Complet list of 1xjh con file
Complete list of 1xjh.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 216
C A 0001 MET C 2.491 C A 0002 ASP CA
C A 0001 MET C 3.740 C A 0002 ASP C
C A 0001 MET C 3.232 C A 0002 ASP CB
C A 0002 ASP C 2.504 C A 0003 VAL CA
C A 0002 ASP C 3.676 C A 0003 VAL C
C A 0002 ASP C 3.371 C A 0003 VAL CB
C A 0003 VAL C 2.499 C A 0004 GLU CA
C A 0003 VAL C 3.427 C A 0004 GLU C
C A 0003 VAL C 3.621 C A 0004 GLU CB
C A 0004 GLU C 2.501 C A 0005 PHE CA
C A 0004 GLU C 3.656 C A 0005 PHE C
C A 0004 GLU C 3.349 C A 0005 PHE CB
C A 0005 PHE C 2.504 C A 0006 LYS CA
C A 0005 PHE C 3.709 C A 0006 LYS C
C A 0005 PHE C 3.343 C A 0006 LYS CB
C A 0005 PHE C 3.334 C A 0006 LYS CG
C A 0006 LYS C 2.480 C A 0007 CYS CA
C A 0006 LYS C 3.020 C A 0007 CYS C
C A 0006 LYS C 3.708 C A 0007 CYS CB
C A 0006 LYS C 3.490 C A 0045 ASN CG
C A 0007 CYS C 2.487 C A 0008 THR CA
C A 0007 CYS C 3.219 C A 0008 THR C
C A 0007 CYS C 3.763 C A 0008 THR CB
C A 0007 CYS CA 3.644 C A 0045 ASN CG
C A 0007 CYS CB 3.790 E A 0047 TYR CE2
C A 0008 THR C 2.503 C A 0009 CYS CA
C A 0008 THR C 3.494 C A 0009 CYS C
C A 0008 THR C 3.531 C A 0009 CYS CB
C A 0009 CYS C 2.517 H A 0010 SER CA
C A 0009 CYS C 3.788 H A 0010 SER C
C A 0009 CYS C 3.138 H A 0010 SER CB
H A 0010 SER C 2.504 H A 0011 ARG CA
H A 0010 SER C 3.068 H A 0011 ARG C
H A 0010 SER C 3.766 H A 0011 ARG CB
H A 0011 ARG C 2.486 H A 0012 GLU CA
H A 0011 ARG C 3.076 H A 0012 GLU C
H A 0011 ARG C 3.723 H A 0012 GLU CB
H A 0011 ARG CB 3.771 E A 0047 TYR CZ
H A 0011 ARG CG 3.784 E A 0047 TYR CG
H A 0011 ARG CG 3.606 E A 0047 TYR CD1
H A 0011 ARG CG 3.628 E A 0047 TYR CE1
H A 0011 ARG CD 3.447 E A 0047 TYR CD1
H A 0011 ARG CD 3.551 E A 0047 TYR CE1
H A 0012 GLU C 2.489 H A 0013 ARG CA
H A 0012 GLU C 3.140 H A 0013 ARG C
H A 0012 GLU C 3.755 H A 0013 ARG CB
H A 0013 ARG C 2.473 H A 0014 CYS CA
H A 0013 ARG C 3.071 H A 0014 CYS C
H A 0013 ARG C 3.715 H A 0014 CYS CB
H A 0013 ARG CB 3.586 C A 0042 TYR CD1
H A 0013 ARG CG 3.726 C A 0042 TYR CD1
H A 0013 ARG CG 3.794 C A 0042 TYR CE1
H A 0014 CYS C 2.481 H A 0015 ALA CA
H A 0014 CYS C 3.102 H A 0015 ALA C
H A 0014 CYS C 3.726 H A 0015 ALA CB
H A 0015 ALA C 2.474 H A 0016 ASP CA
H A 0015 ALA C 3.068 H A 0016 ASP C
H A 0015 ALA C 3.736 H A 0016 ASP CB
H A 0016 ASP C 2.479 H A 0017 ALA CA
H A 0016 ASP C 3.102 H A 0017 ALA C
H A 0016 ASP C 3.734 H A 0017 ALA CB
H A 0017 ALA C 2.483 H A 0018 LEU CA
H A 0017 ALA C 3.187 H A 0018 LEU C
H A 0017 ALA C 3.671 H A 0018 LEU CB
H A 0018 LEU C 2.508 H A 0019 LYS CA
H A 0018 LEU C 3.132 H A 0019 LYS C
H A 0018 LEU C 3.730 H A 0019 LYS CB
H A 0018 LEU CD2 3.723 E A 0049 PHE CB
H A 0018 LEU CD2 3.492 E A 0049 PHE CG
H A 0018 LEU CD2 3.620 E A 0049 PHE CD2
H A 0019 LYS C 2.484 H A 0020 THR CA
H A 0019 LYS C 3.303 H A 0020 THR C
H A 0019 LYS C 3.730 H A 0020 THR CB
H A 0019 LYS CG 3.789 H A 0057 ILE CG2
H A 0020 THR C 2.476 C A 0021 LEU CA
H A 0020 THR C 3.151 C A 0021 LEU C
H A 0020 THR C 3.733 C A 0021 LEU CB
C A 0021 LEU CA 2.991 H A 0022 PRO CD
C A 0021 LEU C 2.482 H A 0022 PRO CA
C A 0021 LEU C 3.037 H A 0022 PRO C
C A 0021 LEU C 3.702 H A 0022 PRO CB
C A 0021 LEU C 3.686 H A 0022 PRO CG
C A 0021 LEU C 2.512 H A 0022 PRO CD
C A 0021 LEU CB 3.540 H A 0022 PRO CD
H A 0022 PRO C 2.469 H A 0023 ASP CA
H A 0022 PRO C 3.050 H A 0023 ASP C
H A 0022 PRO C 3.741 H A 0023 ASP CB
H A 0023 ASP C 2.474 H A 0024 GLU CA
H A 0023 ASP C 3.131 H A 0024 GLU C
H A 0023 ASP C 3.744 H A 0024 GLU CB
H A 0024 GLU C 2.474 H A 0025 GLU CA
H A 0024 GLU C 3.130 H A 0025 GLU C
H A 0024 GLU C 3.730 H A 0025 GLU CB
H A 0025 GLU C 2.480 H A 0026 VAL CA
H A 0025 GLU C 3.047 H A 0026 VAL C
H A 0025 GLU C 3.762 H A 0026 VAL CB
H A 0026 VAL C 2.473 H A 0027 ASP CA
H A 0026 VAL C 3.090 H A 0027 ASP C
H A 0026 VAL C 3.733 H A 0027 ASP CB
H A 0027 ASP C 2.476 H A 0028 SER CA
H A 0027 ASP C 3.079 H A 0028 SER C
H A 0027 ASP C 3.767 H A 0028 SER CB
H A 0028 SER C 2.466 H A 0029 ILE CA
H A 0028 SER C 3.066 H A 0029 ILE C
H A 0028 SER C 3.770 H A 0029 ILE CB
H A 0029 ILE C 2.468 H A 0030 LEU CA
H A 0029 ILE C 3.070 H A 0030 LEU C
H A 0029 ILE C 3.741 H A 0030 LEU CB
H A 0029 ILE CG2 3.741 E A 0036 ILE CG1
H A 0030 LEU C 2.482 H A 0031 ALA CA
H A 0030 LEU C 3.239 H A 0031 ALA C
H A 0030 LEU C 3.703 H A 0031 ALA CB
H A 0030 LEU CD2 3.727 H A 0034 GLY C
H A 0031 ALA C 2.492 H A 0032 GLU CA
H A 0031 ALA C 3.614 H A 0032 GLU C
H A 0031 ALA C 3.500 H A 0032 GLU CB
H A 0031 ALA C 3.623 H A 0032 GLU CG
H A 0032 GLU C 2.491 H A 0033 ASP CA
H A 0032 GLU C 3.704 H A 0033 ASP C
H A 0032 GLU C 3.365 H A 0033 ASP CB
H A 0033 ASP C 2.493 H A 0034 GLY CA
H A 0033 ASP C 3.298 H A 0034 GLY C
H A 0034 GLY C 2.488 E A 0035 GLU CA
H A 0034 GLY C 3.745 E A 0035 GLU C
H A 0034 GLY C 3.217 E A 0035 GLU CB
E A 0035 GLU C 2.510 E A 0036 ILE CA
E A 0035 GLU C 3.602 E A 0036 ILE C
E A 0035 GLU C 3.444 E A 0036 ILE CB
E A 0035 GLU C 3.443 E A 0036 ILE CG1
E A 0036 ILE C 2.501 E A 0037 ASP CA
E A 0036 ILE C 3.514 E A 0037 ASP C
E A 0036 ILE C 3.523 E A 0037 ASP CB
E A 0037 ASP C 2.469 E A 0038 MET CA
E A 0037 ASP C 3.693 E A 0038 MET C
E A 0037 ASP C 3.306 E A 0038 MET CB
E A 0037 ASP CB 3.579 E A 0048 LEU CD2
E A 0037 ASP CG 3.733 E A 0048 LEU CD2
E A 0038 MET C 2.489 E A 0039 HIS CA
E A 0038 MET C 3.389 E A 0039 HIS C
E A 0038 MET C 3.639 E A 0039 HIS CB
E A 0039 HIS C 2.489 C A 0040 CYS CA
E A 0039 HIS C 3.066 C A 0040 CYS C
E A 0039 HIS C 3.706 C A 0040 CYS CB
C A 0040 CYS C 2.484 C A 0041 ASP CA
C A 0040 CYS C 3.164 C A 0041 ASP C
C A 0040 CYS C 3.719 C A 0041 ASP CB
C A 0041 ASP C 2.489 C A 0042 TYR CA
C A 0041 ASP C 3.482 C A 0042 TYR C
C A 0041 ASP C 3.587 C A 0042 TYR CB
C A 0041 ASP C 3.786 C A 0042 TYR CD1
C A 0042 TYR C 2.489 C A 0043 CYS CA
C A 0042 TYR C 3.743 C A 0043 CYS C
C A 0042 TYR C 3.305 C A 0043 CYS CB
C A 0043 CYS C 2.482 C A 0044 GLY CA
C A 0043 CYS C 3.314 C A 0044 GLY C
C A 0044 GLY C 2.477 C A 0045 ASN CA
C A 0044 GLY C 3.106 C A 0045 ASN C
C A 0044 GLY C 3.726 C A 0045 ASN CB
C A 0045 ASN C 2.473 E A 0046 HIS CA
C A 0045 ASN C 3.284 E A 0046 HIS C
C A 0045 ASN C 3.701 E A 0046 HIS CB
E A 0046 HIS C 2.498 E A 0047 TYR CA
E A 0046 HIS C 3.677 E A 0047 TYR C
E A 0046 HIS C 3.310 E A 0047 TYR CB
E A 0046 HIS C 3.503 E A 0047 TYR CG
E A 0046 HIS C 3.701 E A 0047 TYR CD2
E A 0047 TYR C 2.461 E A 0048 LEU CA
E A 0047 TYR C 3.462 E A 0048 LEU C
E A 0047 TYR C 3.557 E A 0048 LEU CB
E A 0047 TYR C 3.760 E A 0048 LEU CG
E A 0047 TYR CB 3.664 E A 0049 PHE CE1
E A 0048 LEU C 2.486 E A 0049 PHE CA
E A 0048 LEU C 3.627 E A 0049 PHE C
E A 0048 LEU C 3.401 E A 0049 PHE CB
E A 0048 LEU C 3.436 E A 0049 PHE CG
E A 0048 LEU C 3.432 E A 0049 PHE CD1
E A 0049 PHE C 2.482 E A 0050 ASN CA
E A 0049 PHE C 3.559 E A 0050 ASN C
E A 0049 PHE C 3.471 E A 0050 ASN CB
E A 0050 ASN C 2.463 H A 0051 ALA CA
E A 0050 ASN C 3.069 H A 0051 ALA C
E A 0050 ASN C 3.712 H A 0051 ALA CB
H A 0051 ALA C 2.477 H A 0052 MET CA
H A 0051 ALA C 3.164 H A 0052 MET C
H A 0051 ALA C 3.742 H A 0052 MET CB
H A 0052 MET C 2.470 H A 0053 ASP CA
H A 0052 MET C 3.101 H A 0053 ASP C
H A 0052 MET C 3.706 H A 0053 ASP CB
H A 0053 ASP C 2.484 H A 0054 ILE CA
H A 0053 ASP C 3.076 H A 0054 ILE C
H A 0053 ASP C 3.734 H A 0054 ILE CB
H A 0054 ILE C 2.459 H A 0055 ALA CA
H A 0054 ILE C 3.087 H A 0055 ALA C
H A 0054 ILE C 3.729 H A 0055 ALA CB
H A 0055 ALA C 2.470 H A 0056 GLU CA
H A 0055 ALA C 3.123 H A 0056 GLU C
H A 0055 ALA C 3.745 H A 0056 GLU CB
H A 0056 GLU C 2.490 H A 0057 ILE CA
H A 0056 GLU C 3.054 H A 0057 ILE C
H A 0056 GLU C 3.762 H A 0057 ILE CB
H A 0057 ILE C 2.512 H A 0058 ARG CA
H A 0057 ILE C 3.204 H A 0058 ARG C
H A 0057 ILE C 3.749 H A 0058 ARG CB
H A 0058 ARG C 2.503 C A 0059 ASN CA
H A 0058 ARG C 3.558 C A 0059 ASN C
H A 0058 ARG C 3.504 C A 0059 ASN CB
H A 0058 ARG C 3.706 C A 0059 ASN CG
C A 0059 ASN C 2.500 C A 0060 ASN CA
C A 0059 ASN C 3.686 C A 0060 ASN C
C A 0059 ASN C 3.359 C A 0060 ASN CB
C A 0060 ASN C 2.502 C A 0061 ALA CA
C A 0060 ASN C 3.495 C A 0061 ALA C
C A 0060 ASN C 3.565 C A 0061 ALA CB
C A 0061 ALA C 2.525 C A 0062 SER CA
C A 0061 ALA C 3.635 C A 0062 SER C
C A 0061 ALA C 3.499 C A 0062 SER CB
CHARGE_ATTR 2.00 12.00 64
C A 0002 ASP OD1 2.743 C A 0006 LYS NZ
C A 0002 ASP OD2 3.839 C A 0006 LYS NZ
C A 0004 GLU OE1 9.842 C A 0006 LYS NZ
C A 0004 GLU OE2 10.08 C A 0006 LYS NZ
H A 0012 GLU OE1 8.885 H A 0011 ARG NH1
H A 0012 GLU OE1 7.598 H A 0011 ARG NH2
H A 0012 GLU OE2 7.877 H A 0011 ARG NH1
H A 0012 GLU OE2 6.932 H A 0011 ARG NH2
H A 0012 GLU OE1 7.298 H A 0013 ARG NH1
H A 0012 GLU OE1 8.731 H A 0013 ARG NH2
H A 0012 GLU OE2 7.388 H A 0013 ARG NH1
H A 0012 GLU OE2 9.208 H A 0013 ARG NH2
H A 0012 GLU OE1 11.59 H A 0019 LYS NZ
H A 0012 GLU OE2 9.990 H A 0019 LYS NZ
H A 0016 ASP OD1 7.280 H A 0013 ARG NH1
H A 0016 ASP OD1 9.384 H A 0013 ARG NH2
H A 0016 ASP OD2 6.935 H A 0013 ARG NH1
H A 0016 ASP OD2 8.888 H A 0013 ARG NH2
H A 0016 ASP OD1 7.324 H A 0019 LYS NZ
H A 0016 ASP OD2 9.243 H A 0019 LYS NZ
H A 0023 ASP OD1 7.652 H A 0019 LYS NZ
H A 0023 ASP OD2 8.251 H A 0019 LYS NZ
H A 0023 ASP OD1 2.791 H A 0058 ARG NH1
H A 0023 ASP OD1 2.785 H A 0058 ARG NH2
H A 0023 ASP OD2 4.695 H A 0058 ARG NH1
H A 0023 ASP OD2 4.973 H A 0058 ARG NH2
H A 0024 GLU OE1 11.81 H A 0058 ARG NH1
H A 0024 GLU OE1 10.99 H A 0058 ARG NH2
H A 0024 GLU OE2 11.91 H A 0058 ARG NH2
H A 0025 GLU OE1 10.67 H A 0058 ARG NH2
H A 0025 GLU OE2 11.99 H A 0058 ARG NH2
H A 0027 ASP OD1 8.774 H A 0058 ARG NH1
H A 0027 ASP OD1 7.487 H A 0058 ARG NH2
H A 0027 ASP OD2 10.01 H A 0058 ARG NH1
H A 0027 ASP OD2 8.687 H A 0058 ARG NH2
H A 0033 ASP OD2 11.79 E A 0046 HIS ND1
E A 0035 GLU OE1 11.83 H A 0011 ARG NH1
E A 0035 GLU OE2 10.88 H A 0011 ARG NH1
E A 0035 GLU OE2 10.05 E A 0046 HIS ND1
E A 0037 ASP OD1 10.74 H A 0011 ARG NH1
E A 0037 ASP OD1 8.436 E A 0039 HIS ND1
E A 0037 ASP OD1 8.625 E A 0039 HIS NE2
E A 0037 ASP OD2 9.454 E A 0039 HIS ND1
E A 0037 ASP OD2 9.143 E A 0039 HIS NE2
E A 0037 ASP OD1 2.811 E A 0046 HIS ND1
E A 0037 ASP OD1 4.905 E A 0046 HIS NE2
E A 0037 ASP OD2 3.893 E A 0046 HIS ND1
E A 0037 ASP OD2 5.456 E A 0046 HIS NE2
C A 0041 ASP OD2 10.34 H A 0013 ARG NH1
C A 0041 ASP OD2 11.37 H A 0013 ARG NH2
C A 0041 ASP OD1 6.471 E A 0039 HIS ND1
C A 0041 ASP OD1 7.862 E A 0039 HIS NE2
C A 0041 ASP OD2 8.294 E A 0039 HIS ND1
C A 0041 ASP OD2 9.890 E A 0039 HIS NE2
C A 0041 ASP OD1 11.94 E A 0046 HIS NE2
H A 0053 ASP OD1 3.676 H A 0011 ARG NH1
H A 0053 ASP OD1 2.816 H A 0011 ARG NH2
H A 0053 ASP OD2 2.739 H A 0011 ARG NH1
H A 0053 ASP OD2 3.368 H A 0011 ARG NH2
H A 0053 ASP OD2 11.86 H A 0058 ARG NH2
H A 0056 GLU OE1 10.75 H A 0011 ARG NH1
H A 0056 GLU OE1 8.888 H A 0011 ARG NH2
H A 0056 GLU OE2 11.62 H A 0011 ARG NH1
H A 0056 GLU OE2 10.01 H A 0011 ARG NH2
CHARGE_REPU 2.00 12.00 79
C A 0002 ASP OD1 8.945 C A 0004 GLU OE1
C A 0002 ASP OD1 8.747 C A 0004 GLU OE2
C A 0002 ASP OD2 7.884 C A 0004 GLU OE1
C A 0002 ASP OD2 8.012 C A 0004 GLU OE2
H A 0011 ARG NH1 11.90 E A 0046 HIS ND1
H A 0012 GLU OE1 8.852 H A 0016 ASP OD1
H A 0012 GLU OE1 9.985 H A 0016 ASP OD2
H A 0012 GLU OE2 7.308 H A 0016 ASP OD1
H A 0012 GLU OE2 8.494 H A 0016 ASP OD2
H A 0012 GLU OE1 9.307 H A 0053 ASP OD1
H A 0012 GLU OE1 10.02 H A 0053 ASP OD2
H A 0012 GLU OE2 8.382 H A 0053 ASP OD1
H A 0012 GLU OE2 8.756 H A 0053 ASP OD2
H A 0012 GLU OE1 10.67 H A 0056 GLU OE1
H A 0012 GLU OE2 10.63 H A 0056 GLU OE1
H A 0012 GLU OE2 11.71 H A 0056 GLU OE2
H A 0016 ASP OD1 10.78 C A 0041 ASP OD1
H A 0016 ASP OD1 9.311 C A 0041 ASP OD2
H A 0016 ASP OD2 8.747 C A 0041 ASP OD1
H A 0016 ASP OD2 7.167 C A 0041 ASP OD2
H A 0019 LYS NZ 6.485 H A 0058 ARG NH1
H A 0019 LYS NZ 7.781 H A 0058 ARG NH2
H A 0023 ASP OD1 9.142 H A 0024 GLU OE1
H A 0023 ASP OD1 10.45 H A 0024 GLU OE2
H A 0023 ASP OD2 7.945 H A 0024 GLU OE1
H A 0023 ASP OD2 9.577 H A 0024 GLU OE2
H A 0023 ASP OD1 10.58 H A 0025 GLU OE1
H A 0023 ASP OD1 11.63 H A 0025 GLU OE2
H A 0023 ASP OD2 10.73 H A 0025 GLU OE1
H A 0023 ASP OD2 11.52 H A 0025 GLU OE2
H A 0023 ASP OD1 8.486 H A 0027 ASP OD1
H A 0023 ASP OD1 9.142 H A 0027 ASP OD2
H A 0023 ASP OD2 9.818 H A 0027 ASP OD1
H A 0023 ASP OD2 10.07 H A 0027 ASP OD2
H A 0024 GLU OE1 9.584 H A 0025 GLU OE1
H A 0024 GLU OE1 8.710 H A 0025 GLU OE2
H A 0024 GLU OE2 9.012 H A 0025 GLU OE1
H A 0024 GLU OE2 7.768 H A 0025 GLU OE2
H A 0024 GLU OE1 10.80 H A 0027 ASP OD1
H A 0024 GLU OE1 9.387 H A 0027 ASP OD2
H A 0024 GLU OE2 10.70 H A 0027 ASP OD1
H A 0024 GLU OE2 9.043 H A 0027 ASP OD2
H A 0024 GLU OE2 11.45 H A 0032 GLU OE2
H A 0025 GLU OE1 11.96 H A 0027 ASP OD2
H A 0025 GLU OE2 11.94 H A 0027 ASP OD2
H A 0025 GLU OE1 11.46 H A 0032 GLU OE2
H A 0025 GLU OE2 10.65 H A 0032 GLU OE2
H A 0027 ASP OD1 11.90 H A 0032 GLU OE1
H A 0027 ASP OD1 10.42 H A 0032 GLU OE2
H A 0027 ASP OD2 10.75 H A 0032 GLU OE1
H A 0027 ASP OD2 9.216 H A 0032 GLU OE2
H A 0032 GLU OE1 8.906 H A 0033 ASP OD1
H A 0032 GLU OE1 10.01 H A 0033 ASP OD2
H A 0032 GLU OE2 9.201 H A 0033 ASP OD1
H A 0032 GLU OE2 9.846 H A 0033 ASP OD2
H A 0033 ASP OD1 6.710 E A 0035 GLU OE1
H A 0033 ASP OD1 7.035 E A 0035 GLU OE2
H A 0033 ASP OD2 5.482 E A 0035 GLU OE1
H A 0033 ASP OD2 5.372 E A 0035 GLU OE2
H A 0033 ASP OD1 11.16 E A 0037 ASP OD1
H A 0033 ASP OD1 9.952 E A 0037 ASP OD2
H A 0033 ASP OD2 9.269 E A 0037 ASP OD1
H A 0033 ASP OD2 8.303 E A 0037 ASP OD2
E A 0035 GLU OE1 9.434 E A 0037 ASP OD1
E A 0035 GLU OE1 9.294 E A 0037 ASP OD2
E A 0035 GLU OE2 7.256 E A 0037 ASP OD1
E A 0035 GLU OE2 7.200 E A 0037 ASP OD2
E A 0035 GLU OE1 10.68 H A 0053 ASP OD2
E A 0035 GLU OE2 11.70 H A 0053 ASP OD1
E A 0035 GLU OE2 10.13 H A 0053 ASP OD2
E A 0037 ASP OD1 11.43 H A 0053 ASP OD2
E A 0039 HIS ND1 6.591 E A 0046 HIS ND1
E A 0039 HIS ND1 5.640 E A 0046 HIS NE2
E A 0039 HIS NE2 6.695 E A 0046 HIS ND1
E A 0039 HIS NE2 5.324 E A 0046 HIS NE2
H A 0053 ASP OD1 7.468 H A 0056 GLU OE1
H A 0053 ASP OD1 8.114 H A 0056 GLU OE2
H A 0053 ASP OD2 9.498 H A 0056 GLU OE1
H A 0053 ASP OD2 9.919 H A 0056 GLU OE2
HB_MM 2.00 3.20 100
C A 0002 ASP N 2.247 C A 0001 MET O
C A 0003 VAL N 2.248 C A 0002 ASP O
C A 0004 GLU N 2.242 C A 0003 VAL O
C A 0005 PHE N 2.245 C A 0004 GLU O
C A 0006 LYS N 2.256 C A 0005 PHE O
C A 0007 CYS N 2.262 C A 0006 LYS O
C A 0008 THR N 3.161 C A 0006 LYS O
C A 0008 THR N 2.250 C A 0007 CYS O
C A 0009 CYS N 2.255 C A 0008 THR O
H A 0010 SER N 2.256 C A 0009 CYS O
H A 0011 ARG N 2.258 H A 0010 SER O
H A 0012 GLU N 3.079 H A 0010 SER O
H A 0012 GLU N 2.245 H A 0011 ARG O
H A 0013 ARG N 2.982 H A 0010 SER O
H A 0013 ARG N 2.243 H A 0012 GLU O
H A 0014 CYS N 3.071 H A 0011 ARG O
H A 0014 CYS N 2.249 H A 0013 ARG O
H A 0015 ALA N 2.822 H A 0011 ARG O
H A 0015 ALA N 2.246 H A 0014 CYS O
H A 0016 ASP N 2.926 H A 0012 GLU O
H A 0016 ASP N 2.239 H A 0015 ALA O
H A 0017 ALA N 3.117 H A 0013 ARG O
H A 0017 ALA N 2.253 H A 0016 ASP O
H A 0018 LEU N 3.195 H A 0014 CYS O
H A 0018 LEU N 3.161 H A 0015 ALA O
H A 0018 LEU N 2.245 H A 0017 ALA O
H A 0019 LYS N 2.943 H A 0015 ALA O
H A 0019 LYS N 2.249 H A 0018 LEU O
H A 0020 THR N 3.181 H A 0018 LEU O
H A 0020 THR N 2.246 H A 0019 LYS O
C A 0021 LEU N 3.089 H A 0018 LEU O
C A 0021 LEU N 2.245 H A 0020 THR O
H A 0022 PRO N 2.260 C A 0021 LEU O
H A 0023 ASP N 2.250 H A 0022 PRO O
H A 0024 GLU N 2.248 H A 0023 ASP O
H A 0025 GLU N 3.115 H A 0022 PRO O
H A 0025 GLU N 2.241 H A 0024 GLU O
H A 0026 VAL N 3.120 H A 0022 PRO O
H A 0026 VAL N 2.254 H A 0025 GLU O
H A 0027 ASP N 2.945 H A 0023 ASP O
H A 0027 ASP N 2.247 H A 0026 VAL O
H A 0028 SER N 2.944 H A 0024 GLU O
H A 0028 SER N 2.246 H A 0027 ASP O
H A 0029 ILE N 2.247 H A 0028 SER O
H A 0030 LEU N 3.161 H A 0026 VAL O
H A 0030 LEU N 2.243 H A 0029 ILE O
H A 0031 ALA N 2.873 H A 0027 ASP O
H A 0031 ALA N 2.241 H A 0030 LEU O
H A 0032 GLU N 3.104 H A 0029 ILE O
H A 0032 GLU N 2.246 H A 0031 ALA O
H A 0033 ASP N 2.862 H A 0029 ILE O
H A 0033 ASP N 2.245 H A 0032 GLU O
H A 0034 GLY N 3.030 H A 0030 LEU O
H A 0034 GLY N 2.242 H A 0033 ASP O
E A 0035 GLU N 2.244 H A 0034 GLY O
E A 0036 ILE N 2.251 E A 0035 GLU O
E A 0036 ILE N 2.803 E A 0049 PHE O
E A 0037 ASP N 2.250 E A 0036 ILE O
E A 0038 MET N 2.256 E A 0037 ASP O
E A 0038 MET N 3.133 E A 0047 TYR O
E A 0039 HIS N 2.255 E A 0038 MET O
C A 0040 CYS N 2.254 E A 0039 HIS O
C A 0040 CYS N 2.828 C A 0045 ASN O
C A 0041 ASP N 2.245 C A 0040 CYS O
C A 0042 TYR N 3.090 C A 0040 CYS O
C A 0042 TYR N 2.246 C A 0041 ASP O
C A 0043 CYS N 2.257 C A 0042 TYR O
C A 0044 GLY N 2.883 C A 0040 CYS O
C A 0044 GLY N 2.236 C A 0043 CYS O
C A 0045 ASN N 2.241 C A 0044 GLY O
E A 0046 HIS N 2.242 C A 0045 ASN O
E A 0047 TYR N 2.953 E A 0038 MET O
E A 0047 TYR N 2.260 E A 0046 HIS O
E A 0048 LEU N 2.262 E A 0047 TYR O
E A 0049 PHE N 2.915 E A 0036 ILE O
E A 0049 PHE N 2.254 E A 0048 LEU O
E A 0050 ASN N 2.241 E A 0049 PHE O
H A 0051 ALA N 2.246 E A 0050 ASN O
H A 0052 MET N 2.244 H A 0051 ALA O
H A 0053 ASP N 2.238 H A 0052 MET O
H A 0054 ILE N 2.897 E A 0050 ASN O
H A 0054 ILE N 2.244 H A 0053 ASP O
H A 0055 ALA N 2.966 H A 0051 ALA O
H A 0055 ALA N 2.241 H A 0054 ILE O
H A 0056 GLU N 3.188 H A 0052 MET O
H A 0056 GLU N 3.178 H A 0053 ASP O
H A 0056 GLU N 2.242 H A 0055 ALA O
H A 0057 ILE N 3.030 H A 0053 ASP O
H A 0057 ILE N 2.248 H A 0056 GLU O
H A 0058 ARG N 2.917 H A 0054 ILE O
H A 0058 ARG N 2.237 H A 0057 ILE O
C A 0059 ASN N 3.037 H A 0056 GLU O
C A 0059 ASN N 3.134 H A 0057 ILE O
C A 0059 ASN N 2.248 H A 0058 ARG O
C A 0060 ASN N 3.196 H A 0056 GLU O
C A 0060 ASN N 3.078 H A 0057 ILE O
C A 0060 ASN N 2.250 C A 0059 ASN O
C A 0061 ALA N 2.813 H A 0057 ILE O
C A 0061 ALA N 2.250 C A 0060 ASN O
C A 0062 SER N 2.255 C A 0061 ALA O
HB_MS 2.00 3.20 9
C A 0003 VAL N 2.880 C A 0002 ASP OD1
C A 0006 LYS O 3.190 C A 0045 ASN ND2
C A 0009 CYS O 2.729 H A 0010 SER OG
H A 0024 GLU O 2.712 H A 0028 SER OG
H A 0052 MET N 3.075 E A 0050 ASN OD1
H A 0053 ASP N 2.941 E A 0050 ASN OD1
H A 0055 ALA O 2.839 C A 0059 ASN ND2
H A 0058 ARG O 3.157 C A 0062 SER OG
C A 0061 ALA O 2.818 H A 0019 LYS NZ
HB_SS 2.00 3.20 1
H A 0019 LYS NZ 2.846 C A 0062 SER OG
AROMATIC 0.00 8.00 2
E A 0039 HIS 5.512 E A 0046 HIS
H A 0011 ARG 4.053 E A 0049 PHE