Complet list of 1jhb con file
Complete list of 1jhb.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 462
C A 0002 ALA C 2.470 C A 0003 GLN CA
C A 0002 ALA C 3.442 C A 0003 GLN C
C A 0002 ALA C 3.563 C A 0003 GLN CB
C A 0002 ALA C 3.733 C A 0003 GLN CG
C A 0002 ALA C 3.779 C A 0003 GLN CD
C A 0002 ALA CB 3.792 H A 0056 GLU CD
C A 0003 GLN C 2.468 H A 0004 GLU CA
C A 0003 GLN C 3.090 H A 0004 GLU C
C A 0003 GLN C 3.723 H A 0004 GLU CB
C A 0003 GLN CA 3.685 H A 0060 TYR CD2
C A 0003 GLN CA 3.758 H A 0060 TYR CE2
C A 0003 GLN CB 3.761 H A 0060 TYR CE1
C A 0003 GLN CG 3.462 H A 0060 TYR CD1
C A 0003 GLN CG 3.712 H A 0060 TYR CE1
H A 0004 GLU C 2.455 H A 0005 PHE CA
H A 0004 GLU C 2.978 H A 0005 PHE C
H A 0004 GLU C 3.755 H A 0005 PHE CB
H A 0005 PHE C 2.444 H A 0006 VAL CA
H A 0005 PHE C 2.993 H A 0006 VAL C
H A 0005 PHE C 3.718 H A 0006 VAL CB
H A 0005 PHE CE1 3.761 H A 0009 LYS CE
H A 0005 PHE CB 3.796 H A 0057 ILE CD1
H A 0006 VAL C 2.462 H A 0007 ASN CA
H A 0006 VAL C 3.009 H A 0007 ASN C
H A 0006 VAL C 3.728 H A 0007 ASN CB
H A 0006 VAL CG1 3.740 C A 0010 ILE CD1
H A 0006 VAL CA 3.794 E A 0018 PHE CE1
H A 0006 VAL CA 3.558 E A 0018 PHE CZ
H A 0006 VAL CG1 3.725 E A 0018 PHE CE2
H A 0006 VAL CG1 3.699 E A 0018 PHE CZ
H A 0006 VAL CG2 3.571 E A 0018 PHE CE1
H A 0006 VAL CG2 3.700 E A 0018 PHE CZ
H A 0006 VAL CG2 3.653 H A 0057 ILE CG2
H A 0006 VAL CG1 3.666 H A 0061 LEU CD2
H A 0006 VAL CG1 3.673 H A 0064 LEU CD2
H A 0007 ASN C 2.465 H A 0008 CYS CA
H A 0007 ASN C 3.233 H A 0008 CYS C
H A 0007 ASN C 3.683 H A 0008 CYS CB
H A 0008 CYS C 2.447 H A 0009 LYS CA
H A 0008 CYS C 3.046 H A 0009 LYS C
H A 0008 CYS C 3.754 H A 0009 LYS CB
H A 0009 LYS C 2.417 C A 0010 ILE CA
H A 0009 LYS C 3.059 C A 0010 ILE C
H A 0009 LYS C 3.722 C A 0010 ILE CB
H A 0009 LYS CE 3.760 E A 0046 VAL CG1
C A 0010 ILE C 2.474 C A 0011 GLN CA
C A 0010 ILE C 3.627 C A 0011 GLN C
C A 0010 ILE C 3.285 C A 0011 GLN CB
C A 0010 ILE CG1 3.603 E A 0018 PHE CE2
C A 0010 ILE CG1 3.741 E A 0018 PHE CZ
C A 0010 ILE CG2 3.792 E A 0074 PHE CB
C A 0010 ILE CG2 3.667 E A 0074 PHE CD1
C A 0010 ILE CD1 3.787 E A 0074 PHE CE1
C A 0010 ILE CD1 3.563 E A 0074 PHE CE2
C A 0010 ILE CD1 3.512 E A 0074 PHE CZ
C A 0010 ILE CG2 3.731 C A 0077 LYS CA
C A 0011 GLN CA 3.027 C A 0012 PRO CD
C A 0011 GLN C 2.432 C A 0012 PRO CA
C A 0011 GLN C 2.999 C A 0012 PRO C
C A 0011 GLN C 3.651 C A 0012 PRO CB
C A 0011 GLN C 3.688 C A 0012 PRO CG
C A 0011 GLN C 2.517 C A 0012 PRO CD
C A 0011 GLN CB 3.489 C A 0012 PRO CD
C A 0011 GLN CG 3.685 C A 0014 LYS CB
C A 0011 GLN CD 3.753 C A 0014 LYS CE
C A 0011 GLN C 3.710 C A 0077 LYS CG
C A 0012 PRO C 2.452 C A 0013 GLY CA
C A 0012 PRO C 3.104 C A 0013 GLY C
C A 0013 GLY C 2.511 C A 0014 LYS CA
C A 0013 GLY C 3.663 C A 0014 LYS C
C A 0013 GLY C 3.350 C A 0014 LYS CB
C A 0013 GLY CA 3.776 C A 0102 ILE CD1
C A 0013 GLY C 3.695 C A 0102 ILE CD1
C A 0014 LYS C 2.470 E A 0015 VAL CA
C A 0014 LYS C 3.353 E A 0015 VAL C
C A 0014 LYS C 3.597 E A 0015 VAL CB
C A 0014 LYS C 3.729 E A 0015 VAL CG2
C A 0014 LYS CD 3.768 E A 0016 VAL CG2
C A 0014 LYS C 3.594 C A 0102 ILE CD1
E A 0015 VAL C 2.442 E A 0016 VAL CA
E A 0015 VAL C 3.179 E A 0016 VAL C
E A 0015 VAL C 3.617 E A 0016 VAL CB
E A 0015 VAL CG1 3.438 E A 0043 LEU CD2
E A 0015 VAL CG1 3.356 E A 0075 ILE CD1
E A 0015 VAL CG2 3.773 H A 0099 LEU CD2
E A 0015 VAL CG2 3.717 C A 0102 ILE CD1
E A 0016 VAL C 2.461 E A 0017 VAL CA
E A 0016 VAL C 3.560 E A 0017 VAL C
E A 0016 VAL C 3.371 E A 0017 VAL CB
E A 0016 VAL C 3.267 E A 0017 VAL CG2
E A 0016 VAL CG1 3.793 E A 0018 PHE CZ
E A 0016 VAL CG1 3.756 E A 0046 VAL CG2
E A 0017 VAL C 2.417 E A 0018 PHE CA
E A 0017 VAL C 3.111 E A 0018 PHE C
E A 0017 VAL C 3.663 E A 0018 PHE CB
E A 0017 VAL CG2 3.541 H A 0033 LEU CD1
E A 0017 VAL CG2 3.674 E A 0043 LEU CD1
E A 0017 VAL CB 3.692 E A 0045 PHE CD1
E A 0017 VAL CG1 3.586 E A 0073 VAL CG2
E A 0018 PHE C 2.491 E A 0019 ILE CA
E A 0018 PHE C 3.659 E A 0019 ILE C
E A 0018 PHE C 3.409 E A 0019 ILE CB
E A 0018 PHE C 3.413 E A 0019 ILE CG2
E A 0018 PHE CD1 3.785 E A 0046 VAL CB
E A 0018 PHE CD1 3.736 E A 0046 VAL CG1
E A 0018 PHE CE1 3.664 E A 0046 VAL CG1
E A 0018 PHE CB 3.800 C A 0048 ILE CG2
E A 0018 PHE CE2 3.745 E A 0074 PHE CD2
E A 0019 ILE C 2.482 C A 0020 LYS CA
E A 0019 ILE C 3.572 C A 0020 LYS C
E A 0019 ILE C 3.392 C A 0020 LYS CB
E A 0019 ILE C 3.731 C A 0020 LYS CG
C A 0020 LYS CA 3.019 C A 0021 PRO CD
C A 0020 LYS C 2.444 C A 0021 PRO CA
C A 0020 LYS C 3.124 C A 0021 PRO C
C A 0020 LYS C 3.651 C A 0021 PRO CB
C A 0020 LYS C 3.694 C A 0021 PRO CG
C A 0020 LYS C 2.515 C A 0021 PRO CD
C A 0020 LYS CB 3.716 C A 0021 PRO CD
C A 0020 LYS CB 3.765 C A 0048 ILE CG1
C A 0020 LYS CD 3.723 C A 0048 ILE CD1
C A 0021 PRO C 2.475 C A 0022 THR CA
C A 0021 PRO C 3.318 C A 0022 THR C
C A 0021 PRO C 3.631 C A 0022 THR CB
C A 0021 PRO CD 3.737 C A 0049 THR CG2
C A 0022 THR C 2.461 C A 0023 CYS CA
C A 0022 THR C 3.160 C A 0023 CYS C
C A 0022 THR C 3.704 C A 0023 CYS CB
C A 0023 CYS CA 2.991 H A 0024 PRO CD
C A 0023 CYS C 2.451 H A 0024 PRO CA
C A 0023 CYS C 3.061 H A 0024 PRO C
C A 0023 CYS C 3.662 H A 0024 PRO CB
C A 0023 CYS C 3.687 H A 0024 PRO CG
C A 0023 CYS C 2.504 H A 0024 PRO CD
H A 0024 PRO C 2.452 H A 0025 TYR CA
H A 0024 PRO C 3.122 H A 0025 TYR C
H A 0024 PRO C 3.683 H A 0025 TYR CB
H A 0025 TYR C 2.425 H A 0026 CYS CA
H A 0025 TYR C 3.025 H A 0026 CYS C
H A 0025 TYR C 3.699 H A 0026 CYS CB
H A 0025 TYR C 3.630 C A 0071 PRO CD
H A 0025 TYR CB 3.432 C A 0071 PRO CD
H A 0026 CYS C 2.452 H A 0027 ARG CA
H A 0026 CYS C 3.083 H A 0027 ARG C
H A 0026 CYS C 3.721 H A 0027 ARG CB
H A 0027 ARG C 2.462 H A 0028 ARG CA
H A 0027 ARG C 2.955 H A 0028 ARG C
H A 0027 ARG C 3.760 H A 0028 ARG CB
H A 0028 ARG CA 3.788 H A 0029 ALA CA
H A 0028 ARG C 2.435 H A 0029 ALA CA
H A 0028 ARG C 2.953 H A 0029 ALA C
H A 0028 ARG C 3.722 H A 0029 ALA CB
H A 0028 ARG CG 3.348 H A 0032 ILE CD1
H A 0029 ALA C 2.447 H A 0030 GLN CA
H A 0029 ALA C 3.063 H A 0030 GLN C
H A 0029 ALA C 3.727 H A 0030 GLN CB
H A 0029 ALA CB 3.499 C A 0071 PRO CG
H A 0029 ALA CB 3.645 H A 0086 LEU CD2
H A 0030 GLN C 2.416 H A 0031 GLU CA
H A 0030 GLN C 3.024 H A 0031 GLU C
H A 0030 GLN C 3.728 H A 0031 GLU CB
H A 0030 GLN CA 3.756 E A 0045 PHE CZ
H A 0030 GLN CG 3.669 E A 0045 PHE CE2
H A 0030 GLN CG 3.679 E A 0045 PHE CZ
H A 0031 GLU C 2.470 H A 0032 ILE CA
H A 0031 GLU C 2.937 H A 0032 ILE C
H A 0031 GLU C 3.719 H A 0032 ILE CB
H A 0032 ILE CA 3.789 H A 0033 LEU CA
H A 0032 ILE C 2.415 H A 0033 LEU CA
H A 0032 ILE C 3.110 H A 0033 LEU C
H A 0032 ILE C 3.720 H A 0033 LEU CB
H A 0032 ILE CG2 3.660 H A 0086 LEU CG
H A 0032 ILE CG2 3.513 H A 0086 LEU CD2
H A 0032 ILE CD1 3.687 H A 0087 VAL CG2
H A 0033 LEU C 2.449 H A 0034 SER CA
H A 0033 LEU C 3.160 H A 0034 SER C
H A 0033 LEU C 3.718 H A 0034 SER CB
H A 0033 LEU CD1 3.627 E A 0073 VAL CG2
H A 0034 SER C 2.462 C A 0035 GLN CA
H A 0034 SER C 3.152 C A 0035 GLN C
H A 0034 SER C 3.716 C A 0035 GLN CB
C A 0035 GLN C 2.464 C A 0036 LEU CA
C A 0035 GLN C 3.311 C A 0036 LEU C
C A 0035 GLN C 3.638 C A 0036 LEU CB
C A 0036 LEU CA 2.964 C A 0037 PRO CD
C A 0036 LEU C 2.475 C A 0037 PRO CA
C A 0036 LEU C 3.130 C A 0037 PRO C
C A 0036 LEU C 3.673 C A 0037 PRO CB
C A 0036 LEU C 3.698 C A 0037 PRO CG
C A 0036 LEU C 2.498 C A 0037 PRO CD
C A 0036 LEU CB 3.739 C A 0037 PRO CD
C A 0037 PRO C 2.468 C A 0038 ILE CA
C A 0037 PRO C 3.546 C A 0038 ILE C
C A 0037 PRO C 3.370 C A 0038 ILE CB
C A 0037 PRO C 3.449 C A 0038 ILE CG1
C A 0038 ILE C 2.445 C A 0039 LYS CA
C A 0038 ILE C 2.956 C A 0039 LYS C
C A 0038 ILE C 3.735 C A 0039 LYS CB
C A 0038 ILE CD1 3.580 E A 0043 LEU CD2
C A 0038 ILE CG1 3.371 H A 0099 LEU CD2
C A 0038 ILE CD1 3.245 H A 0099 LEU CD2
C A 0039 LYS CA 3.795 C A 0040 GLN CA
C A 0039 LYS C 2.437 C A 0040 GLN CA
C A 0039 LYS C 2.983 C A 0040 GLN C
C A 0039 LYS C 3.694 C A 0040 GLN CB
C A 0039 LYS CB 3.564 C A 0042 LEU CG
C A 0039 LYS CB 3.690 C A 0042 LEU CD1
C A 0039 LYS CD 3.539 C A 0106 GLN CD
C A 0040 GLN C 2.470 C A 0041 GLY CA
C A 0040 GLN C 3.359 C A 0041 GLY C
C A 0041 GLY C 2.422 C A 0042 LEU CA
C A 0041 GLY C 3.086 C A 0042 LEU C
C A 0041 GLY C 3.726 C A 0042 LEU CB
C A 0042 LEU C 2.416 E A 0043 LEU CA
C A 0042 LEU C 3.069 E A 0043 LEU C
C A 0042 LEU C 3.706 E A 0043 LEU CB
C A 0042 LEU CD1 3.758 C A 0102 ILE CD1
C A 0042 LEU CD1 3.662 C A 0104 ALA CA
E A 0043 LEU C 2.438 E A 0044 GLU CA
E A 0043 LEU C 3.522 E A 0044 GLU C
E A 0043 LEU C 3.368 E A 0044 GLU CB
E A 0043 LEU CD1 3.572 E A 0045 PHE CE1
E A 0043 LEU CD1 3.685 E A 0045 PHE CE2
E A 0043 LEU CD1 3.319 E A 0045 PHE CZ
E A 0044 GLU CA 3.798 E A 0045 PHE CA
E A 0044 GLU C 2.442 E A 0045 PHE CA
E A 0044 GLU C 3.133 E A 0045 PHE C
E A 0044 GLU C 3.663 E A 0045 PHE CB
E A 0045 PHE C 2.485 E A 0046 VAL CA
E A 0045 PHE C 3.227 E A 0046 VAL C
E A 0045 PHE C 3.684 E A 0046 VAL CB
E A 0046 VAL C 2.431 E A 0047 ASP CA
E A 0046 VAL C 3.282 E A 0047 ASP C
E A 0046 VAL C 3.587 E A 0047 ASP CB
E A 0047 ASP C 2.493 C A 0048 ILE CA
E A 0047 ASP C 3.515 C A 0048 ILE C
E A 0047 ASP C 3.582 C A 0048 ILE CB
E A 0047 ASP C 3.632 C A 0048 ILE CG2
E A 0047 ASP CB 3.719 C A 0050 ALA CB
E A 0047 ASP CG 3.688 C A 0050 ALA CB
C A 0048 ILE C 2.455 C A 0049 THR CA
C A 0048 ILE C 3.622 C A 0049 THR C
C A 0048 ILE C 3.312 C A 0049 THR CB
C A 0048 ILE C 3.479 C A 0052 ASN CG
C A 0048 ILE CD1 3.381 H A 0058 GLN CG
C A 0048 ILE CD1 3.487 H A 0058 GLN CD
C A 0049 THR C 2.462 C A 0050 ALA CA
C A 0049 THR C 3.089 C A 0050 ALA C
C A 0049 THR C 3.735 C A 0050 ALA CB
C A 0050 ALA C 2.466 C A 0051 THR CA
C A 0050 ALA C 3.726 C A 0051 THR C
C A 0050 ALA C 3.223 C A 0051 THR CB
C A 0050 ALA C 3.601 C A 0051 THR CG2
C A 0051 THR C 2.455 C A 0052 ASN CA
C A 0051 THR C 3.697 C A 0052 ASN C
C A 0051 THR C 3.150 C A 0052 ASN CB
C A 0052 ASN C 2.503 C A 0053 HIS CA
C A 0052 ASN C 3.523 C A 0053 HIS C
C A 0052 ASN C 3.448 C A 0053 HIS CB
C A 0052 ASN C 3.672 C A 0053 HIS CG
C A 0052 ASN C 3.750 C A 0053 HIS CD2
C A 0052 ASN CB 3.568 H A 0057 ILE CD1
C A 0052 ASN CG 3.679 H A 0057 ILE CD1
C A 0053 HIS C 2.475 H A 0054 THR CA
C A 0053 HIS C 2.847 H A 0054 THR C
C A 0053 HIS CB 3.795 H A 0056 GLU CB
H A 0054 THR C 2.505 H A 0055 ASN CA
H A 0054 THR C 3.052 H A 0055 ASN C
H A 0054 THR C 3.705 H A 0055 ASN CB
H A 0055 ASN C 2.457 H A 0056 GLU CA
H A 0055 ASN C 3.197 H A 0056 GLU C
H A 0055 ASN C 3.667 H A 0056 GLU CB
H A 0056 GLU C 2.483 H A 0057 ILE CA
H A 0056 GLU C 3.025 H A 0057 ILE C
H A 0056 GLU C 3.740 H A 0057 ILE CB
H A 0057 ILE C 2.445 H A 0058 GLN CA
H A 0057 ILE C 3.030 H A 0058 GLN C
H A 0057 ILE C 3.692 H A 0058 GLN CB
H A 0058 GLN C 2.486 H A 0059 ASP CA
H A 0058 GLN C 3.100 H A 0059 ASP C
H A 0058 GLN C 3.715 H A 0059 ASP CB
H A 0058 GLN C 3.659 C A 0068 ARG CB
H A 0059 ASP C 2.449 H A 0060 TYR CA
H A 0059 ASP C 2.998 H A 0060 TYR C
H A 0059 ASP C 3.746 H A 0060 TYR CB
H A 0060 TYR C 2.473 H A 0061 LEU CA
H A 0060 TYR C 3.009 H A 0061 LEU C
H A 0060 TYR C 3.765 H A 0061 LEU CB
H A 0060 TYR CE2 3.740 H A 0064 LEU CD2
H A 0061 LEU C 2.462 H A 0062 GLN CA
H A 0061 LEU C 2.979 H A 0062 GLN C
H A 0061 LEU C 3.763 H A 0062 GLN CB
H A 0061 LEU CD2 3.796 E A 0072 ARG CD
H A 0062 GLN C 2.447 H A 0063 GLN CA
H A 0062 GLN C 3.080 H A 0063 GLN C
H A 0062 GLN C 3.715 H A 0063 GLN CB
H A 0062 GLN CA 3.540 C A 0067 ALA C
H A 0063 GLN C 2.454 H A 0064 LEU CA
H A 0063 GLN C 3.133 H A 0064 LEU C
H A 0063 GLN C 3.702 H A 0064 LEU CB
H A 0064 LEU C 2.488 H A 0065 THR CA
H A 0064 LEU C 3.621 H A 0065 THR C
H A 0064 LEU C 3.479 H A 0065 THR CB
H A 0064 LEU C 3.483 H A 0065 THR CG2
H A 0064 LEU CG 3.794 H A 0065 THR CG2
H A 0065 THR C 2.476 C A 0066 GLY CA
H A 0065 THR C 3.400 C A 0066 GLY C
H A 0065 THR CG2 3.617 E A 0074 PHE CE2
H A 0065 THR CG2 3.540 E A 0074 PHE CZ
H A 0065 THR CG2 3.644 E A 0079 CYS CB
C A 0066 GLY C 2.463 C A 0067 ALA CA
C A 0066 GLY C 3.696 C A 0067 ALA C
C A 0066 GLY C 3.152 C A 0067 ALA CB
C A 0067 ALA C 2.472 C A 0068 ARG CA
C A 0067 ALA C 3.415 C A 0068 ARG C
C A 0067 ALA C 3.622 C A 0068 ARG CB
C A 0067 ALA C 3.767 E A 0072 ARG CZ
C A 0067 ALA CB 3.618 E A 0072 ARG CZ
C A 0068 ARG CA 3.782 C A 0069 THR CA
C A 0068 ARG C 2.432 C A 0069 THR CA
C A 0068 ARG C 3.056 C A 0069 THR C
C A 0068 ARG C 3.668 C A 0069 THR CB
C A 0069 THR C 2.477 C A 0070 VAL CA
C A 0069 THR C 3.453 C A 0070 VAL C
C A 0069 THR C 3.532 C A 0070 VAL CB
C A 0069 THR C 3.787 C A 0070 VAL CG2
C A 0070 VAL CA 3.017 C A 0071 PRO CA
C A 0070 VAL CA 3.211 C A 0071 PRO C
C A 0070 VAL C 2.537 C A 0071 PRO CA
C A 0070 VAL C 3.155 C A 0071 PRO C
C A 0070 VAL C 3.719 C A 0071 PRO CB
C A 0070 VAL C 3.639 C A 0071 PRO CG
C A 0070 VAL C 2.440 C A 0071 PRO CD
C A 0070 VAL CB 3.395 C A 0071 PRO CA
C A 0071 PRO C 2.459 E A 0072 ARG CA
C A 0071 PRO C 3.576 E A 0072 ARG C
C A 0071 PRO C 3.308 E A 0072 ARG CB
C A 0071 PRO CG 3.790 C A 0083 CYS CB
E A 0072 ARG C 2.456 E A 0073 VAL CA
E A 0072 ARG C 3.204 E A 0073 VAL C
E A 0072 ARG C 3.673 E A 0073 VAL CB
E A 0073 VAL C 2.503 E A 0074 PHE CA
E A 0073 VAL C 3.468 E A 0074 PHE C
E A 0073 VAL C 3.575 E A 0074 PHE CB
E A 0073 VAL CG1 3.112 E A 0075 ILE CD1
E A 0073 VAL CB 3.693 E A 0080 ILE CG1
E A 0073 VAL CG1 3.629 E A 0080 ILE CG1
E A 0073 VAL CG2 3.785 H A 0086 LEU CD1
E A 0074 PHE C 2.444 E A 0075 ILE CA
E A 0074 PHE C 3.101 E A 0075 ILE C
E A 0074 PHE C 3.684 E A 0075 ILE CB
E A 0074 PHE CD1 3.710 C A 0077 LYS C
E A 0074 PHE CD1 3.535 E A 0078 ASP C
E A 0074 PHE CD1 3.702 E A 0079 CYS CA
E A 0074 PHE CE1 3.676 E A 0079 CYS CB
E A 0074 PHE CZ 3.642 E A 0079 CYS CB
E A 0075 ILE C 2.511 C A 0076 GLY CA
E A 0075 ILE C 3.002 C A 0076 GLY C
E A 0075 ILE CG2 3.714 H A 0098 ARG C
E A 0075 ILE CG2 3.760 H A 0098 ARG CD
E A 0075 ILE CG1 3.523 H A 0099 LEU CG
E A 0075 ILE CG1 3.473 H A 0099 LEU CD1
E A 0075 ILE CD1 3.721 H A 0099 LEU CD1
C A 0076 GLY C 2.506 C A 0077 LYS CA
C A 0076 GLY C 3.129 C A 0077 LYS C
C A 0076 GLY C 3.238 C A 0077 LYS CB
C A 0077 LYS C 2.460 E A 0078 ASP CA
C A 0077 LYS C 3.462 E A 0078 ASP C
C A 0077 LYS C 3.522 E A 0078 ASP CB
E A 0078 ASP C 2.445 E A 0079 CYS CA
E A 0078 ASP C 3.025 E A 0079 CYS C
E A 0078 ASP C 3.722 E A 0079 CYS CB
E A 0078 ASP CG 3.751 H A 0098 ARG CZ
E A 0079 CYS C 2.432 E A 0080 ILE CA
E A 0079 CYS C 3.176 E A 0080 ILE C
E A 0079 CYS C 3.665 E A 0080 ILE CB
E A 0080 ILE C 2.461 E A 0081 GLY CA
E A 0080 ILE C 3.560 E A 0081 GLY C
E A 0081 GLY C 2.474 C A 0082 GLY CA
E A 0081 GLY C 3.354 C A 0082 GLY C
C A 0082 GLY C 2.428 C A 0083 CYS CA
C A 0082 GLY C 3.085 C A 0083 CYS C
C A 0082 GLY C 3.730 C A 0083 CYS CB
C A 0083 CYS C 2.430 H A 0084 SER CA
C A 0083 CYS C 2.969 H A 0084 SER C
C A 0083 CYS C 3.721 H A 0084 SER CB
C A 0083 CYS CA 3.662 H A 0086 LEU CB
H A 0084 SER C 2.460 H A 0085 ASP CA
H A 0084 SER C 3.065 H A 0085 ASP C
H A 0084 SER C 3.718 H A 0085 ASP CB
H A 0085 ASP C 2.458 H A 0086 LEU CA
H A 0085 ASP C 3.025 H A 0086 LEU C
H A 0085 ASP C 3.717 H A 0086 LEU CB
H A 0086 LEU C 2.449 H A 0087 VAL CA
H A 0086 LEU C 3.001 H A 0087 VAL C
H A 0086 LEU C 3.710 H A 0087 VAL CB
H A 0086 LEU CD1 3.732 H A 0095 LEU CD1
H A 0086 LEU CD1 3.598 H A 0095 LEU CD2
H A 0087 VAL C 2.461 H A 0088 SER CA
H A 0087 VAL C 2.891 H A 0088 SER C
H A 0087 VAL C 3.796 H A 0088 SER CB
H A 0088 SER CA 3.767 H A 0089 LEU CA
H A 0088 SER C 2.416 H A 0089 LEU CA
H A 0088 SER C 2.999 H A 0089 LEU C
H A 0088 SER C 3.706 H A 0089 LEU CB
H A 0089 LEU C 2.441 H A 0090 GLN CA
H A 0089 LEU C 3.051 H A 0090 GLN C
H A 0089 LEU C 3.727 H A 0090 GLN CB
H A 0089 LEU CG 3.650 H A 0094 GLU CB
H A 0089 LEU C 3.555 H A 0095 LEU CB
H A 0089 LEU CB 3.763 H A 0095 LEU CB
H A 0090 GLN C 2.479 H A 0091 GLN CA
H A 0090 GLN C 3.151 H A 0091 GLN C
H A 0090 GLN C 3.706 H A 0091 GLN CB
H A 0091 GLN C 2.518 C A 0092 SER CA
H A 0091 GLN C 3.184 C A 0092 SER C
H A 0091 GLN C 3.710 C A 0092 SER CB
C A 0092 SER C 2.456 C A 0093 GLY CA
C A 0092 SER C 3.192 C A 0093 GLY C
C A 0093 GLY C 2.448 H A 0094 GLU CA
C A 0093 GLY C 3.006 H A 0094 GLU C
C A 0093 GLY C 3.691 H A 0094 GLU CB
H A 0094 GLU C 2.490 H A 0095 LEU CA
H A 0094 GLU C 3.033 H A 0095 LEU C
H A 0094 GLU C 3.745 H A 0095 LEU CB
H A 0095 LEU C 2.452 H A 0096 LEU CA
H A 0095 LEU C 3.012 H A 0096 LEU C
H A 0095 LEU C 3.755 H A 0096 LEU CB
H A 0095 LEU CG 3.574 H A 0099 LEU CD1
H A 0096 LEU C 2.454 H A 0097 THR CA
H A 0096 LEU C 3.004 H A 0097 THR C
H A 0096 LEU C 3.703 H A 0097 THR CB
H A 0097 THR C 2.483 H A 0098 ARG CA
H A 0097 THR C 2.989 H A 0098 ARG C
H A 0097 THR C 3.750 H A 0098 ARG CB
H A 0098 ARG C 2.460 H A 0099 LEU CA
H A 0098 ARG C 3.099 H A 0099 LEU C
H A 0098 ARG C 3.732 H A 0099 LEU CB
H A 0099 LEU CA 3.792 H A 0100 LYS CA
H A 0099 LEU C 2.391 H A 0100 LYS CA
H A 0099 LEU C 3.028 H A 0100 LYS C
H A 0099 LEU C 3.723 H A 0100 LYS CB
H A 0099 LEU CD2 3.792 C A 0104 ALA CB
H A 0100 LYS C 2.449 C A 0101 GLN CA
H A 0100 LYS C 2.923 C A 0101 GLN C
H A 0100 LYS C 3.736 C A 0101 GLN CB
H A 0100 LYS CG 3.750 C A 0105 LEU CG
C A 0101 GLN C 2.462 C A 0102 ILE CA
C A 0101 GLN C 3.227 C A 0102 ILE C
C A 0101 GLN C 3.709 C A 0102 ILE CB
C A 0102 ILE C 2.474 C A 0103 GLY CA
C A 0102 ILE C 3.196 C A 0103 GLY C
C A 0103 GLY C 2.451 C A 0104 ALA CA
C A 0103 GLY C 3.205 C A 0104 ALA C
C A 0103 GLY C 3.651 C A 0104 ALA CB
C A 0104 ALA CA 3.769 C A 0105 LEU CA
C A 0104 ALA C 2.401 C A 0105 LEU CA
C A 0104 ALA C 2.968 C A 0105 LEU C
C A 0104 ALA C 3.718 C A 0105 LEU CB
C A 0105 LEU C 2.518 C A 0106 GLN CA
C A 0105 LEU C 3.641 C A 0106 GLN C
C A 0105 LEU C 3.262 C A 0106 GLN CB
CHARGE_ATTR 2.00 12.00 50
H A 0004 GLU OE1 10.62 H A 0009 LYS NZ
H A 0004 GLU OE2 11.53 H A 0009 LYS NZ
H A 0004 GLU OE1 9.931 C A 0077 LYS NZ
H A 0004 GLU OE2 11.93 C A 0077 LYS NZ
H A 0031 GLU OE1 5.205 H A 0027 ARG NH1
H A 0031 GLU OE1 7.479 H A 0027 ARG NH2
H A 0031 GLU OE2 7.390 H A 0027 ARG NH1
H A 0031 GLU OE2 9.652 H A 0027 ARG NH2
H A 0031 GLU OE1 6.714 H A 0028 ARG NH1
H A 0031 GLU OE1 8.558 H A 0028 ARG NH2
H A 0031 GLU OE2 5.970 H A 0028 ARG NH1
H A 0031 GLU OE2 8.013 H A 0028 ARG NH2
E A 0044 GLU OE1 7.938 H A 0009 LYS NZ
E A 0044 GLU OE2 6.387 H A 0009 LYS NZ
E A 0044 GLU OE1 4.754 C A 0014 LYS NZ
E A 0044 GLU OE2 5.607 C A 0014 LYS NZ
E A 0047 ASP OD1 10.18 H A 0009 LYS NZ
E A 0047 ASP OD2 10.74 H A 0009 LYS NZ
E A 0047 ASP OD1 8.894 C A 0020 LYS NZ
E A 0047 ASP OD2 9.510 C A 0020 LYS NZ
H A 0056 GLU OE1 2.808 C A 0053 HIS ND1
H A 0056 GLU OE1 4.975 C A 0053 HIS NE2
H A 0056 GLU OE2 4.835 C A 0053 HIS ND1
H A 0056 GLU OE2 6.875 C A 0053 HIS NE2
H A 0059 ASP OD2 11.32 C A 0053 HIS ND1
H A 0059 ASP OD1 4.543 C A 0068 ARG NH1
H A 0059 ASP OD1 6.756 C A 0068 ARG NH2
H A 0059 ASP OD2 6.612 C A 0068 ARG NH1
H A 0059 ASP OD2 8.775 C A 0068 ARG NH2
H A 0059 ASP OD1 11.96 E A 0072 ARG NH1
E A 0078 ASP OD1 10.05 E A 0072 ARG NH1
E A 0078 ASP OD1 11.75 E A 0072 ARG NH2
E A 0078 ASP OD2 11.57 E A 0072 ARG NH1
E A 0078 ASP OD1 10.41 C A 0077 LYS NZ
E A 0078 ASP OD2 9.026 C A 0077 LYS NZ
E A 0078 ASP OD1 3.329 H A 0098 ARG NH1
E A 0078 ASP OD1 3.659 H A 0098 ARG NH2
E A 0078 ASP OD2 4.622 H A 0098 ARG NH1
E A 0078 ASP OD2 3.729 H A 0098 ARG NH2
H A 0085 ASP OD1 9.367 E A 0072 ARG NH1
H A 0085 ASP OD1 9.137 E A 0072 ARG NH2
H A 0085 ASP OD2 8.015 E A 0072 ARG NH1
H A 0085 ASP OD2 7.433 E A 0072 ARG NH2
H A 0085 ASP OD1 8.952 H A 0098 ARG NH1
H A 0085 ASP OD1 11.11 H A 0098 ARG NH2
H A 0085 ASP OD2 10.45 H A 0098 ARG NH1
H A 0094 GLU OE1 9.473 H A 0098 ARG NH1
H A 0094 GLU OE1 11.09 H A 0098 ARG NH2
H A 0094 GLU OE2 7.500 H A 0098 ARG NH1
H A 0094 GLU OE2 9.057 H A 0098 ARG NH2
CHARGE_REPU 2.00 12.00 25
H A 0009 LYS NZ 10.96 C A 0014 LYS NZ
C A 0014 LYS NZ 9.355 C A 0039 LYS NZ
C A 0020 LYS NZ 11.91 E A 0072 ARG NH2
H A 0027 ARG NH1 9.868 H A 0028 ARG NH1
H A 0027 ARG NH1 11.06 H A 0028 ARG NH2
H A 0027 ARG NH2 11.57 H A 0028 ARG NH1
C A 0039 LYS NZ 10.23 H A 0100 LYS NZ
E A 0044 GLU OE2 11.86 E A 0047 ASP OD1
E A 0044 GLU OE2 11.28 E A 0047 ASP OD2
H A 0056 GLU OE1 10.79 H A 0059 ASP OD1
H A 0056 GLU OE1 9.319 H A 0059 ASP OD2
H A 0056 GLU OE2 9.808 H A 0059 ASP OD1
H A 0056 GLU OE2 8.049 H A 0059 ASP OD2
C A 0068 ARG NH1 11.56 E A 0072 ARG NH1
C A 0068 ARG NH1 11.08 E A 0072 ARG NH2
C A 0068 ARG NH2 11.26 E A 0072 ARG NH2
E A 0072 ARG NH1 11.99 H A 0098 ARG NH1
E A 0078 ASP OD1 9.901 H A 0085 ASP OD1
E A 0078 ASP OD1 10.82 H A 0085 ASP OD2
E A 0078 ASP OD2 11.98 H A 0085 ASP OD1
E A 0078 ASP OD1 10.48 H A 0094 GLU OE2
H A 0085 ASP OD1 8.055 H A 0094 GLU OE1
H A 0085 ASP OD1 7.364 H A 0094 GLU OE2
H A 0085 ASP OD2 10.14 H A 0094 GLU OE1
H A 0085 ASP OD2 9.550 H A 0094 GLU OE2
HB_MM 2.00 3.20 180
C A 0003 GLN N 2.251 C A 0002 ALA O
H A 0004 GLU N 2.250 C A 0003 GLN O
H A 0005 PHE N 3.134 C A 0003 GLN O
H A 0005 PHE N 2.254 H A 0004 GLU O
H A 0006 VAL N 2.239 H A 0005 PHE O
H A 0007 ASN N 3.104 C A 0003 GLN O
H A 0007 ASN N 2.261 H A 0006 VAL O
H A 0008 CYS N 2.853 H A 0004 GLU O
H A 0008 CYS N 2.256 H A 0007 ASN O
H A 0009 LYS N 2.987 H A 0005 PHE O
H A 0009 LYS N 3.120 H A 0006 VAL O
H A 0009 LYS N 2.243 H A 0008 CYS O
C A 0010 ILE N 3.085 H A 0006 VAL O
C A 0010 ILE N 2.241 H A 0009 LYS O
C A 0011 GLN N 2.239 C A 0010 ILE O
C A 0012 PRO N 2.248 C A 0011 GLN O
C A 0013 GLY N 2.237 C A 0012 PRO O
C A 0014 LYS N 2.247 C A 0013 GLY O
E A 0015 VAL N 2.242 C A 0014 LYS O
E A 0015 VAL N 2.729 C A 0042 LEU O
E A 0016 VAL N 2.226 E A 0015 VAL O
E A 0016 VAL N 2.990 E A 0074 PHE O
E A 0017 VAL N 2.227 E A 0016 VAL O
E A 0017 VAL N 2.844 E A 0044 GLU O
E A 0018 PHE N 2.237 E A 0017 VAL O
E A 0018 PHE N 2.945 E A 0072 ARG O
E A 0019 ILE N 2.260 E A 0018 PHE O
E A 0019 ILE N 2.784 E A 0046 VAL O
C A 0020 LYS N 2.235 E A 0019 ILE O
C A 0021 PRO N 2.246 C A 0020 LYS O
C A 0022 THR N 2.232 C A 0021 PRO O
C A 0023 CYS N 2.245 C A 0022 THR O
H A 0024 PRO N 2.253 C A 0023 CYS O
H A 0025 TYR N 2.239 H A 0024 PRO O
H A 0026 CYS N 2.248 H A 0025 TYR O
H A 0027 ARG N 2.241 H A 0026 CYS O
H A 0028 ARG N 2.259 H A 0027 ARG O
H A 0029 ALA N 3.097 H A 0025 TYR O
H A 0029 ALA N 2.259 H A 0028 ARG O
H A 0030 GLN N 2.977 H A 0026 CYS O
H A 0030 GLN N 3.095 H A 0028 ARG O
H A 0030 GLN N 2.246 H A 0029 ALA O
H A 0031 GLU N 3.051 H A 0028 ARG O
H A 0031 GLU N 2.248 H A 0030 GLN O
H A 0032 ILE N 2.893 H A 0028 ARG O
H A 0032 ILE N 2.247 H A 0031 GLU O
H A 0033 LEU N 2.815 H A 0029 ALA O
H A 0033 LEU N 3.082 H A 0031 GLU O
H A 0033 LEU N 2.265 H A 0032 ILE O
H A 0034 SER N 2.935 H A 0030 GLN O
H A 0034 SER N 3.074 H A 0031 GLU O
H A 0034 SER N 2.254 H A 0033 LEU O
C A 0035 GLN N 2.750 H A 0031 GLU O
C A 0035 GLN N 3.134 H A 0033 LEU O
C A 0035 GLN N 2.237 H A 0034 SER O
C A 0036 LEU N 3.113 H A 0033 LEU O
C A 0036 LEU N 2.249 C A 0035 GLN O
C A 0037 PRO N 2.251 C A 0036 LEU O
C A 0038 ILE N 2.241 C A 0037 PRO O
C A 0039 LYS N 2.256 C A 0038 ILE O
C A 0039 LYS N 2.820 C A 0104 ALA O
C A 0040 GLN N 2.257 C A 0039 LYS O
C A 0041 GLY N 2.266 C A 0040 GLN O
C A 0042 LEU N 3.023 C A 0039 LYS O
C A 0042 LEU N 2.254 C A 0041 GLY O
E A 0043 LEU N 2.241 C A 0042 LEU O
E A 0044 GLU N 2.917 E A 0015 VAL O
E A 0044 GLU N 2.259 E A 0043 LEU O
E A 0045 PHE N 2.252 E A 0044 GLU O
E A 0046 VAL N 2.756 E A 0017 VAL O
E A 0046 VAL N 2.241 E A 0045 PHE O
E A 0047 ASP N 2.230 E A 0046 VAL O
C A 0048 ILE N 2.763 E A 0019 ILE O
C A 0048 ILE N 2.253 E A 0047 ASP O
C A 0049 THR N 2.234 C A 0048 ILE O
C A 0050 ALA N 2.233 C A 0049 THR O
C A 0051 THR N 2.245 C A 0050 ALA O
C A 0052 ASN N 2.239 C A 0051 THR O
C A 0053 HIS N 2.243 C A 0052 ASN O
H A 0054 THR N 3.035 C A 0048 ILE O
H A 0054 THR N 2.250 C A 0053 HIS O
H A 0055 ASN N 2.255 H A 0054 THR O
H A 0056 GLU N 2.887 H A 0054 THR O
H A 0056 GLU N 2.242 H A 0055 ASN O
H A 0057 ILE N 3.110 C A 0053 HIS O
H A 0057 ILE N 2.996 H A 0054 THR O
H A 0057 ILE N 2.253 H A 0056 GLU O
H A 0058 GLN N 2.732 H A 0054 THR O
H A 0058 GLN N 3.083 H A 0056 GLU O
H A 0058 GLN N 2.236 H A 0057 ILE O
H A 0059 ASP N 2.990 H A 0056 GLU O
H A 0059 ASP N 2.237 H A 0058 GLN O
H A 0060 TYR N 2.899 H A 0056 GLU O
H A 0060 TYR N 2.242 H A 0059 ASP O
H A 0061 LEU N 2.782 H A 0057 ILE O
H A 0061 LEU N 2.244 H A 0060 TYR O
H A 0062 GLN N 2.856 H A 0058 GLN O
H A 0062 GLN N 3.134 H A 0059 ASP O
H A 0062 GLN N 2.258 H A 0061 LEU O
H A 0063 GLN N 3.185 H A 0059 ASP O
H A 0063 GLN N 3.003 H A 0060 TYR O
H A 0063 GLN N 2.256 H A 0062 GLN O
H A 0064 LEU N 2.833 H A 0060 TYR O
H A 0064 LEU N 2.243 H A 0063 GLN O
H A 0065 THR N 2.841 H A 0061 LEU O
H A 0065 THR N 2.261 H A 0064 LEU O
C A 0066 GLY N 2.853 H A 0062 GLN O
C A 0066 GLY N 2.237 H A 0065 THR O
C A 0067 ALA N 2.249 C A 0066 GLY O
C A 0068 ARG N 2.253 C A 0067 ALA O
C A 0069 THR N 2.246 C A 0068 ARG O
C A 0070 VAL N 2.254 C A 0069 THR O
C A 0071 PRO N 2.264 C A 0070 VAL O
E A 0072 ARG N 2.960 E A 0018 PHE O
E A 0072 ARG N 2.245 C A 0071 PRO O
E A 0073 VAL N 2.255 E A 0072 ARG O
E A 0073 VAL N 3.173 E A 0081 GLY O
E A 0074 PHE N 2.759 E A 0016 VAL O
E A 0074 PHE N 2.257 E A 0073 VAL O
E A 0075 ILE N 2.235 E A 0074 PHE O
E A 0075 ILE N 2.853 E A 0078 ASP O
C A 0076 GLY N 2.829 C A 0014 LYS O
C A 0076 GLY N 2.248 E A 0075 ILE O
C A 0077 LYS N 3.134 C A 0011 GLN O
C A 0077 LYS N 2.257 C A 0076 GLY O
E A 0078 ASP N 2.944 E A 0075 ILE O
E A 0078 ASP N 2.938 C A 0076 GLY O
E A 0078 ASP N 2.244 C A 0077 LYS O
E A 0079 CYS N 2.247 E A 0078 ASP O
E A 0080 ILE N 2.876 E A 0073 VAL O
E A 0080 ILE N 2.254 E A 0079 CYS O
E A 0081 GLY N 2.253 E A 0080 ILE O
C A 0082 GLY N 2.267 E A 0081 GLY O
C A 0083 CYS N 2.242 C A 0082 GLY O
H A 0084 SER N 2.244 C A 0083 CYS O
H A 0085 ASP N 2.255 H A 0084 SER O
H A 0086 LEU N 2.896 C A 0082 GLY O
H A 0086 LEU N 2.241 H A 0085 ASP O
H A 0087 VAL N 2.892 C A 0083 CYS O
H A 0087 VAL N 2.250 H A 0086 LEU O
H A 0088 SER N 2.954 H A 0085 ASP O
H A 0088 SER N 2.260 H A 0087 VAL O
H A 0089 LEU N 2.930 H A 0085 ASP O
H A 0089 LEU N 2.252 H A 0088 SER O
H A 0090 GLN N 2.882 H A 0086 LEU O
H A 0090 GLN N 3.155 H A 0088 SER O
H A 0090 GLN N 2.235 H A 0089 LEU O
H A 0091 GLN N 2.914 H A 0087 VAL O
H A 0091 GLN N 2.949 H A 0088 SER O
H A 0091 GLN N 2.244 H A 0090 GLN O
C A 0092 SER N 2.732 H A 0088 SER O
C A 0092 SER N 2.257 H A 0091 GLN O
C A 0093 GLY N 3.116 H A 0089 LEU O
C A 0093 GLY N 3.015 H A 0090 GLN O
C A 0093 GLY N 2.239 C A 0092 SER O
H A 0094 GLU N 2.809 H A 0089 LEU O
H A 0094 GLU N 2.255 C A 0093 GLY O
H A 0095 LEU N 2.886 H A 0089 LEU O
H A 0095 LEU N 3.149 C A 0093 GLY O
H A 0095 LEU N 2.257 H A 0094 GLU O
H A 0096 LEU N 3.115 C A 0093 GLY O
H A 0096 LEU N 2.245 H A 0095 LEU O
H A 0097 THR N 2.253 H A 0096 LEU O
H A 0098 ARG N 2.964 H A 0094 GLU O
H A 0098 ARG N 2.261 H A 0097 THR O
H A 0099 LEU N 2.823 H A 0095 LEU O
H A 0099 LEU N 2.250 H A 0098 ARG O
H A 0100 LYS N 2.904 H A 0096 LEU O
H A 0100 LYS N 3.131 H A 0097 THR O
H A 0100 LYS N 2.234 H A 0099 LEU O
C A 0101 GLN N 3.133 H A 0099 LEU O
C A 0101 GLN N 2.257 H A 0100 LYS O
C A 0102 ILE N 2.867 H A 0099 LEU O
C A 0102 ILE N 2.246 C A 0101 GLN O
C A 0103 GLY N 2.872 H A 0100 LYS O
C A 0103 GLY N 3.138 C A 0101 GLN O
C A 0103 GLY N 2.239 C A 0102 ILE O
C A 0104 ALA N 2.245 C A 0103 GLY O
C A 0105 LEU N 2.239 C A 0104 ALA O
C A 0106 GLN N 2.269 C A 0105 LEU O
HB_MS 2.00 3.20 14
C A 0002 ALA N 2.816 C A 0003 GLN OE1
C A 0002 ALA N 2.870 H A 0056 GLU OE2
H A 0032 ILE O 3.056 H A 0090 GLN NE2
C A 0048 ILE N 2.983 E A 0047 ASP OD1
C A 0048 ILE O 2.775 C A 0052 ASN ND2
C A 0049 THR N 2.765 E A 0047 ASP OD1
C A 0049 THR N 3.121 C A 0052 ASN OD1
C A 0050 ALA N 2.860 E A 0047 ASP OD1
H A 0055 ASN N 2.951 H A 0054 THR OG1
H A 0061 LEU O 2.658 H A 0065 THR OG1
C A 0067 ALA O 3.116 H A 0065 THR OG1
C A 0068 ARG O 2.853 H A 0058 GLN NE2
C A 0069 THR O 2.836 E A 0072 ARG NH2
C A 0105 LEU O 2.889 H A 0100 LYS NZ
HB_SS 2.00 3.20 5
H A 0007 ASN ND2 2.981 H A 0060 TYR OH
H A 0054 THR OG1 2.731 H A 0058 GLN OE1
C A 0068 ARG NH1 2.890 H A 0062 GLN OE1
E A 0072 ARG NH1 2.910 H A 0065 THR OG1
H A 0094 GLU OE1 2.645 C A 0092 SER OG
AROMATIC 0.00 8.00 1
H A 0009 LYS 3.800 H A 0005 PHE