
C A 0068 GLY C 2.431 C A 0069 ALA CA
C A 0068 GLY C 2.901 C A 0069 ALA C
C A 0068 GLY C 3.693 C A 0069 ALA CB
C A 0069 ALA C 2.425 C A 0070 ASN CA
C A 0069 ALA C 3.217 C A 0070 ASN C
C A 0069 ALA C 3.644 C A 0070 ASN CB
C A 0070 ASN C 2.435 H A 0071 ALA CA
C A 0070 ASN C 2.999 H A 0071 ALA C
C A 0070 ASN C 3.702 H A 0071 ALA CB
H A 0071 ALA C 2.415 H A 0072 LYS CA
H A 0071 ALA C 3.056 H A 0072 LYS C
H A 0071 ALA C 3.684 H A 0072 LYS CB
H A 0072 LYS C 2.429 H A 0073 GLN CA
H A 0072 LYS C 3.042 H A 0073 GLN C
H A 0072 LYS C 3.690 H A 0073 GLN CB
H A 0073 GLN C 2.413 H A 0074 SER CA
H A 0073 GLN C 3.013 H A 0074 SER C
H A 0073 GLN C 3.681 H A 0074 SER CB
H A 0074 SER C 2.425 H A 0075 ARG CA
H A 0074 SER C 2.985 H A 0075 ARG C
H A 0074 SER C 3.711 H A 0075 ARG CB
H A 0075 ARG C 2.424 H A 0076 ASP CA
H A 0075 ARG C 3.057 H A 0076 ASP C
H A 0075 ARG C 3.694 H A 0076 ASP CB
H A 0076 ASP C 2.411 H A 0077 CYS CA
H A 0076 ASP C 3.035 H A 0077 CYS C
H A 0076 ASP C 3.678 H A 0077 CYS CB
H A 0077 CYS C 2.408 H A 0078 PHE CA
H A 0077 CYS C 2.953 H A 0078 PHE C
H A 0077 CYS C 3.695 H A 0078 PHE CB
H A 0078 PHE C 2.422 H A 0079 GLY CA
H A 0078 PHE C 2.973 H A 0079 GLY C
H A 0078 PHE CE2 3.462 H A 0082 ARG CD
H A 0079 GLY C 2.409 H A 0080 CYS CA
H A 0079 GLY C 3.003 H A 0080 CYS C
H A 0079 GLY C 3.683 H A 0080 CYS CB
H A 0080 CYS C 2.403 H A 0081 LEU CA
H A 0080 CYS C 3.029 H A 0081 LEU C
H A 0080 CYS C 3.674 H A 0081 LEU CB
H A 0081 LEU C 2.429 H A 0082 ARG CA
H A 0081 LEU C 3.010 H A 0082 ARG C
H A 0081 LEU C 3.711 H A 0082 ARG CB
H A 0082 ARG C 2.422 H A 0083 GLU CA
H A 0082 ARG C 3.056 H A 0083 GLU C
H A 0082 ARG C 3.694 H A 0083 GLU CB
H A 0083 GLU C 2.423 H A 0084 TRP CA
H A 0083 GLU C 2.949 H A 0084 TRP C
H A 0083 GLU C 3.696 H A 0084 TRP CB
H A 0084 TRP C 2.427 H A 0085 CYS CA
H A 0084 TRP C 2.968 H A 0085 CYS C
H A 0084 TRP C 3.702 H A 0085 CYS CB
H A 0084 TRP CG 3.769 C A 0088 PHE CD2
H A 0084 TRP CD1 3.624 C A 0088 PHE CD2
H A 0084 TRP CD1 3.625 C A 0088 PHE CE2
H A 0084 TRP CD2 3.328 C A 0088 PHE CD2
H A 0084 TRP CE2 3.511 C A 0088 PHE CG
H A 0084 TRP CE2 2.892 C A 0088 PHE CD2
H A 0084 TRP CE2 3.382 C A 0088 PHE CE2
H A 0084 TRP CE3 3.786 C A 0088 PHE CB
H A 0084 TRP CZ2 3.580 C A 0088 PHE CB
H A 0084 TRP CZ2 3.281 C A 0088 PHE CG
H A 0084 TRP CZ2 3.225 C A 0088 PHE CD2
H A 0084 TRP CZ3 3.388 C A 0088 PHE CB
H A 0084 TRP CH2 3.276 C A 0088 PHE CB
H A 0084 TRP CH2 3.576 C A 0088 PHE CG
H A 0085 CYS C 2.422 H A 0086 ASP CA
H A 0085 CYS C 2.960 H A 0086 ASP C
H A 0085 CYS C 3.693 H A 0086 ASP CB
H A 0085 CYS C 3.634 C A 0089 LEU C
H A 0086 ASP C 2.430 H A 0087 ALA CA
H A 0086 ASP C 3.226 H A 0087 ALA C
H A 0086 ASP C 3.651 H A 0087 ALA CB
H A 0087 ALA C 2.437 C A 0088 PHE CA
H A 0087 ALA C 3.382 C A 0088 PHE C
H A 0087 ALA C 3.560 C A 0088 PHE CB
H A 0087 ALA C 3.724 C A 0088 PHE CG
C A 0088 PHE C 2.428 C A 0089 LEU CA
C A 0088 PHE C 3.151 C A 0089 LEU C
C A 0088 PHE C 3.670 C A 0089 LEU CB
CHARGE_ATTR 2.00 12.00 111
H A 0009 ASP OD1 10.72 H A 0006 LYS NZ
H A 0009 ASP OD2 8.843 H A 0006 LYS NZ
H A 0009 ASP OD1 9.839 H A 0007 HIS ND1
H A 0009 ASP OD1 9.869 H A 0007 HIS NE2
H A 0009 ASP OD2 10.31 H A 0007 HIS ND1
H A 0009 ASP OD2 10.76 H A 0007 HIS NE2
H A 0009 ASP OD1 6.865 H A 0008 ARG NH1
H A 0009 ASP OD1 6.210 H A 0008 ARG NH2
H A 0009 ASP OD2 8.044 H A 0008 ARG NH1
H A 0009 ASP OD2 6.811 H A 0008 ARG NH2
H A 0009 ASP OD1 8.416 C A 0018 LYS NZ
H A 0009 ASP OD2 7.771 C A 0018 LYS NZ
C A 0013 GLU OE1 4.794 C A 0018 LYS NZ
C A 0013 GLU OE2 2.831 C A 0018 LYS NZ
C A 0017 GLU OE1 11.64 C A 0018 LYS NZ
C A 0017 GLU OE1 3.706 C A 0041 LYS NZ
C A 0017 GLU OE2 4.157 C A 0041 LYS NZ
H A 0028 GLU OE1 8.060 H A 0006 LYS NZ
H A 0028 GLU OE2 7.424 H A 0006 LYS NZ
H A 0028 GLU OE1 8.412 H A 0032 LYS NZ
H A 0028 GLU OE2 9.445 H A 0032 LYS NZ
H A 0035 GLU OE1 8.002 H A 0032 LYS NZ
H A 0035 GLU OE2 9.297 H A 0032 LYS NZ
H A 0035 GLU OE1 10.93 H A 0033 LYS NZ
H A 0035 GLU OE1 10.85 C A 0041 LYS NZ
H A 0035 GLU OE2 10.12 C A 0041 LYS NZ
H A 0036 GLU OE1 8.368 H A 0032 LYS NZ
H A 0036 GLU OE2 6.749 H A 0032 LYS NZ
H A 0036 GLU OE1 7.276 H A 0033 LYS NZ
H A 0036 GLU OE2 7.690 H A 0033 LYS NZ
H A 0036 GLU OE1 6.881 H A 0037 ARG NH1
H A 0036 GLU OE1 6.421 H A 0037 ARG NH2
H A 0036 GLU OE2 8.995 H A 0037 ARG NH1
H A 0036 GLU OE2 8.502 H A 0037 ARG NH2
C A 0040 ASP OD1 5.724 C A 0041 LYS NZ
C A 0040 ASP OD2 5.300 C A 0041 LYS NZ
C A 0055 ASP OD1 8.359 C A 0053 LYS NZ
C A 0055 ASP OD2 7.367 C A 0053 LYS NZ
C A 0055 ASP OD1 10.05 C A 0054 LYS NZ
C A 0055 ASP OD2 10.87 C A 0054 LYS NZ
C A 0055 ASP OD1 10.45 H A 0060 ARG NH2
C A 0055 ASP OD2 11.23 H A 0060 ARG NH2
C A 0055 ASP OD1 9.462 H A 0082 ARG NH1
C A 0055 ASP OD1 10.29 H A 0082 ARG NH2
C A 0055 ASP OD2 11.29 H A 0082 ARG NH1
H A 0056 GLU OE1 5.742 H A 0060 ARG NH1
H A 0056 GLU OE1 5.349 H A 0060 ARG NH2
H A 0056 GLU OE2 4.114 H A 0060 ARG NH1
H A 0056 GLU OE2 4.517 H A 0060 ARG NH2
H A 0056 GLU OE1 9.763 H A 0075 ARG NH1
H A 0056 GLU OE1 11.43 H A 0075 ARG NH2
H A 0056 GLU OE2 7.987 H A 0075 ARG NH1
H A 0056 GLU OE2 9.499 H A 0075 ARG NH2
H A 0056 GLU OE1 5.773 H A 0082 ARG NH1
H A 0056 GLU OE1 7.898 H A 0082 ARG NH2
H A 0056 GLU OE2 7.350 H A 0082 ARG NH1
H A 0056 GLU OE2 9.561 H A 0082 ARG NH2
H A 0057 ASP OD1 4.624 H A 0060 ARG NH1
H A 0057 ASP OD1 2.385 H A 0060 ARG NH2
H A 0057 ASP OD2 6.709 H A 0060 ARG NH1
H A 0057 ASP OD2 4.463 H A 0060 ARG NH2
H A 0057 ASP OD1 10.80 H A 0082 ARG NH1
H A 0057 ASP OD2 11.39 H A 0082 ARG NH1
H A 0061 GLU OE1 8.576 H A 0060 ARG NH1
H A 0061 GLU OE1 7.064 H A 0060 ARG NH2
H A 0061 GLU OE2 9.247 H A 0060 ARG NH1
H A 0061 GLU OE2 8.054 H A 0060 ARG NH2
H A 0061 GLU OE1 11.16 H A 0064 LYS NZ
H A 0061 GLU OE2 9.898 H A 0064 LYS NZ
H A 0065 ASP OD1 11.50 H A 0037 ARG NH1
H A 0065 ASP OD1 10.78 H A 0037 ARG NH2
H A 0065 ASP OD2 11.86 H A 0037 ARG NH1
H A 0065 ASP OD2 11.51 H A 0037 ARG NH2
H A 0065 ASP OD1 11.79 H A 0060 ARG NH1
H A 0065 ASP OD1 11.63 H A 0060 ARG NH2
H A 0065 ASP OD2 11.25 H A 0060 ARG NH1
H A 0065 ASP OD2 10.76 H A 0060 ARG NH2
H A 0065 ASP OD1 6.784 H A 0064 LYS NZ
H A 0065 ASP OD2 8.297 H A 0064 LYS NZ
H A 0076 ASP OD2 11.81 H A 0006 LYS NZ
H A 0076 ASP OD1 6.639 H A 0007 HIS ND1
H A 0076 ASP OD1 7.840 H A 0007 HIS NE2
H A 0076 ASP OD2 7.549 H A 0007 HIS ND1
H A 0076 ASP OD2 9.103 H A 0007 HIS NE2
H A 0076 ASP OD1 11.15 H A 0060 ARG NH1
H A 0076 ASP OD1 9.086 H A 0072 LYS NZ
H A 0076 ASP OD2 8.846 H A 0072 LYS NZ
H A 0076 ASP OD1 6.985 H A 0075 ARG NH1
H A 0076 ASP OD1 5.972 H A 0075 ARG NH2
H A 0076 ASP OD2 8.295 H A 0075 ARG NH1
H A 0076 ASP OD2 6.818 H A 0075 ARG NH2
H A 0083 GLU OE1 4.022 H A 0007 HIS ND1
H A 0083 GLU OE1 2.421 H A 0007 HIS NE2
H A 0083 GLU OE2 5.419 H A 0007 HIS ND1
H A 0083 GLU OE2 3.665 H A 0007 HIS NE2
H A 0083 GLU OE1 10.72 H A 0008 ARG NH1
H A 0083 GLU OE1 11.39 H A 0008 ARG NH2
H A 0083 GLU OE2 11.43 H A 0008 ARG NH1
H A 0083 GLU OE1 10.48 H A 0082 ARG NH1
H A 0083 GLU OE1 10.99 H A 0082 ARG NH2
H A 0083 GLU OE2 9.256 H A 0082 ARG NH1
H A 0083 GLU OE2 9.737 H A 0082 ARG NH2
H A 0086 ASP OD1 11.17 H A 0007 HIS NE2
H A 0086 ASP OD2 10.61 H A 0007 HIS ND1
H A 0086 ASP OD2 9.416 H A 0007 HIS NE2
H A 0086 ASP OD1 5.637 C A 0054 LYS NZ
H A 0086 ASP OD2 7.536 C A 0054 LYS NZ
H A 0086 ASP OD1 7.258 H A 0082 ARG NH1
H A 0086 ASP OD1 6.196 H A 0082 ARG NH2
H A 0086 ASP OD2 6.819 H A 0082 ARG NH1
H A 0086 ASP OD2 5.998 H A 0082 ARG NH2
CHARGE_REPU 2.00 12.00 82
H A 0006 LYS NZ 11.82 H A 0007 HIS ND1
H A 0006 LYS NZ 10.18 C A 0018 LYS NZ
H A 0007 HIS ND1 10.16 H A 0008 ARG NH1
H A 0007 HIS ND1 10.02 H A 0008 ARG NH2
H A 0007 HIS NE2 9.231 H A 0008 ARG NH1
H A 0007 HIS NE2 9.572 H A 0008 ARG NH2
H A 0009 ASP OD1 6.114 C A 0013 GLU OE1
H A 0009 ASP OD1 7.324 C A 0013 GLU OE2
H A 0009 ASP OD2 6.414 C A 0013 GLU OE1
H A 0009 ASP OD2 7.251 C A 0013 GLU OE2
H A 0009 ASP OD1 11.10 H A 0083 GLU OE1
C A 0017 GLU OE1 9.416 C A 0040 ASP OD1
C A 0017 GLU OE1 8.924 C A 0040 ASP OD2
C A 0017 GLU OE2 9.448 C A 0040 ASP OD1
C A 0017 GLU OE2 9.132 C A 0040 ASP OD2
H A 0028 GLU OE1 10.52 H A 0035 GLU OE1
H A 0032 LYS NZ 7.530 H A 0033 LYS NZ
H A 0033 LYS NZ 9.897 H A 0037 ARG NH1
H A 0033 LYS NZ 7.959 H A 0037 ARG NH2
H A 0035 GLU OE1 8.360 H A 0036 GLU OE1
H A 0035 GLU OE1 7.385 H A 0036 GLU OE2
H A 0035 GLU OE2 8.917 H A 0036 GLU OE1
H A 0035 GLU OE2 7.861 H A 0036 GLU OE2
H A 0035 GLU OE1 7.985 C A 0040 ASP OD1
H A 0035 GLU OE1 7.819 C A 0040 ASP OD2
H A 0035 GLU OE2 7.306 C A 0040 ASP OD1
H A 0035 GLU OE2 6.628 C A 0040 ASP OD2
C A 0053 LYS NZ 10.39 C A 0054 LYS NZ
C A 0054 LYS NZ 8.462 H A 0082 ARG NH1
C A 0054 LYS NZ 7.764 H A 0082 ARG NH2
C A 0055 ASP OD1 8.904 H A 0056 GLU OE1
C A 0055 ASP OD1 10.49 H A 0056 GLU OE2
C A 0055 ASP OD2 10.42 H A 0056 GLU OE1
C A 0055 ASP OD2 11.76 H A 0056 GLU OE2
C A 0055 ASP OD1 8.548 H A 0057 ASP OD1
C A 0055 ASP OD1 7.731 H A 0057 ASP OD2
C A 0055 ASP OD2 9.320 H A 0057 ASP OD1
C A 0055 ASP OD2 8.507 H A 0057 ASP OD2
C A 0055 ASP OD1 10.27 H A 0061 GLU OE1
C A 0055 ASP OD2 9.668 H A 0061 GLU OE1
C A 0055 ASP OD2 11.78 H A 0061 GLU OE2
H A 0056 GLU OE1 5.571 H A 0057 ASP OD1
H A 0056 GLU OE1 6.768 H A 0057 ASP OD2
H A 0056 GLU OE2 5.643 H A 0057 ASP OD1
H A 0056 GLU OE2 7.357 H A 0057 ASP OD2
H A 0056 GLU OE1 11.04 H A 0061 GLU OE1
H A 0056 GLU OE2 10.78 H A 0061 GLU OE1
H A 0056 GLU OE1 11.85 H A 0076 ASP OD1
H A 0056 GLU OE2 10.18 H A 0076 ASP OD1
H A 0056 GLU OE2 11.69 H A 0076 ASP OD2
H A 0056 GLU OE1 11.99 H A 0083 GLU OE2
H A 0056 GLU OE2 11.88 H A 0083 GLU OE2
H A 0056 GLU OE1 11.97 H A 0086 ASP OD2
H A 0057 ASP OD1 6.144 H A 0061 GLU OE1
H A 0057 ASP OD1 7.576 H A 0061 GLU OE2
H A 0057 ASP OD2 6.283 H A 0061 GLU OE1
H A 0057 ASP OD2 7.869 H A 0061 GLU OE2
H A 0057 ASP OD1 10.86 H A 0065 ASP OD2
H A 0057 ASP OD2 11.66 H A 0065 ASP OD2
H A 0060 ARG NH1 10.21 H A 0064 LYS NZ
H A 0060 ARG NH2 11.28 H A 0064 LYS NZ
H A 0060 ARG NH1 11.81 H A 0072 LYS NZ
H A 0060 ARG NH1 8.024 H A 0075 ARG NH1
H A 0060 ARG NH1 9.130 H A 0075 ARG NH2
H A 0060 ARG NH2 10.04 H A 0075 ARG NH1
H A 0060 ARG NH2 11.30 H A 0075 ARG NH2
H A 0060 ARG NH1 11.38 H A 0082 ARG NH1
H A 0060 ARG NH2 11.05 H A 0082 ARG NH1
H A 0061 GLU OE1 7.346 H A 0065 ASP OD1
H A 0061 GLU OE1 5.718 H A 0065 ASP OD2
H A 0061 GLU OE2 5.868 H A 0065 ASP OD1
H A 0061 GLU OE2 4.628 H A 0065 ASP OD2
H A 0072 LYS NZ 6.505 H A 0075 ARG NH1
H A 0072 LYS NZ 4.696 H A 0075 ARG NH2
H A 0076 ASP OD1 9.337 H A 0083 GLU OE1
H A 0076 ASP OD1 9.350 H A 0083 GLU OE2
H A 0076 ASP OD2 10.81 H A 0083 GLU OE1
H A 0076 ASP OD2 11.12 H A 0083 GLU OE2
H A 0083 GLU OE1 8.793 H A 0086 ASP OD1
H A 0083 GLU OE1 7.016 H A 0086 ASP OD2
H A 0083 GLU OE2 8.589 H A 0086 ASP OD1
H A 0083 GLU OE2 6.569 H A 0086 ASP OD2
HB_MM 2.00 3.20 155
C A 0002 THR N 2.201 C A 0001 MET O
C A 0003 THR N 2.194 C A 0002 THR O
C A 0004 SER N 2.198 C A 0003 THR O
H A 0005 GLN N 2.200 C A 0004 SER O
H A 0006 LYS N 2.865 C A 0004 SER O
H A 0006 LYS N 2.197 H A 0005 GLN O
H A 0007 HIS N 2.939 C A 0004 SER O
H A 0007 HIS N 2.192 H A 0006 LYS O
H A 0008 ARG N 2.199 H A 0007 HIS O
H A 0009 ASP N 2.982 H A 0005 GLN O
H A 0009 ASP N 3.151 H A 0006 LYS O
H A 0009 ASP N 2.193 H A 0008 ARG O
H A 0010 PHE N 2.715 H A 0006 LYS O
H A 0010 PHE N 2.196 H A 0009 ASP O
H A 0011 VAL N 2.196 H A 0010 PHE O
H A 0012 ALA N 3.170 H A 0009 ASP O
H A 0012 ALA N 3.137 H A 0010 PHE O
H A 0012 ALA N 2.206 H A 0011 VAL O
C A 0013 GLU N 2.192 H A 0012 ALA O
C A 0014 PRO N 2.204 C A 0013 GLU O
C A 0015 MET N 2.196 C A 0014 PRO O
C A 0016 GLY N 2.198 C A 0015 MET O
C A 0017 GLU N 2.207 C A 0016 GLY O
C A 0018 LYS N 2.190 C A 0017 GLU O
C A 0019 PRO N 2.205 C A 0018 LYS O
H A 0020 VAL N 2.203 C A 0019 PRO O
H A 0021 GLY N 3.196 C A 0019 PRO O
H A 0021 GLY N 2.202 H A 0020 VAL O
H A 0022 SER N 2.776 C A 0019 PRO O
H A 0022 SER N 2.526 H A 0020 VAL O
H A 0022 SER N 2.194 H A 0021 GLY O
C A 0023 LEU N 2.801 H A 0020 VAL O
C A 0023 LEU N 2.198 H A 0022 SER O
C A 0024 ALA N 2.196 C A 0023 LEU O
C A 0025 GLY N 2.203 C A 0024 ALA O
C A 0026 ILE N 2.199 C A 0025 GLY O
C A 0027 GLY N 2.194 C A 0026 ILE O
H A 0028 GLU N 2.197 C A 0027 GLY O
H A 0029 VAL N 2.193 H A 0028 GLU O
H A 0030 LEU N 3.187 C A 0027 GLY O
H A 0030 LEU N 2.195 H A 0029 VAL O
H A 0031 GLY N 2.827 C A 0027 GLY O
H A 0031 GLY N 2.195 H A 0030 LEU O
H A 0032 LYS N 2.199 H A 0031 GLY O
H A 0033 LYS N 2.190 H A 0032 LYS O
H A 0034 LEU N 2.193 H A 0033 LYS O
H A 0035 GLU N 3.026 H A 0031 GLY O
H A 0035 GLU N 2.195 H A 0034 LEU O
H A 0036 GLU N 3.138 H A 0032 LYS O
H A 0036 GLU N 3.124 H A 0033 LYS O
H A 0036 GLU N 2.194 H A 0035 GLU O
H A 0037 ARG N 2.820 H A 0034 LEU O
H A 0037 ARG N 3.110 H A 0035 GLU O
H A 0037 ARG N 2.200 H A 0036 GLU O
C A 0038 GLY N 3.074 H A 0035 GLU O
C A 0038 GLY N 2.202 H A 0037 ARG O
C A 0039 PHE N 3.098 H A 0034 LEU O
C A 0039 PHE N 2.195 C A 0038 GLY O
C A 0040 ASP N 2.201 C A 0039 PHE O
C A 0041 LYS N 2.202 C A 0040 ASP O
H A 0042 ALA N 2.198 C A 0041 LYS O
H A 0043 TYR N 2.192 H A 0042 ALA O
H A 0044 VAL N 2.906 H A 0042 ALA O
H A 0044 VAL N 2.190 H A 0043 TYR O
H A 0045 VAL N 2.796 H A 0042 ALA O
H A 0045 VAL N 2.208 H A 0044 VAL O
H A 0046 LEU N 2.874 H A 0042 ALA O
H A 0046 LEU N 2.198 H A 0045 VAL O
H A 0047 GLY N 3.181 H A 0045 VAL O
H A 0047 GLY N 2.199 H A 0046 LEU O
H A 0048 GLN N 3.046 H A 0045 VAL O
H A 0048 GLN N 2.193 H A 0047 GLY O
H A 0049 PHE N 3.058 H A 0046 LEU O
H A 0049 PHE N 2.198 H A 0048 GLN O
H A 0050 LEU N 3.143 H A 0046 LEU O
H A 0050 LEU N 2.986 H A 0047 GLY O
H A 0050 LEU N 2.194 H A 0049 PHE O
H A 0051 VAL N 2.900 H A 0047 GLY O
H A 0051 VAL N 3.063 H A 0048 GLN O
H A 0051 VAL N 2.195 H A 0050 LEU O
C A 0052 LEU N 3.087 H A 0048 GLN O
C A 0052 LEU N 2.195 H A 0051 VAL O
C A 0053 LYS N 3.085 H A 0050 LEU O
C A 0053 LYS N 2.188 C A 0052 LEU O
C A 0054 LYS N 2.824 C A 0052 LEU O
C A 0054 LYS N 2.207 C A 0053 LYS O
C A 0055 ASP N 2.724 C A 0052 LEU O
C A 0055 ASP N 3.046 C A 0053 LYS O
C A 0055 ASP N 2.184 C A 0054 LYS O
H A 0056 GLU N 3.030 C A 0054 LYS O
H A 0056 GLU N 2.200 C A 0055 ASP O
H A 0057 ASP N 2.191 H A 0056 GLU O
H A 0058 LEU N 2.187 H A 0057 ASP O
H A 0059 PHE N 2.935 C A 0055 ASP O
H A 0059 PHE N 2.196 H A 0058 LEU O
H A 0060 ARG N 2.921 H A 0056 GLU O
H A 0060 ARG N 2.199 H A 0059 PHE O
H A 0061 GLU N 3.110 H A 0057 ASP O
H A 0061 GLU N 2.193 H A 0060 ARG O
H A 0062 TRP N 3.020 H A 0058 LEU O
H A 0062 TRP N 3.112 H A 0059 PHE O
H A 0062 TRP N 2.190 H A 0061 GLU O
H A 0063 LEU N 3.129 H A 0059 PHE O
H A 0063 LEU N 2.187 H A 0062 TRP O
H A 0064 LYS N 2.989 H A 0060 ARG O
H A 0064 LYS N 2.194 H A 0063 LEU O
H A 0065 ASP N 2.783 H A 0061 GLU O
H A 0065 ASP N 2.196 H A 0064 LYS O
H A 0066 THR N 2.799 H A 0062 TRP O
H A 0066 THR N 3.110 H A 0063 LEU O
H A 0066 THR N 2.198 H A 0065 ASP O
H A 0067 CYS N 2.826 H A 0063 LEU O
H A 0067 CYS N 2.200 H A 0066 THR O
C A 0068 GLY N 2.620 H A 0064 LYS O
C A 0068 GLY N 2.199 H A 0067 CYS O
C A 0069 ALA N 2.199 C A 0068 GLY O
C A 0070 ASN N 2.193 C A 0069 ALA O
H A 0071 ALA N 2.200 C A 0070 ASN O
H A 0072 LYS N 3.151 C A 0070 ASN O
H A 0072 LYS N 2.191 H A 0071 ALA O
H A 0073 GLN N 3.118 C A 0070 ASN O
H A 0073 GLN N 2.201 H A 0072 LYS O
H A 0074 SER N 3.066 C A 0070 ASN O
H A 0074 SER N 2.194 H A 0073 GLN O
H A 0075 ARG N 2.198 H A 0074 SER O
H A 0076 ASP N 2.190 H A 0075 ARG O
H A 0077 CYS N 2.191 H A 0076 ASP O
H A 0078 PHE N 3.083 H A 0074 SER O
H A 0078 PHE N 2.192 H A 0077 CYS O
H A 0079 GLY N 2.196 H A 0078 PHE O
H A 0080 CYS N 2.943 H A 0076 ASP O
H A 0080 CYS N 3.145 H A 0078 PHE O
H A 0080 CYS N 2.187 H A 0079 GLY O
H A 0081 LEU N 2.749 H A 0077 CYS O
H A 0081 LEU N 3.158 H A 0078 PHE O
H A 0081 LEU N 2.192 H A 0080 CYS O
H A 0082 ARG N 2.645 H A 0078 PHE O
H A 0082 ARG N 2.200 H A 0081 LEU O
H A 0083 GLU N 2.826 H A 0079 GLY O
H A 0083 GLU N 2.195 H A 0082 ARG O
H A 0084 TRP N 3.101 H A 0080 CYS O
H A 0084 TRP N 2.193 H A 0083 GLU O
H A 0085 CYS N 3.079 H A 0081 LEU O
H A 0085 CYS N 2.199 H A 0084 TRP O
H A 0086 ASP N 3.105 H A 0082 ARG O
H A 0086 ASP N 3.103 H A 0083 GLU O
H A 0086 ASP N 2.196 H A 0085 CYS O
H A 0087 ALA N 3.193 H A 0083 GLU O
H A 0087 ALA N 3.004 H A 0084 TRP O
H A 0087 ALA N 3.110 H A 0085 CYS O
H A 0087 ALA N 2.199 H A 0086 ASP O
C A 0088 PHE N 2.830 H A 0084 TRP O
C A 0088 PHE N 2.202 H A 0087 ALA O
C A 0089 LEU N 3.111 H A 0085 CYS O
C A 0089 LEU N 2.196 C A 0088 PHE O
HB_MS 2.00 3.20 3
C A 0041 LYS N 2.734 C A 0040 ASP OD1
H A 0062 TRP O 2.325 H A 0066 THR OG1
H A 0075 ARG N 2.775 H A 0074 SER OG
AROMATIC 0.00 8.00 5
C A 0039 PHE 5.837 H A 0062 TRP
C A 0041 LYS 5.606 H A 0043 TYR
H A 0049 PHE 5.949 H A 0078 PHE
H A 0082 ARG 5.007 H A 0078 PHE
H A 0049 PHE 5.591 H A 0059 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 8
C A 0015 MET CG 3.688 C B 0089 LEU CD1
H A 0050 LEU CD1 3.481 H B 0050 LEU CD1
H A 0084 TRP CZ2 3.741 C B 0089 LEU CD1
H A 0084 TRP CH2 3.394 C B 0089 LEU CD1
C A 0089 LEU CD1 3.662 C B 0015 MET CG
C A 0089 LEU CD1 3.715 C B 0015 MET CE
C A 0089 LEU CD1 3.761 H B 0084 TRP CZ2
C A 0089 LEU CD1 3.402 H B 0084 TRP CH2
CHARGE_ATTR 2.00 12.00 26
C A 0017 GLU OE1 9.621 C B 0053 LYS NZ
C A 0017 GLU OE2 9.035 C B 0053 LYS NZ
C A 0017 GLU OE1 8.421 C B 0054 LYS NZ
C A 0017 GLU OE2 6.425 C B 0054 LYS NZ
C A 0017 GLU OE2 11.79 H B 0082 ARG NH1
C A 0017 GLU OE2 10.43 H B 0082 ARG NH2
H A 0035 GLU OE1 10.68 C B 0053 LYS NZ
H A 0035 GLU OE2 9.844 C B 0053 LYS NZ
C A 0040 ASP OD1 2.769 C B 0053 LYS NZ
C A 0040 ASP OD2 3.691 C B 0053 LYS NZ
C A 0040 ASP OD1 11.99 C B 0054 LYS NZ
C A 0041 LYS NZ 10.90 C B 0055 ASP OD1
C A 0041 LYS NZ 11.14 C B 0055 ASP OD2
C A 0053 LYS NZ 9.779 C B 0017 GLU OE1
C A 0053 LYS NZ 9.247 C B 0017 GLU OE2
C A 0053 LYS NZ 10.44 H B 0035 GLU OE1
C A 0053 LYS NZ 9.630 H B 0035 GLU OE2
C A 0053 LYS NZ 2.559 C B 0040 ASP OD1
C A 0053 LYS NZ 3.586 C B 0040 ASP OD2
C A 0054 LYS NZ 8.234 C B 0017 GLU OE1
C A 0054 LYS NZ 6.243 C B 0017 GLU OE2
C A 0054 LYS NZ 11.73 C B 0040 ASP OD1
C A 0055 ASP OD1 10.73 C B 0041 LYS NZ
C A 0055 ASP OD2 11.01 C B 0041 LYS NZ
H A 0082 ARG NH1 11.48 C B 0017 GLU OE2
H A 0082 ARG NH2 10.09 C B 0017 GLU OE2
CHARGE_REPU 2.00 12.00 20
C A 0017 GLU OE2 10.85 C B 0055 ASP OD1
C A 0017 GLU OE2 11.75 C B 0055 ASP OD2
C A 0017 GLU OE2 10.35 H B 0086 ASP OD1
C A 0040 ASP OD1 10.85 C B 0055 ASP OD1
C A 0040 ASP OD1 9.969 C B 0055 ASP OD2
C A 0040 ASP OD2 10.49 C B 0055 ASP OD1
C A 0040 ASP OD2 9.830 C B 0055 ASP OD2
C A 0041 LYS NZ 6.208 C B 0053 LYS NZ
C A 0041 LYS NZ 9.029 C B 0054 LYS NZ
C A 0053 LYS NZ 6.320 C B 0041 LYS NZ
C A 0054 LYS NZ 8.779 C B 0041 LYS NZ
C A 0055 ASP OD1 10.80 C B 0017 GLU OE2
C A 0055 ASP OD2 11.74 C B 0017 GLU OE2
C A 0055 ASP OD1 10.59 C B 0040 ASP OD1
C A 0055 ASP OD1 10.20 C B 0040 ASP OD2
C A 0055 ASP OD2 9.730 C B 0040 ASP OD1
C A 0055 ASP OD2 9.575 C B 0040 ASP OD2
H A 0086 ASP OD1 11.90 C B 0017 GLU OE1
H A 0086 ASP OD1 10.05 C B 0017 GLU OE2
H A 0086 ASP OD2 11.89 C B 0017 GLU OE2
AROMATIC 0.00 8.00 3
H A 0043 TYR 5.222 C B 0053 LYS
C A 0053 LYS 5.351 H B 0043 TYR
C A 0053 LYS 7.936 C B 0039 PHE
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
HYDROPHOBIC 2.00 3.80 342
C B 0001 MET C 2.437 C B 0002 THR CA
C B 0001 MET C 3.261 C B 0002 THR C
C B 0001 MET C 3.635 C B 0002 THR CB
C B 0002 THR C 2.422 C B 0003 THR CA
C B 0002 THR C 3.057 C B 0003 THR C
C B 0002 THR C 3.686 C B 0003 THR CB
C B 0003 THR C 2.426 C B 0004 SER CA
C B 0003 THR C 3.039 C B 0004 SER C
C B 0003 THR C 3.696 C B 0004 SER CB
C B 0004 SER C 2.427 H B 0005 GLN CA
C B 0004 SER C 2.945 H B 0005 GLN C
C B 0004 SER C 3.693 H B 0005 GLN CB
H B 0005 GLN C 2.424 H B 0006 LYS CA
H B 0005 GLN C 2.982 H B 0006 LYS C
H B 0005 GLN C 3.701 H B 0006 LYS CB
H B 0006 LYS C 2.419 H B 0007 HIS CA
H B 0006 LYS C 2.945 H B 0007 HIS C
H B 0006 LYS C 3.693 H B 0007 HIS CB
H B 0007 HIS C 2.429 H B 0008 ARG CA
H B 0007 HIS C 3.071 H B 0008 ARG C
H B 0007 HIS C 3.682 H B 0008 ARG CB
H B 0007 HIS CE1 3.617 H B 0083 GLU CD
H B 0008 ARG C 2.417 H B 0009 ASP CA
H B 0008 ARG C 3.080 H B 0009 ASP C
H B 0008 ARG C 3.684 H B 0009 ASP CB
H B 0008 ARG CA 3.720 H B 0011 VAL CG2
H B 0008 ARG C 3.769 H B 0011 VAL CG2
H B 0009 ASP C 2.427 H B 0010 PHE CA
H B 0009 ASP C 3.046 H B 0010 PHE C
H B 0009 ASP C 3.686 H B 0010 PHE CB
H B 0010 PHE C 2.426 H B 0011 VAL CA
H B 0010 PHE C 3.187 H B 0011 VAL C
H B 0010 PHE C 3.656 H B 0011 VAL CB
H B 0010 PHE CE1 3.719 C B 0015 MET CB
H B 0010 PHE CZ 3.764 C B 0015 MET CB
H B 0010 PHE CE1 3.625 C B 0023 LEU CD2
H B 0010 PHE CZ 3.411 C B 0023 LEU CD2
H B 0010 PHE CD2 3.670 H B 0084 TRP CD1
H B 0010 PHE CE2 3.660 H B 0084 TRP CG
H B 0010 PHE CE2 3.283 H B 0084 TRP CD1
H B 0011 VAL C 2.449 H B 0012 ALA CA
H B 0011 VAL C 3.502 H B 0012 ALA C
H B 0011 VAL C 3.492 H B 0012 ALA CB
H B 0012 ALA C 2.424 C B 0013 GLU CA
H B 0012 ALA C 3.659 C B 0013 GLU C
H B 0012 ALA C 3.187 C B 0013 GLU CB
H B 0012 ALA C 3.523 C B 0013 GLU CG
C B 0013 GLU CA 2.936 C B 0014 PRO CD
C B 0013 GLU C 2.453 C B 0014 PRO CA
C B 0013 GLU C 2.911 C B 0014 PRO C
C B 0013 GLU C 3.615 C B 0014 PRO CB
C B 0013 GLU C 3.669 C B 0014 PRO CG
C B 0013 GLU C 2.497 C B 0014 PRO CD
C B 0013 GLU CB 3.501 C B 0014 PRO CD
C B 0013 GLU C 3.708 C B 0088 PHE CZ
C B 0014 PRO C 2.428 C B 0015 MET CA
C B 0014 PRO C 3.246 C B 0015 MET C
C B 0014 PRO C 3.633 C B 0015 MET CB
C B 0014 PRO CA 3.739 C B 0088 PHE CZ
C B 0015 MET C 2.428 C B 0016 GLY CA
C B 0015 MET C 2.904 C B 0016 GLY C
C B 0015 MET CE 3.252 H B 0046 LEU CD2
C B 0015 MET CE 3.688 H B 0084 TRP CD2
C B 0015 MET CE 3.455 H B 0084 TRP CE2
C B 0015 MET CE 3.462 H B 0084 TRP CZ2
C B 0015 MET CE 3.685 H B 0084 TRP CH2
C B 0016 GLY C 2.450 C B 0017 GLU CA
C B 0016 GLY C 3.419 C B 0017 GLU C
C B 0016 GLY C 3.569 C B 0017 GLU CB
C B 0016 GLY C 3.760 C B 0017 GLU CG
C B 0017 GLU C 2.418 C B 0018 LYS CA
C B 0017 GLU C 2.946 C B 0018 LYS C
C B 0017 GLU C 3.686 C B 0018 LYS CB
C B 0018 LYS CA 2.923 C B 0019 PRO CD
C B 0018 LYS C 2.465 C B 0019 PRO CA
C B 0018 LYS C 3.106 C B 0019 PRO C
C B 0018 LYS C 3.662 C B 0019 PRO CB
C B 0018 LYS C 3.633 C B 0019 PRO CG
C B 0018 LYS C 2.492 C B 0019 PRO CD
C B 0018 LYS CB 3.534 C B 0019 PRO CD
C B 0019 PRO C 2.432 H B 0020 VAL CA
C B 0019 PRO C 2.937 H B 0020 VAL C
C B 0019 PRO C 3.694 H B 0020 VAL CB
H B 0020 VAL C 2.431 H B 0021 GLY CA
H B 0020 VAL C 2.951 H B 0021 GLY C
H B 0020 VAL CG2 3.719 H B 0045 VAL CG2
H B 0021 GLY C 2.423 H B 0022 SER CA
H B 0021 GLY C 3.149 H B 0022 SER C
H B 0021 GLY C 3.663 H B 0022 SER CB
H B 0022 SER C 2.420 C B 0023 LEU CA
H B 0022 SER C 2.984 C B 0023 LEU C
H B 0022 SER C 3.695 C B 0023 LEU CB
C B 0023 LEU C 2.416 C B 0024 ALA CA
C B 0023 LEU C 2.996 C B 0024 ALA C
C B 0023 LEU C 3.687 C B 0024 ALA CB
C B 0024 ALA C 2.441 C B 0025 GLY CA
C B 0024 ALA C 3.342 C B 0025 GLY C
C B 0025 GLY C 2.438 C B 0026 ILE CA
C B 0025 GLY C 3.298 C B 0026 ILE C
C B 0025 GLY C 3.625 C B 0026 ILE CB
C B 0025 GLY C 3.778 C B 0026 ILE CG1
C B 0025 GLY C 3.730 C B 0026 ILE CD1
C B 0026 ILE C 2.425 C B 0027 GLY CA
C B 0026 ILE C 3.237 C B 0027 GLY C
C B 0026 ILE CG2 3.766 H B 0030 LEU CB
C B 0027 GLY C 2.425 H B 0028 GLU CA
C B 0027 GLY C 2.967 H B 0028 GLU C
C B 0027 GLY C 3.696 H B 0028 GLU CB
H B 0028 GLU C 2.421 H B 0029 VAL CA
H B 0028 GLU C 3.026 H B 0029 VAL C
H B 0028 GLU C 3.686 H B 0029 VAL CB
H B 0029 VAL C 2.425 H B 0030 LEU CA
H B 0029 VAL C 3.011 H B 0030 LEU C
H B 0029 VAL C 3.693 H B 0030 LEU CB
H B 0030 LEU C 2.419 H B 0031 GLY CA
H B 0030 LEU C 2.966 H B 0031 GLY C
H B 0030 LEU CD1 3.643 H B 0073 GLN CD
H B 0031 GLY C 2.434 H B 0032 LYS CA
H B 0031 GLY C 3.043 H B 0032 LYS C
H B 0031 GLY C 3.703 H B 0032 LYS CB
H B 0032 LYS C 2.416 H B 0033 LYS CA
H B 0032 LYS C 3.006 H B 0033 LYS C
H B 0032 LYS C 3.687 H B 0033 LYS CB
H B 0033 LYS C 2.422 H B 0034 LEU CA
H B 0033 LYS C 2.979 H B 0034 LEU C
H B 0033 LYS C 3.693 H B 0034 LEU CB
H B 0034 LEU C 2.412 H B 0035 GLU CA
H B 0034 LEU C 2.942 H B 0035 GLU C
H B 0034 LEU C 3.697 H B 0035 GLU CB
H B 0034 LEU CD2 3.687 H B 0066 THR CG2
H B 0035 GLU C 2.418 H B 0036 GLU CA
H B 0035 GLU C 3.012 H B 0036 GLU C
H B 0035 GLU C 3.687 H B 0036 GLU CB
H B 0036 GLU C 2.428 H B 0037 ARG CA
H B 0036 GLU C 3.259 H B 0037 ARG C
H B 0036 GLU C 3.634 H B 0037 ARG CB
H B 0037 ARG C 2.445 C B 0038 GLY CA
H B 0037 ARG C 3.404 C B 0038 GLY C
H B 0037 ARG CD 3.532 H B 0066 THR CG2
C B 0038 GLY C 2.434 C B 0039 PHE CA
C B 0038 GLY C 3.333 C B 0039 PHE C
C B 0038 GLY C 3.585 C B 0039 PHE CB
C B 0038 GLY C 3.742 C B 0039 PHE CG
C B 0039 PHE C 2.425 C B 0040 ASP CA
C B 0039 PHE C 3.158 C B 0040 ASP C
C B 0039 PHE C 3.664 C B 0040 ASP CB
C B 0039 PHE CD1 3.351 H B 0044 VAL CG1
C B 0039 PHE CE1 3.648 H B 0044 VAL CG1
C B 0039 PHE CB 3.798 H B 0045 VAL CG2
C B 0039 PHE CD1 3.638 H B 0045 VAL CG2
C B 0040 ASP C 2.443 C B 0041 LYS CA
C B 0040 ASP C 3.541 C B 0041 LYS C
C B 0040 ASP C 3.421 C B 0041 LYS CB
C B 0040 ASP C 3.402 C B 0041 LYS CG
C B 0040 ASP CG 3.737 C B 0041 LYS CG
C B 0041 LYS C 2.430 H B 0042 ALA CA
C B 0041 LYS C 3.051 H B 0042 ALA C
C B 0041 LYS C 3.691 H B 0042 ALA CB
C B 0041 LYS CB 3.494 H B 0043 TYR CD2
C B 0041 LYS CB 3.056 H B 0043 TYR CE2
C B 0041 LYS CB 3.523 H B 0043 TYR CZ
C B 0041 LYS CG 3.472 H B 0043 TYR CE2
H B 0042 ALA C 2.425 H B 0043 TYR CA
H B 0042 ALA C 2.993 H B 0043 TYR C
H B 0042 ALA C 3.721 H B 0043 TYR CB
H B 0043 TYR C 2.417 H B 0044 VAL CA
H B 0043 TYR C 3.080 H B 0044 VAL C
H B 0043 TYR C 3.688 H B 0044 VAL CB
H B 0043 TYR CD1 3.537 H B 0044 VAL CG2
H B 0043 TYR CE1 3.238 H B 0044 VAL CG2
H B 0044 VAL C 2.430 H B 0045 VAL CA
H B 0044 VAL C 3.084 H B 0045 VAL C
H B 0044 VAL C 3.688 H B 0045 VAL CB
H B 0045 VAL C 2.417 H B 0046 LEU CA
H B 0045 VAL C 2.912 H B 0046 LEU C
H B 0045 VAL C 3.698 H B 0046 LEU CB
H B 0046 LEU C 2.430 H B 0047 GLY CA
H B 0046 LEU C 2.986 H B 0047 GLY C
H B 0047 GLY C 2.419 H B 0048 GLN CA
H B 0047 GLY C 2.948 H B 0048 GLN C
H B 0047 GLY C 3.692 H B 0048 GLN CB
H B 0048 GLN C 2.438 H B 0049 PHE CA
H B 0048 GLN C 2.962 H B 0049 PHE C
H B 0048 GLN C 3.694 H B 0049 PHE CB
H B 0049 PHE C 2.417 H B 0050 LEU CA
H B 0049 PHE C 3.020 H B 0050 LEU C
H B 0049 PHE C 3.689 H B 0050 LEU CB
H B 0049 PHE CE1 3.610 C B 0054 LYS CA
H B 0049 PHE CE2 3.639 C B 0054 LYS CG
H B 0049 PHE CZ 3.748 C B 0054 LYS CA
H B 0049 PHE CZ 3.663 C B 0054 LYS CB
H B 0049 PHE CZ 3.571 C B 0054 LYS CG
H B 0049 PHE CD1 3.654 H B 0059 PHE CD1
H B 0050 LEU C 2.433 H B 0051 VAL CA
H B 0050 LEU C 3.028 H B 0051 VAL C
H B 0050 LEU C 3.704 H B 0051 VAL CB
H B 0050 LEU CD2 3.499 C B 0089 LEU CD2
H B 0051 VAL C 2.432 C B 0052 LEU CA
H B 0051 VAL C 3.246 C B 0052 LEU C
H B 0051 VAL C 3.638 C B 0052 LEU CB
C B 0052 LEU C 2.416 C B 0053 LYS CA
C B 0052 LEU C 2.880 C B 0053 LYS C
C B 0052 LEU C 3.055 C B 0053 LYS CB
C B 0052 LEU C 3.648 C B 0053 LYS CG
C B 0052 LEU CD1 3.462 H B 0059 PHE CA
C B 0053 LYS C 2.459 C B 0054 LYS CA
C B 0053 LYS C 3.054 C B 0054 LYS C
C B 0053 LYS C 2.998 C B 0054 LYS CB
C B 0053 LYS C 3.350 C B 0054 LYS CG
C B 0054 LYS C 2.406 C B 0055 ASP CA
C B 0054 LYS C 2.984 C B 0055 ASP C
C B 0054 LYS C 3.679 C B 0055 ASP CB
C B 0055 ASP C 2.443 H B 0056 GLU CA
C B 0055 ASP C 3.093 H B 0056 GLU C
C B 0055 ASP C 3.695 H B 0056 GLU CB
C B 0055 ASP CB 3.736 H B 0058 LEU CD1
H B 0056 GLU C 2.427 H B 0057 ASP CA
H B 0056 GLU C 3.066 H B 0057 ASP C
H B 0056 GLU C 3.694 H B 0057 ASP CB
H B 0056 GLU CA 3.766 H B 0078 PHE CD1
H B 0056 GLU CA 3.450 H B 0078 PHE CE1
H B 0056 GLU CB 3.478 H B 0078 PHE CE1
H B 0056 GLU CG 3.685 H B 0078 PHE CD1
H B 0057 ASP CA 3.797 H B 0058 LEU CA
H B 0057 ASP C 2.398 H B 0058 LEU CA
H B 0057 ASP C 3.019 H B 0058 LEU C
H B 0057 ASP C 3.678 H B 0058 LEU CB
H B 0058 LEU C 2.415 H B 0059 PHE CA
H B 0058 LEU C 3.012 H B 0059 PHE C
H B 0058 LEU C 3.690 H B 0059 PHE CB
H B 0059 PHE C 2.426 H B 0060 ARG CA
H B 0059 PHE C 3.001 H B 0060 ARG C
H B 0059 PHE C 3.712 H B 0060 ARG CB
H B 0059 PHE CE1 3.524 H B 0081 LEU CD1
H B 0059 PHE CZ 3.309 H B 0081 LEU CD1
H B 0060 ARG C 2.411 H B 0061 GLU CA
H B 0060 ARG C 2.975 H B 0061 GLU C
H B 0060 ARG C 3.698 H B 0061 GLU CB
H B 0060 ARG CG 3.771 H B 0074 SER CB
H B 0061 GLU C 2.407 H B 0062 TRP CA
H B 0061 GLU C 2.977 H B 0062 TRP C
H B 0061 GLU C 3.695 H B 0062 TRP CB
H B 0062 TRP C 2.418 H B 0063 LEU CA
H B 0062 TRP C 3.051 H B 0063 LEU C
H B 0062 TRP C 3.679 H B 0063 LEU CB
H B 0062 TRP CE3 3.467 H B 0063 LEU CA
H B 0062 TRP CE3 3.766 H B 0063 LEU CB
H B 0063 LEU C 2.424 H B 0064 LYS CA
H B 0063 LEU C 2.978 H B 0064 LYS C
H B 0063 LEU C 3.703 H B 0064 LYS CB
H B 0063 LEU CG 3.753 C B 0069 ALA CB
H B 0064 LYS C 2.423 H B 0065 ASP CA
H B 0064 LYS C 3.043 H B 0065 ASP C
H B 0064 LYS C 3.691 H B 0065 ASP CB
H B 0065 ASP C 2.427 H B 0066 THR CA
H B 0065 ASP C 3.172 H B 0066 THR C
H B 0065 ASP C 3.675 H B 0066 THR CB
H B 0066 THR C 2.442 H B 0067 CYS CA
H B 0066 THR C 3.611 H B 0067 CYS C
H B 0066 THR C 3.369 H B 0067 CYS CB
H B 0067 CYS C 2.440 C B 0068 GLY CA
H B 0067 CYS C 3.359 C B 0068 GLY C
C B 0068 GLY C 2.431 C B 0069 ALA CA
C B 0068 GLY C 2.899 C B 0069 ALA C
C B 0068 GLY C 3.693 C B 0069 ALA CB
C B 0069 ALA C 2.427 C B 0070 ASN CA
C B 0069 ALA C 3.217 C B 0070 ASN C
C B 0069 ALA C 3.647 C B 0070 ASN CB
C B 0070 ASN C 2.434 H B 0071 ALA CA
C B 0070 ASN C 2.997 H B 0071 ALA C
C B 0070 ASN C 3.702 H B 0071 ALA CB
H B 0071 ALA C 2.415 H B 0072 LYS CA
H B 0071 ALA C 3.056 H B 0072 LYS C
H B 0071 ALA C 3.684 H B 0072 LYS CB
H B 0072 LYS C 2.430 H B 0073 GLN CA
H B 0072 LYS C 3.041 H B 0073 GLN C
H B 0072 LYS C 3.691 H B 0073 GLN CB
H B 0073 GLN C 2.415 H B 0074 SER CA
H B 0073 GLN C 3.011 H B 0074 SER C
H B 0073 GLN C 3.683 H B 0074 SER CB
H B 0074 SER C 2.426 H B 0075 ARG CA
H B 0074 SER C 2.983 H B 0075 ARG C
H B 0074 SER C 3.711 H B 0075 ARG CB
H B 0075 ARG C 2.424 H B 0076 ASP CA
H B 0075 ARG C 3.054 H B 0076 ASP C
H B 0075 ARG C 3.693 H B 0076 ASP CB
H B 0076 ASP C 2.413 H B 0077 CYS CA
H B 0076 ASP C 3.038 H B 0077 CYS C
H B 0076 ASP C 3.681 H B 0077 CYS CB
H B 0077 CYS C 2.406 H B 0078 PHE CA
H B 0077 CYS C 2.951 H B 0078 PHE C
H B 0077 CYS C 3.693 H B 0078 PHE CB
H B 0078 PHE C 2.421 H B 0079 GLY CA
H B 0078 PHE C 2.970 H B 0079 GLY C
H B 0078 PHE CE2 3.461 H B 0082 ARG CD
H B 0079 GLY C 2.408 H B 0080 CYS CA
H B 0079 GLY C 3.002 H B 0080 CYS C
H B 0079 GLY C 3.684 H B 0080 CYS CB
H B 0080 CYS C 2.403 H B 0081 LEU CA
H B 0080 CYS C 3.028 H B 0081 LEU C
H B 0080 CYS C 3.673 H B 0081 LEU CB
H B 0081 LEU C 2.427 H B 0082 ARG CA
H B 0081 LEU C 3.009 H B 0082 ARG C
H B 0081 LEU C 3.708 H B 0082 ARG CB
H B 0082 ARG C 2.422 H B 0083 GLU CA
H B 0082 ARG C 3.056 H B 0083 GLU C
H B 0082 ARG C 3.692 H B 0083 GLU CB
H B 0083 GLU C 2.422 H B 0084 TRP CA
H B 0083 GLU C 2.947 H B 0084 TRP C
H B 0083 GLU C 3.695 H B 0084 TRP CB
H B 0084 TRP C 2.428 H B 0085 CYS CA
H B 0084 TRP C 2.967 H B 0085 CYS C
H B 0084 TRP C 3.702 H B 0085 CYS CB
H B 0084 TRP CE3 3.798 H B 0085 CYS CA
H B 0084 TRP CG 3.771 C B 0088 PHE CD2
H B 0084 TRP CD1 3.625 C B 0088 PHE CD2
H B 0084 TRP CD1 3.625 C B 0088 PHE CE2
H B 0084 TRP CD2 3.331 C B 0088 PHE CD2
H B 0084 TRP CE2 3.515 C B 0088 PHE CG
H B 0084 TRP CE2 2.895 C B 0088 PHE CD2
H B 0084 TRP CE2 3.384 C B 0088 PHE CE2
H B 0084 TRP CE3 3.791 C B 0088 PHE CB
H B 0084 TRP CZ2 3.583 C B 0088 PHE CB
H B 0084 TRP CZ2 3.287 C B 0088 PHE CG
H B 0084 TRP CZ2 3.230 C B 0088 PHE CD2
H B 0084 TRP CZ3 3.393 C B 0088 PHE CB
H B 0084 TRP CH2 3.281 C B 0088 PHE CB
H B 0084 TRP CH2 3.583 C B 0088 PHE CG
H B 0085 CYS C 2.422 H B 0086 ASP CA
H B 0085 CYS C 2.958 H B 0086 ASP C
H B 0085 CYS C 3.694 H B 0086 ASP CB
H B 0085 CYS C 3.641 C B 0089 LEU C
H B 0086 ASP C 2.429 H B 0087 ALA CA
H B 0086 ASP C 3.225 H B 0087 ALA C
H B 0086 ASP C 3.650 H B 0087 ALA CB
H B 0087 ALA C 2.437 C B 0088 PHE CA
H B 0087 ALA C 3.386 C B 0088 PHE C
H B 0087 ALA C 3.560 C B 0088 PHE CB
H B 0087 ALA C 3.722 C B 0088 PHE CG
C B 0088 PHE C 2.429 C B 0089 LEU CA
C B 0088 PHE C 3.153 C B 0089 LEU C
C B 0088 PHE C 3.672 C B 0089 LEU CB
CHARGE_ATTR 2.00 12.00 111
H B 0009 ASP OD1 10.72 H B 0006 LYS NZ
H B 0009 ASP OD2 8.846 H B 0006 LYS NZ
H B 0009 ASP OD1 9.843 H B 0007 HIS ND1
H B 0009 ASP OD1 9.871 H B 0007 HIS NE2
H B 0009 ASP OD2 10.32 H B 0007 HIS ND1
H B 0009 ASP OD2 10.77 H B 0007 HIS NE2
H B 0009 ASP OD1 6.864 H B 0008 ARG NH1
H B 0009 ASP OD1 6.208 H B 0008 ARG NH2
H B 0009 ASP OD2 8.042 H B 0008 ARG NH1
H B 0009 ASP OD2 6.809 H B 0008 ARG NH2
H B 0009 ASP OD1 8.416 C B 0018 LYS NZ
H B 0009 ASP OD2 7.773 C B 0018 LYS NZ
C B 0013 GLU OE1 4.793 C B 0018 LYS NZ
C B 0013 GLU OE2 2.831 C B 0018 LYS NZ
C B 0017 GLU OE1 11.64 C B 0018 LYS NZ
C B 0017 GLU OE1 3.707 C B 0041 LYS NZ
C B 0017 GLU OE2 4.162 C B 0041 LYS NZ
H B 0028 GLU OE1 8.058 H B 0006 LYS NZ
H B 0028 GLU OE2 7.421 H B 0006 LYS NZ
H B 0028 GLU OE1 8.413 H B 0032 LYS NZ
H B 0028 GLU OE2 9.448 H B 0032 LYS NZ
H B 0035 GLU OE1 8.007 H B 0032 LYS NZ
H B 0035 GLU OE2 9.295 H B 0032 LYS NZ
H B 0035 GLU OE1 10.93 H B 0033 LYS NZ
H B 0035 GLU OE1 10.85 C B 0041 LYS NZ
H B 0035 GLU OE2 10.12 C B 0041 LYS NZ
H B 0036 GLU OE1 8.366 H B 0032 LYS NZ
H B 0036 GLU OE2 6.749 H B 0032 LYS NZ
H B 0036 GLU OE1 7.276 H B 0033 LYS NZ
H B 0036 GLU OE2 7.693 H B 0033 LYS NZ
H B 0036 GLU OE1 6.887 H B 0037 ARG NH1
H B 0036 GLU OE1 6.421 H B 0037 ARG NH2
H B 0036 GLU OE2 9.000 H B 0037 ARG NH1
H B 0036 GLU OE2 8.502 H B 0037 ARG NH2
C B 0040 ASP OD1 5.726 C B 0041 LYS NZ
C B 0040 ASP OD2 5.301 C B 0041 LYS NZ
C B 0055 ASP OD1 8.348 C B 0053 LYS NZ
C B 0055 ASP OD2 7.371 C B 0053 LYS NZ
C B 0055 ASP OD1 10.03 C B 0054 LYS NZ
C B 0055 ASP OD2 10.88 C B 0054 LYS NZ
C B 0055 ASP OD1 10.46 H B 0060 ARG NH2
C B 0055 ASP OD2 11.23 H B 0060 ARG NH2
C B 0055 ASP OD1 9.455 H B 0082 ARG NH1
C B 0055 ASP OD1 10.28 H B 0082 ARG NH2
C B 0055 ASP OD2 11.29 H B 0082 ARG NH1
H B 0056 GLU OE1 5.742 H B 0060 ARG NH1
H B 0056 GLU OE1 5.343 H B 0060 ARG NH2
H B 0056 GLU OE2 4.115 H B 0060 ARG NH1
H B 0056 GLU OE2 4.513 H B 0060 ARG NH2
H B 0056 GLU OE1 9.769 H B 0075 ARG NH1
H B 0056 GLU OE1 11.43 H B 0075 ARG NH2
H B 0056 GLU OE2 7.993 H B 0075 ARG NH1
H B 0056 GLU OE2 9.503 H B 0075 ARG NH2
H B 0056 GLU OE1 5.777 H B 0082 ARG NH1
H B 0056 GLU OE1 7.901 H B 0082 ARG NH2
H B 0056 GLU OE2 7.349 H B 0082 ARG NH1
H B 0056 GLU OE2 9.561 H B 0082 ARG NH2
H B 0057 ASP OD1 4.627 H B 0060 ARG NH1
H B 0057 ASP OD1 2.387 H B 0060 ARG NH2
H B 0057 ASP OD2 6.711 H B 0060 ARG NH1
H B 0057 ASP OD2 4.464 H B 0060 ARG NH2
H B 0057 ASP OD1 10.81 H B 0082 ARG NH1
H B 0057 ASP OD2 11.39 H B 0082 ARG NH1
H B 0061 GLU OE1 8.578 H B 0060 ARG NH1
H B 0061 GLU OE1 7.068 H B 0060 ARG NH2
H B 0061 GLU OE2 9.245 H B 0060 ARG NH1
H B 0061 GLU OE2 8.054 H B 0060 ARG NH2
H B 0061 GLU OE1 11.16 H B 0064 LYS NZ
H B 0061 GLU OE2 9.900 H B 0064 LYS NZ
H B 0065 ASP OD1 11.49 H B 0037 ARG NH1
H B 0065 ASP OD1 10.78 H B 0037 ARG NH2
H B 0065 ASP OD2 11.86 H B 0037 ARG NH1
H B 0065 ASP OD2 11.51 H B 0037 ARG NH2
H B 0065 ASP OD1 11.78 H B 0060 ARG NH1
H B 0065 ASP OD1 11.62 H B 0060 ARG NH2
H B 0065 ASP OD2 11.26 H B 0060 ARG NH1
H B 0065 ASP OD2 10.78 H B 0060 ARG NH2
H B 0065 ASP OD1 6.769 H B 0064 LYS NZ
H B 0065 ASP OD2 8.309 H B 0064 LYS NZ
H B 0076 ASP OD2 11.81 H B 0006 LYS NZ
H B 0076 ASP OD1 6.638 H B 0007 HIS ND1
H B 0076 ASP OD1 7.841 H B 0007 HIS NE2
H B 0076 ASP OD2 7.548 H B 0007 HIS ND1
H B 0076 ASP OD2 9.103 H B 0007 HIS NE2
H B 0076 ASP OD1 11.15 H B 0060 ARG NH1
H B 0076 ASP OD1 9.087 H B 0072 LYS NZ
H B 0076 ASP OD2 8.845 H B 0072 LYS NZ
H B 0076 ASP OD1 6.984 H B 0075 ARG NH1
H B 0076 ASP OD1 5.973 H B 0075 ARG NH2
H B 0076 ASP OD2 8.295 H B 0075 ARG NH1
H B 0076 ASP OD2 6.818 H B 0075 ARG NH2
H B 0083 GLU OE1 4.020 H B 0007 HIS ND1
H B 0083 GLU OE1 2.421 H B 0007 HIS NE2
H B 0083 GLU OE2 5.415 H B 0007 HIS ND1
H B 0083 GLU OE2 3.663 H B 0007 HIS NE2
H B 0083 GLU OE1 10.72 H B 0008 ARG NH1
H B 0083 GLU OE1 11.39 H B 0008 ARG NH2
H B 0083 GLU OE2 11.43 H B 0008 ARG NH1
H B 0083 GLU OE1 10.47 H B 0082 ARG NH1
H B 0083 GLU OE1 10.99 H B 0082 ARG NH2
H B 0083 GLU OE2 9.252 H B 0082 ARG NH1
H B 0083 GLU OE2 9.736 H B 0082 ARG NH2
H B 0086 ASP OD1 11.17 H B 0007 HIS NE2
H B 0086 ASP OD2 10.61 H B 0007 HIS ND1
H B 0086 ASP OD2 9.415 H B 0007 HIS NE2
H B 0086 ASP OD1 5.635 C B 0054 LYS NZ
H B 0086 ASP OD2 7.534 C B 0054 LYS NZ
H B 0086 ASP OD1 7.256 H B 0082 ARG NH1
H B 0086 ASP OD1 6.198 H B 0082 ARG NH2
H B 0086 ASP OD2 6.819 H B 0082 ARG NH1
H B 0086 ASP OD2 6.000 H B 0082 ARG NH2
CHARGE_REPU 2.00 12.00 82
H B 0006 LYS NZ 11.83 H B 0007 HIS ND1
H B 0006 LYS NZ 10.18 C B 0018 LYS NZ
H B 0007 HIS ND1 10.16 H B 0008 ARG NH1
H B 0007 HIS ND1 10.01 H B 0008 ARG NH2
H B 0007 HIS NE2 9.233 H B 0008 ARG NH1
H B 0007 HIS NE2 9.566 H B 0008 ARG NH2
H B 0009 ASP OD1 6.111 C B 0013 GLU OE1
H B 0009 ASP OD1 7.321 C B 0013 GLU OE2
H B 0009 ASP OD2 6.413 C B 0013 GLU OE1
H B 0009 ASP OD2 7.250 C B 0013 GLU OE2
H B 0009 ASP OD1 11.10 H B 0083 GLU OE1
C B 0017 GLU OE1 9.419 C B 0040 ASP OD1
C B 0017 GLU OE1 8.925 C B 0040 ASP OD2
C B 0017 GLU OE2 9.456 C B 0040 ASP OD1
C B 0017 GLU OE2 9.137 C B 0040 ASP OD2
H B 0028 GLU OE1 10.52 H B 0035 GLU OE1
H B 0032 LYS NZ 7.532 H B 0033 LYS NZ
H B 0033 LYS NZ 9.900 H B 0037 ARG NH1
H B 0033 LYS NZ 7.960 H B 0037 ARG NH2
H B 0035 GLU OE1 8.364 H B 0036 GLU OE1
H B 0035 GLU OE1 7.388 H B 0036 GLU OE2
H B 0035 GLU OE2 8.914 H B 0036 GLU OE1
H B 0035 GLU OE2 7.856 H B 0036 GLU OE2
H B 0035 GLU OE1 7.980 C B 0040 ASP OD1
H B 0035 GLU OE1 7.813 C B 0040 ASP OD2
H B 0035 GLU OE2 7.306 C B 0040 ASP OD1
H B 0035 GLU OE2 6.628 C B 0040 ASP OD2
C B 0053 LYS NZ 10.39 C B 0054 LYS NZ
C B 0054 LYS NZ 8.459 H B 0082 ARG NH1
C B 0054 LYS NZ 7.763 H B 0082 ARG NH2
C B 0055 ASP OD1 8.902 H B 0056 GLU OE1
C B 0055 ASP OD1 10.49 H B 0056 GLU OE2
C B 0055 ASP OD2 10.42 H B 0056 GLU OE1
C B 0055 ASP OD2 11.76 H B 0056 GLU OE2
C B 0055 ASP OD1 8.558 H B 0057 ASP OD1
C B 0055 ASP OD1 7.747 H B 0057 ASP OD2
C B 0055 ASP OD2 9.315 H B 0057 ASP OD1
C B 0055 ASP OD2 8.502 H B 0057 ASP OD2
C B 0055 ASP OD1 10.28 H B 0061 GLU OE1
C B 0055 ASP OD2 9.661 H B 0061 GLU OE1
C B 0055 ASP OD2 11.77 H B 0061 GLU OE2
H B 0056 GLU OE1 5.568 H B 0057 ASP OD1
H B 0056 GLU OE1 6.765 H B 0057 ASP OD2
H B 0056 GLU OE2 5.643 H B 0057 ASP OD1
H B 0056 GLU OE2 7.356 H B 0057 ASP OD2
H B 0056 GLU OE1 11.03 H B 0061 GLU OE1
H B 0056 GLU OE2 10.78 H B 0061 GLU OE1
H B 0056 GLU OE1 11.85 H B 0076 ASP OD1
H B 0056 GLU OE2 10.18 H B 0076 ASP OD1
H B 0056 GLU OE2 11.70 H B 0076 ASP OD2
H B 0056 GLU OE1 11.99 H B 0083 GLU OE2
H B 0056 GLU OE2 11.87 H B 0083 GLU OE2
H B 0056 GLU OE1 11.97 H B 0086 ASP OD2
H B 0057 ASP OD1 6.143 H B 0061 GLU OE1
H B 0057 ASP OD1 7.572 H B 0061 GLU OE2
H B 0057 ASP OD2 6.283 H B 0061 GLU OE1
H B 0057 ASP OD2 7.865 H B 0061 GLU OE2
H B 0057 ASP OD1 10.87 H B 0065 ASP OD2
H B 0057 ASP OD2 11.67 H B 0065 ASP OD2
H B 0060 ARG NH1 10.21 H B 0064 LYS NZ
H B 0060 ARG NH2 11.28 H B 0064 LYS NZ
H B 0060 ARG NH1 11.81 H B 0072 LYS NZ
H B 0060 ARG NH1 8.028 H B 0075 ARG NH1
H B 0060 ARG NH1 9.129 H B 0075 ARG NH2
H B 0060 ARG NH2 10.04 H B 0075 ARG NH1
H B 0060 ARG NH2 11.30 H B 0075 ARG NH2
H B 0060 ARG NH1 11.38 H B 0082 ARG NH1
H B 0060 ARG NH2 11.05 H B 0082 ARG NH1
H B 0061 GLU OE1 7.345 H B 0065 ASP OD1
H B 0061 GLU OE1 5.724 H B 0065 ASP OD2
H B 0061 GLU OE2 5.874 H B 0065 ASP OD1
H B 0061 GLU OE2 4.635 H B 0065 ASP OD2
H B 0072 LYS NZ 6.506 H B 0075 ARG NH1
H B 0072 LYS NZ 4.695 H B 0075 ARG NH2
H B 0076 ASP OD1 9.336 H B 0083 GLU OE1
H B 0076 ASP OD1 9.344 H B 0083 GLU OE2
H B 0076 ASP OD2 10.81 H B 0083 GLU OE1
H B 0076 ASP OD2 11.11 H B 0083 GLU OE2
H B 0083 GLU OE1 8.793 H B 0086 ASP OD1
H B 0083 GLU OE1 7.016 H B 0086 ASP OD2
H B 0083 GLU OE2 8.589 H B 0086 ASP OD1
H B 0083 GLU OE2 6.569 H B 0086 ASP OD2
HB_MM 2.00 3.20 155
C B 0002 THR N 2.200 C B 0001 MET O
C B 0003 THR N 2.193 C B 0002 THR O
C B 0004 SER N 2.199 C B 0003 THR O
H B 0005 GLN N 2.199 C B 0004 SER O
H B 0006 LYS N 2.860 C B 0004 SER O
H B 0006 LYS N 2.196 H B 0005 GLN O
H B 0007 HIS N 2.936 C B 0004 SER O
H B 0007 HIS N 2.191 H B 0006 LYS O
H B 0008 ARG N 2.197 H B 0007 HIS O
H B 0009 ASP N 2.978 H B 0005 GLN O
H B 0009 ASP N 3.143 H B 0006 LYS O
H B 0009 ASP N 2.193 H B 0008 ARG O
H B 0010 PHE N 2.714 H B 0006 LYS O
H B 0010 PHE N 2.195 H B 0009 ASP O
H B 0011 VAL N 2.196 H B 0010 PHE O
H B 0012 ALA N 3.178 H B 0009 ASP O
H B 0012 ALA N 3.136 H B 0010 PHE O
H B 0012 ALA N 2.206 H B 0011 VAL O
C B 0013 GLU N 2.192 H B 0012 ALA O
C B 0014 PRO N 2.205 C B 0013 GLU O
C B 0015 MET N 2.197 C B 0014 PRO O
C B 0016 GLY N 2.198 C B 0015 MET O
C B 0017 GLU N 2.206 C B 0016 GLY O
C B 0018 LYS N 2.191 C B 0017 GLU O
C B 0019 PRO N 2.205 C B 0018 LYS O
H B 0020 VAL N 2.203 C B 0019 PRO O
H B 0021 GLY N 3.193 C B 0019 PRO O
H B 0021 GLY N 2.202 H B 0020 VAL O
H B 0022 SER N 2.773 C B 0019 PRO O
H B 0022 SER N 2.529 H B 0020 VAL O
H B 0022 SER N 2.194 H B 0021 GLY O
C B 0023 LEU N 2.802 H B 0020 VAL O
C B 0023 LEU N 2.196 H B 0022 SER O
C B 0024 ALA N 2.195 C B 0023 LEU O
C B 0025 GLY N 2.202 C B 0024 ALA O
C B 0026 ILE N 2.200 C B 0025 GLY O
C B 0027 GLY N 2.194 C B 0026 ILE O
H B 0028 GLU N 2.199 C B 0027 GLY O
H B 0029 VAL N 2.192 H B 0028 GLU O
H B 0030 LEU N 3.188 C B 0027 GLY O
H B 0030 LEU N 2.196 H B 0029 VAL O
H B 0031 GLY N 2.829 C B 0027 GLY O
H B 0031 GLY N 2.194 H B 0030 LEU O
H B 0032 LYS N 2.198 H B 0031 GLY O
H B 0033 LYS N 2.190 H B 0032 LYS O
H B 0034 LEU N 2.193 H B 0033 LYS O
H B 0035 GLU N 3.023 H B 0031 GLY O
H B 0035 GLU N 2.195 H B 0034 LEU O
H B 0036 GLU N 3.137 H B 0032 LYS O
H B 0036 GLU N 3.125 H B 0033 LYS O
H B 0036 GLU N 2.194 H B 0035 GLU O
H B 0037 ARG N 2.815 H B 0034 LEU O
H B 0037 ARG N 3.111 H B 0035 GLU O
H B 0037 ARG N 2.199 H B 0036 GLU O
C B 0038 GLY N 3.075 H B 0035 GLU O
C B 0038 GLY N 2.202 H B 0037 ARG O
C B 0039 PHE N 3.099 H B 0034 LEU O
C B 0039 PHE N 2.195 C B 0038 GLY O
C B 0040 ASP N 2.201 C B 0039 PHE O
C B 0041 LYS N 2.204 C B 0040 ASP O
H B 0042 ALA N 2.197 C B 0041 LYS O
H B 0043 TYR N 2.192 H B 0042 ALA O
H B 0044 VAL N 2.898 H B 0042 ALA O
H B 0044 VAL N 2.189 H B 0043 TYR O
H B 0045 VAL N 2.790 H B 0042 ALA O
H B 0045 VAL N 2.209 H B 0044 VAL O
H B 0046 LEU N 2.872 H B 0042 ALA O
H B 0046 LEU N 2.196 H B 0045 VAL O
H B 0047 GLY N 3.175 H B 0045 VAL O
H B 0047 GLY N 2.199 H B 0046 LEU O
H B 0048 GLN N 3.050 H B 0045 VAL O
H B 0048 GLN N 2.192 H B 0047 GLY O
H B 0049 PHE N 3.062 H B 0046 LEU O
H B 0049 PHE N 2.197 H B 0048 GLN O
H B 0050 LEU N 3.142 H B 0046 LEU O
H B 0050 LEU N 2.990 H B 0047 GLY O
H B 0050 LEU N 2.194 H B 0049 PHE O
H B 0051 VAL N 2.896 H B 0047 GLY O
H B 0051 VAL N 3.063 H B 0048 GLN O
H B 0051 VAL N 2.196 H B 0050 LEU O
C B 0052 LEU N 3.084 H B 0048 GLN O
C B 0052 LEU N 2.196 H B 0051 VAL O
C B 0053 LYS N 3.093 H B 0050 LEU O
C B 0053 LYS N 2.188 C B 0052 LEU O
C B 0054 LYS N 2.835 C B 0052 LEU O
C B 0054 LYS N 2.207 C B 0053 LYS O
C B 0055 ASP N 2.733 C B 0052 LEU O
C B 0055 ASP N 3.051 C B 0053 LYS O
C B 0055 ASP N 2.185 C B 0054 LYS O
H B 0056 GLU N 3.034 C B 0054 LYS O
H B 0056 GLU N 2.199 C B 0055 ASP O
H B 0057 ASP N 2.191 H B 0056 GLU O
H B 0058 LEU N 2.186 H B 0057 ASP O
H B 0059 PHE N 2.933 C B 0055 ASP O
H B 0059 PHE N 2.195 H B 0058 LEU O
H B 0060 ARG N 2.924 H B 0056 GLU O
H B 0060 ARG N 2.201 H B 0059 PHE O
H B 0061 GLU N 3.113 H B 0057 ASP O
H B 0061 GLU N 2.192 H B 0060 ARG O
H B 0062 TRP N 3.019 H B 0058 LEU O
H B 0062 TRP N 3.113 H B 0059 PHE O
H B 0062 TRP N 2.189 H B 0061 GLU O
H B 0063 LEU N 3.131 H B 0059 PHE O
H B 0063 LEU N 2.187 H B 0062 TRP O
H B 0064 LYS N 2.992 H B 0060 ARG O
H B 0064 LYS N 2.195 H B 0063 LEU O
H B 0065 ASP N 2.783 H B 0061 GLU O
H B 0065 ASP N 2.195 H B 0064 LYS O
H B 0066 THR N 2.796 H B 0062 TRP O
H B 0066 THR N 3.113 H B 0063 LEU O
H B 0066 THR N 2.197 H B 0065 ASP O
H B 0067 CYS N 2.825 H B 0063 LEU O
H B 0067 CYS N 2.200 H B 0066 THR O
C B 0068 GLY N 2.616 H B 0064 LYS O
C B 0068 GLY N 2.199 H B 0067 CYS O
C B 0069 ALA N 2.197 C B 0068 GLY O
C B 0070 ASN N 2.195 C B 0069 ALA O
H B 0071 ALA N 2.200 C B 0070 ASN O
H B 0072 LYS N 3.149 C B 0070 ASN O
H B 0072 LYS N 2.193 H B 0071 ALA O
H B 0073 GLN N 3.112 C B 0070 ASN O
H B 0073 GLN N 2.200 H B 0072 LYS O
H B 0074 SER N 3.066 C B 0070 ASN O
H B 0074 SER N 2.195 H B 0073 GLN O
H B 0075 ARG N 2.197 H B 0074 SER O
H B 0076 ASP N 2.190 H B 0075 ARG O
H B 0077 CYS N 2.191 H B 0076 ASP O
H B 0078 PHE N 3.080 H B 0074 SER O
H B 0078 PHE N 2.191 H B 0077 CYS O
H B 0079 GLY N 2.195 H B 0078 PHE O
H B 0080 CYS N 2.942 H B 0076 ASP O
H B 0080 CYS N 3.140 H B 0078 PHE O
H B 0080 CYS N 2.186 H B 0079 GLY O
H B 0081 LEU N 2.747 H B 0077 CYS O
H B 0081 LEU N 3.152 H B 0078 PHE O
H B 0081 LEU N 2.192 H B 0080 CYS O
H B 0082 ARG N 2.645 H B 0078 PHE O
H B 0082 ARG N 2.198 H B 0081 LEU O
H B 0083 GLU N 2.829 H B 0079 GLY O
H B 0083 GLU N 2.193 H B 0082 ARG O
H B 0084 TRP N 3.103 H B 0080 CYS O
H B 0084 TRP N 2.193 H B 0083 GLU O
H B 0085 CYS N 3.081 H B 0081 LEU O
H B 0085 CYS N 2.201 H B 0084 TRP O
H B 0086 ASP N 3.105 H B 0082 ARG O
H B 0086 ASP N 3.103 H B 0083 GLU O
H B 0086 ASP N 2.196 H B 0085 CYS O
H B 0087 ALA N 3.191 H B 0083 GLU O
H B 0087 ALA N 3.002 H B 0084 TRP O
H B 0087 ALA N 3.108 H B 0085 CYS O
H B 0087 ALA N 2.198 H B 0086 ASP O
C B 0088 PHE N 2.829 H B 0084 TRP O
C B 0088 PHE N 2.202 H B 0087 ALA O
C B 0089 LEU N 3.112 H B 0085 CYS O
C B 0089 LEU N 2.197 C B 0088 PHE O
HB_MS 2.00 3.20 3
C B 0041 LYS N 2.732 C B 0040 ASP OD1
H B 0062 TRP O 2.327 H B 0066 THR OG1
H B 0075 ARG N 2.774 H B 0074 SER OG
AROMATIC 0.00 8.00 5
C B 0039 PHE 5.839 H B 0062 TRP
C B 0041 LYS 5.601 H B 0043 TYR
H B 0049 PHE 5.951 H B 0078 PHE
H B 0082 ARG 5.007 H B 0078 PHE
H B 0049 PHE 5.590 H B 0059 PHE