Complet list of 1nin con file
Complete list of 1nin.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 543
C A 0001 GLU C 2.482 C A 0002 THR CA
C A 0001 GLU C 3.059 C A 0002 THR C
C A 0001 GLU C 3.735 C A 0002 THR CB
C A 0001 GLU CA 3.797 E A 0003 TYR CZ
C A 0001 GLU CB 3.760 E A 0003 TYR CE1
C A 0001 GLU C 3.721 C A 0028 THR C
C A 0002 THR C 2.472 E A 0003 TYR CA
C A 0002 THR C 3.152 E A 0003 TYR C
C A 0002 THR C 3.713 E A 0003 TYR CB
C A 0002 THR CA 3.226 C A 0028 THR C
C A 0002 THR CA 3.734 C A 0028 THR CB
C A 0002 THR CB 3.618 C A 0028 THR CB
C A 0002 THR CB 3.282 C A 0028 THR CG2
C A 0002 THR CA 3.719 E A 0029 VAL CA
C A 0002 THR CG2 3.731 C A 0073 SER CB
E A 0003 TYR C 2.439 E A 0004 THR CA
E A 0003 TYR C 3.459 E A 0004 THR C
E A 0003 TYR C 3.623 E A 0004 THR CB
E A 0003 TYR C 3.735 E A 0030 GLU CB
E A 0004 THR CA 3.777 E A 0005 VAL CA
E A 0004 THR C 2.480 E A 0005 VAL CA
E A 0004 THR C 3.222 E A 0005 VAL C
E A 0004 THR C 3.650 E A 0005 VAL CB
E A 0004 THR CA 3.721 E A 0030 GLU CB
E A 0005 VAL CA 3.777 E A 0006 LYS CA
E A 0005 VAL C 2.404 E A 0006 LYS CA
E A 0005 VAL C 3.270 E A 0006 LYS C
E A 0005 VAL C 3.541 E A 0006 LYS CB
E A 0005 VAL CG1 3.218 C A 0016 PHE CD2
E A 0005 VAL CG1 3.465 C A 0016 PHE CE2
E A 0006 LYS C 2.465 E A 0007 LEU CA
E A 0006 LYS C 3.247 E A 0007 LEU C
E A 0006 LYS C 3.622 E A 0007 LEU CB
E A 0006 LYS C 3.684 E A 0007 LEU CD1
E A 0006 LYS CG 3.595 C A 0017 GLU CB
E A 0006 LYS CD 3.631 C A 0017 GLU CD
E A 0006 LYS CE 3.530 C A 0017 GLU CD
E A 0007 LEU C 2.491 C A 0008 GLY CA
E A 0007 LEU C 3.515 C A 0008 GLY C
E A 0007 LEU CD1 3.351 E A 0032 LEU C
E A 0007 LEU C 3.401 C A 0034 ASN CB
E A 0007 LEU CD2 3.122 C A 0039 HIS CB
E A 0007 LEU CD2 3.537 C A 0039 HIS CG
E A 0007 LEU CD1 3.672 C A 0065 LEU CD2
E A 0007 LEU CA 3.753 C A 0097 MET CE
E A 0007 LEU C 3.677 C A 0097 MET CE
E A 0007 LEU CB 3.796 C A 0097 MET CE
C A 0008 GLY C 2.442 C A 0009 SER CA
C A 0008 GLY C 3.615 C A 0009 SER C
C A 0008 GLY C 3.480 C A 0009 SER CB
C A 0008 GLY CA 3.546 C A 0034 ASN CB
C A 0008 GLY C 3.411 C A 0034 ASN CB
C A 0008 GLY C 3.311 C A 0034 ASN CG
C A 0009 SER C 2.436 C A 0010 ASP CA
C A 0009 SER C 3.498 C A 0010 ASP C
C A 0009 SER C 3.470 C A 0010 ASP CB
C A 0009 SER C 3.628 C A 0035 LYS CE
C A 0010 ASP C 2.469 C A 0011 LYS CA
C A 0010 ASP C 3.385 C A 0011 LYS C
C A 0010 ASP C 3.632 C A 0011 LYS CB
C A 0010 ASP C 3.754 C A 0011 LYS CD
C A 0010 ASP CB 3.603 C A 0011 LYS CD
C A 0010 ASP CG 3.535 C A 0011 LYS CD
C A 0010 ASP CG 3.740 C A 0011 LYS CE
C A 0010 ASP CG 3.661 C A 0013 LEU CD2
C A 0010 ASP CA 3.752 C A 0035 LYS CE
C A 0010 ASP C 3.110 C A 0035 LYS CE
C A 0011 LYS C 2.477 C A 0012 GLY CA
C A 0011 LYS C 3.635 C A 0012 GLY C
C A 0011 LYS C 3.685 C A 0035 LYS CD
C A 0011 LYS C 3.455 C A 0035 LYS CE
C A 0012 GLY C 2.480 C A 0013 LEU CA
C A 0012 GLY C 3.007 C A 0013 LEU C
C A 0012 GLY C 3.615 C A 0013 LEU CB
C A 0012 GLY CA 3.587 C A 0035 LYS CD
C A 0012 GLY C 3.251 C A 0035 LYS CD
C A 0013 LEU C 2.470 C A 0014 LEU CA
C A 0013 LEU C 3.469 C A 0014 LEU C
C A 0013 LEU C 3.569 C A 0014 LEU CB
C A 0013 LEU C 3.775 C A 0014 LEU CG
C A 0014 LEU C 2.451 C A 0015 VAL CA
C A 0014 LEU C 3.540 C A 0015 VAL C
C A 0014 LEU C 3.513 C A 0015 VAL CB
C A 0014 LEU C 3.529 C A 0015 VAL CG1
C A 0014 LEU CD2 3.682 C A 0035 LYS C
C A 0014 LEU CD2 3.335 C A 0035 LYS CB
C A 0014 LEU CD1 3.667 C A 0036 VAL CB
C A 0014 LEU CD1 3.634 C A 0036 VAL CG2
C A 0014 LEU CD2 3.580 C A 0036 VAL CB
C A 0015 VAL C 2.472 C A 0016 PHE CA
C A 0015 VAL C 3.417 C A 0016 PHE C
C A 0015 VAL C 3.610 C A 0016 PHE CB
C A 0016 PHE C 2.434 C A 0017 GLU CA
C A 0016 PHE C 3.443 C A 0017 GLU C
C A 0016 PHE C 3.480 C A 0017 GLU CB
C A 0016 PHE C 3.409 C A 0018 PRO C
C A 0016 PHE CD1 3.624 C A 0097 MET CA
C A 0016 PHE CD1 3.357 C A 0097 MET C
C A 0016 PHE CE1 3.301 C A 0097 MET C
C A 0016 PHE CG 3.790 C A 0098 VAL C
C A 0016 PHE CD2 3.697 C A 0099 GLY CA
C A 0017 GLU CA 2.987 C A 0018 PRO CA
C A 0017 GLU CA 3.521 C A 0018 PRO C
C A 0017 GLU C 2.521 C A 0018 PRO CA
C A 0017 GLU C 3.326 C A 0018 PRO C
C A 0017 GLU C 3.633 C A 0018 PRO CB
C A 0017 GLU C 3.607 C A 0018 PRO CG
C A 0017 GLU C 2.449 C A 0018 PRO CD
C A 0018 PRO C 2.466 C A 0019 ALA CA
C A 0018 PRO C 3.524 C A 0019 ALA C
C A 0018 PRO C 3.498 C A 0019 ALA CB
C A 0019 ALA C 2.480 E A 0020 LYS CA
C A 0019 ALA C 3.423 E A 0020 LYS C
C A 0019 ALA C 3.528 E A 0020 LYS CB
E A 0020 LYS C 2.471 E A 0021 LEU CA
E A 0020 LYS C 3.626 E A 0021 LEU C
E A 0020 LYS C 3.498 E A 0021 LEU CB
E A 0020 LYS CE 3.761 E A 0021 LEU C
E A 0021 LEU C 2.424 E A 0022 THR CA
E A 0021 LEU C 3.129 E A 0022 THR C
E A 0021 LEU C 3.662 E A 0022 THR CB
E A 0021 LEU CD2 3.222 E A 0022 THR C
E A 0021 LEU CG 3.743 C A 0023 ILE CG2
E A 0021 LEU CD1 3.078 C A 0023 ILE CG2
E A 0021 LEU CD2 3.221 C A 0023 ILE CG2
E A 0022 THR C 2.445 C A 0023 ILE CA
E A 0022 THR C 3.324 C A 0023 ILE C
E A 0022 THR C 3.606 C A 0023 ILE CB
E A 0022 THR C 3.765 C A 0023 ILE CG2
E A 0022 THR CA 3.561 E A 0102 THR CB
E A 0022 THR CG2 3.748 E A 0102 THR CB
C A 0023 ILE CA 3.776 C A 0024 LYS CA
C A 0023 ILE C 2.415 C A 0024 LYS CA
C A 0023 ILE C 3.404 C A 0024 LYS C
C A 0023 ILE C 3.531 C A 0024 LYS CB
C A 0023 ILE C 3.173 C A 0024 LYS CD
C A 0023 ILE CB 3.633 C A 0027 ASP CB
C A 0023 ILE CD1 3.422 C A 0027 ASP CB
C A 0023 ILE CG1 3.615 E A 0101 ILE CD1
C A 0023 ILE CG2 3.462 E A 0101 ILE CG1
C A 0023 ILE CG2 3.553 E A 0101 ILE CD1
C A 0023 ILE CD1 3.297 E A 0101 ILE CD1
C A 0023 ILE CG1 3.700 E A 0102 THR C
C A 0023 ILE CG1 3.594 C A 0103 VAL CA
C A 0023 ILE CD1 3.795 C A 0103 VAL CG1
C A 0024 LYS CA 2.976 C A 0025 PRO CD
C A 0024 LYS C 2.473 C A 0025 PRO CA
C A 0024 LYS C 3.143 C A 0025 PRO C
C A 0024 LYS C 3.642 C A 0025 PRO CB
C A 0024 LYS C 3.580 C A 0025 PRO CG
C A 0024 LYS C 2.501 C A 0025 PRO CD
C A 0024 LYS CB 3.387 C A 0025 PRO CD
C A 0024 LYS CB 3.786 C A 0027 ASP CB
C A 0025 PRO C 2.470 C A 0026 GLY CA
C A 0025 PRO C 3.473 C A 0026 GLY C
C A 0025 PRO C 3.710 C A 0078 ALA CA
C A 0025 PRO CD 3.526 C A 0104 ALA C
C A 0025 PRO CD 3.665 C A 0105 GLY CA
C A 0026 GLY CA 3.783 C A 0027 ASP CA
C A 0026 GLY C 2.447 C A 0027 ASP CA
C A 0026 GLY C 3.416 C A 0027 ASP C
C A 0026 GLY C 3.501 C A 0027 ASP CB
C A 0026 GLY CA 3.693 C A 0077 PRO C
C A 0027 ASP C 2.459 C A 0028 THR CA
C A 0027 ASP C 3.445 C A 0028 THR C
C A 0027 ASP C 3.567 C A 0028 THR CB
C A 0028 THR C 2.467 E A 0029 VAL CA
C A 0028 THR C 3.586 E A 0029 VAL C
C A 0028 THR C 3.448 E A 0029 VAL CB
C A 0028 THR C 3.456 E A 0029 VAL CG2
C A 0028 THR CG2 3.551 C A 0074 THR C
E A 0029 VAL C 2.426 E A 0030 GLU CA
E A 0029 VAL C 3.479 E A 0030 GLU C
E A 0029 VAL C 3.415 E A 0030 GLU CB
E A 0029 VAL CB 3.687 E A 0031 PHE CE1
E A 0029 VAL CG1 3.389 E A 0031 PHE CE1
E A 0029 VAL CG1 3.274 E A 0031 PHE CZ
E A 0029 VAL CG2 3.616 C A 0076 PHE CE2
E A 0029 VAL CG2 3.401 E A 0101 ILE CD1
E A 0030 GLU C 2.456 E A 0031 PHE CA
E A 0030 GLU C 3.499 E A 0031 PHE C
E A 0030 GLU C 3.508 E A 0031 PHE CB
E A 0030 GLU C 3.517 E A 0031 PHE CG
E A 0030 GLU C 3.393 E A 0031 PHE CD1
E A 0030 GLU CD 3.789 E A 0031 PHE CA
E A 0030 GLU CD 3.573 E A 0031 PHE C
E A 0030 GLU CD 3.465 C A 0071 SER CB
E A 0031 PHE C 2.458 E A 0032 LEU CA
E A 0031 PHE C 3.540 E A 0032 LEU C
E A 0031 PHE C 3.499 E A 0032 LEU CB
E A 0031 PHE CE1 3.571 C A 0061 HIS CE1
E A 0031 PHE CZ 3.479 C A 0061 HIS CE1
E A 0032 LEU C 2.423 E A 0033 ASN CA
E A 0032 LEU C 3.103 E A 0033 ASN C
E A 0032 LEU C 3.688 E A 0033 ASN CB
E A 0032 LEU CD2 3.612 E A 0033 ASN C
E A 0033 ASN C 2.425 C A 0034 ASN CA
E A 0033 ASN C 3.431 C A 0034 ASN C
E A 0033 ASN C 3.532 C A 0034 ASN CB
E A 0033 ASN CB 3.582 C A 0065 LEU CB
E A 0033 ASN CG 3.764 C A 0067 SER C
C A 0034 ASN C 2.455 C A 0035 LYS CA
C A 0034 ASN C 3.675 C A 0035 LYS C
C A 0034 ASN C 3.311 C A 0035 LYS CB
C A 0034 ASN C 2.991 C A 0035 LYS CG
C A 0034 ASN CG 3.782 C A 0035 LYS CG
C A 0035 LYS C 2.510 C A 0036 VAL CA
C A 0035 LYS C 3.033 C A 0036 VAL C
C A 0035 LYS C 3.590 C A 0036 VAL CB
C A 0036 VAL CA 2.918 C A 0037 PRO CD
C A 0036 VAL C 2.472 C A 0037 PRO CA
C A 0036 VAL C 3.351 C A 0037 PRO C
C A 0036 VAL C 3.559 C A 0037 PRO CB
C A 0036 VAL C 3.655 C A 0037 PRO CG
C A 0036 VAL C 2.506 C A 0037 PRO CD
C A 0037 PRO CA 2.945 C A 0038 PRO CA
C A 0037 PRO C 2.512 C A 0038 PRO CA
C A 0037 PRO C 3.368 C A 0038 PRO C
C A 0037 PRO C 3.527 C A 0038 PRO CB
C A 0037 PRO C 3.637 C A 0038 PRO CG
C A 0037 PRO C 2.457 C A 0038 PRO CD
C A 0037 PRO CB 3.268 C A 0038 PRO CA
C A 0037 PRO CB 3.701 C A 0066 MET CA
C A 0037 PRO C 3.401 C A 0092 HIS CE1
C A 0038 PRO C 2.428 C A 0039 HIS CA
C A 0038 PRO C 3.576 C A 0039 HIS C
C A 0038 PRO C 3.492 C A 0039 HIS CB
C A 0038 PRO C 3.613 C A 0039 HIS CG
C A 0038 PRO C 3.634 C A 0092 HIS CE1
C A 0039 HIS C 2.466 C A 0040 ASN CA
C A 0039 HIS C 3.397 C A 0040 ASN C
C A 0039 HIS C 3.609 C A 0040 ASN CB
C A 0039 HIS CB 3.795 C A 0065 LEU CB
C A 0039 HIS CE1 3.327 C A 0092 HIS CE1
C A 0039 HIS CE1 3.501 C A 0097 MET CE
C A 0040 ASN C 2.397 E A 0041 VAL CA
C A 0040 ASN C 3.422 E A 0041 VAL C
C A 0040 ASN C 3.546 E A 0041 VAL CB
C A 0040 ASN C 3.671 E A 0041 VAL CG1
C A 0040 ASN CG 3.735 C A 0062 LYS CA
C A 0040 ASN CG 3.637 C A 0062 LYS CB
C A 0040 ASN CG 3.781 C A 0062 LYS CE
C A 0040 ASN CB 3.782 C A 0090 GLU CG
C A 0040 ASN CB 3.611 C A 0090 GLU CD
E A 0041 VAL CA 3.777 E A 0042 VAL CA
E A 0041 VAL C 2.420 E A 0042 VAL CA
E A 0041 VAL C 3.283 E A 0042 VAL C
E A 0041 VAL C 3.510 E A 0042 VAL CB
E A 0041 VAL C 3.594 E A 0042 VAL CG2
E A 0041 VAL CG2 3.429 C A 0061 HIS CD2
E A 0042 VAL C 2.437 E A 0043 PHE CA
E A 0042 VAL C 3.391 E A 0043 PHE C
E A 0042 VAL C 3.689 E A 0043 PHE CB
E A 0042 VAL CA 3.297 C A 0060 SER CB
E A 0042 VAL C 3.208 C A 0060 SER CB
E A 0042 VAL C 3.675 E A 0088 TYR CE1
E A 0042 VAL C 3.612 E A 0088 TYR CZ
E A 0042 VAL CB 3.299 E A 0088 TYR CE2
E A 0042 VAL CB 3.629 E A 0088 TYR CZ
E A 0042 VAL CG1 3.657 E A 0088 TYR CE2
E A 0042 VAL CG1 3.593 E A 0088 TYR CZ
E A 0042 VAL CG2 3.353 C A 0090 GLU CG
E A 0042 VAL CG2 3.580 C A 0090 GLU CD
E A 0043 PHE C 2.512 C A 0044 ASP CA
E A 0043 PHE C 3.171 C A 0044 ASP C
E A 0043 PHE C 3.589 C A 0044 ASP CB
E A 0043 PHE C 3.546 C A 0044 ASP CG
E A 0043 PHE CB 3.615 C A 0044 ASP CG
E A 0043 PHE CB 3.750 H A 0056 ALA C
E A 0043 PHE CD2 3.425 C A 0059 LEU CB
E A 0043 PHE CE2 3.349 C A 0059 LEU CB
E A 0043 PHE CA 3.605 C A 0060 SER CB
E A 0043 PHE CB 3.478 C A 0060 SER CB
E A 0043 PHE CG 3.738 C A 0060 SER CA
E A 0043 PHE CG 3.373 C A 0060 SER CB
E A 0043 PHE CD1 3.204 C A 0060 SER CA
E A 0043 PHE CD1 2.985 C A 0060 SER CB
E A 0043 PHE CE1 3.495 C A 0060 SER CA
E A 0043 PHE CD1 3.412 E A 0087 PHE CB
E A 0043 PHE CD1 3.655 E A 0087 PHE CD1
E A 0043 PHE CE1 3.433 E A 0087 PHE CB
E A 0043 PHE CE1 3.596 E A 0087 PHE CG
E A 0043 PHE CE1 3.180 E A 0087 PHE CD1
E A 0043 PHE CZ 3.403 E A 0087 PHE CD1
E A 0043 PHE C 3.398 E A 0088 TYR CE1
C A 0044 ASP C 2.476 C A 0045 ALA CA
C A 0044 ASP C 2.897 C A 0045 ALA C
C A 0044 ASP C 3.692 C A 0045 ALA CB
C A 0044 ASP CB 3.546 C A 0047 LEU C
C A 0044 ASP CB 3.731 C A 0048 ASN CB
C A 0044 ASP CG 3.548 C A 0048 ASN CB
C A 0045 ALA C 2.449 C A 0046 ALA CA
C A 0045 ALA C 3.498 C A 0046 ALA C
C A 0045 ALA C 3.496 C A 0046 ALA CB
C A 0046 ALA C 2.471 C A 0047 LEU CA
C A 0046 ALA C 3.548 C A 0047 LEU C
C A 0046 ALA C 3.611 C A 0047 LEU CB
C A 0046 ALA C 3.526 C A 0047 LEU CD1
C A 0046 ALA CB 3.573 C A 0047 LEU CD1
C A 0046 ALA CA 3.730 C A 0051 LYS CE
C A 0047 LEU C 2.455 C A 0048 ASN CA
C A 0047 LEU C 3.637 C A 0048 ASN C
C A 0047 LEU C 3.430 C A 0048 ASN CB
C A 0048 ASN CA 2.945 C A 0049 PRO CD
C A 0048 ASN C 2.489 C A 0049 PRO CA
C A 0048 ASN C 3.041 C A 0049 PRO C
C A 0048 ASN C 3.662 C A 0049 PRO CB
C A 0048 ASN C 3.515 C A 0049 PRO CG
C A 0048 ASN C 2.510 C A 0049 PRO CD
C A 0048 ASN CB 3.476 C A 0049 PRO CD
C A 0049 PRO C 2.444 C A 0050 ALA CA
C A 0049 PRO C 3.380 C A 0050 ALA C
C A 0049 PRO C 3.545 C A 0050 ALA CB
C A 0049 PRO CG 3.508 C A 0085 TYR CE1
C A 0049 PRO CG 3.375 C A 0085 TYR CZ
C A 0049 PRO CD 3.444 C A 0085 TYR CE1
C A 0049 PRO CD 3.773 C A 0085 TYR CZ
C A 0050 ALA C 2.492 C A 0051 LYS CA
C A 0050 ALA C 2.999 C A 0051 LYS C
C A 0050 ALA C 3.486 C A 0051 LYS CB
C A 0051 LYS C 2.444 C A 0052 SER CA
C A 0051 LYS C 3.448 C A 0052 SER C
C A 0051 LYS C 3.534 C A 0052 SER CB
C A 0052 SER C 2.469 C A 0053 ALA CA
C A 0052 SER C 3.489 C A 0053 ALA C
C A 0052 SER C 3.424 C A 0053 ALA CB
C A 0052 SER CB 3.541 C A 0054 ASP CG
C A 0053 ALA C 2.514 C A 0054 ASP CA
C A 0053 ALA C 2.998 C A 0054 ASP C
C A 0053 ALA C 3.591 C A 0054 ASP CB
C A 0053 ALA C 3.538 C A 0054 ASP CG
C A 0053 ALA C 3.784 H A 0057 LYS CG
C A 0053 ALA C 3.618 H A 0057 LYS CD
C A 0054 ASP C 2.460 C A 0055 LEU CA
C A 0054 ASP C 3.186 C A 0055 LEU C
C A 0054 ASP C 3.629 C A 0055 LEU CB
C A 0054 ASP CA 3.779 H A 0057 LYS CD
C A 0054 ASP C 3.458 H A 0057 LYS CD
C A 0055 LEU C 2.461 H A 0056 ALA CA
C A 0055 LEU C 2.905 H A 0056 ALA C
C A 0055 LEU C 3.646 H A 0056 ALA CB
C A 0055 LEU CD1 3.754 C A 0059 LEU CG
C A 0055 LEU CD1 3.401 C A 0059 LEU CD1
C A 0055 LEU CD2 3.697 C A 0059 LEU CD2
H A 0056 ALA C 2.432 H A 0057 LYS CA
H A 0056 ALA C 3.300 H A 0057 LYS C
H A 0056 ALA C 3.667 H A 0057 LYS CB
H A 0057 LYS C 2.486 H A 0058 SER CA
H A 0057 LYS C 3.540 H A 0058 SER C
H A 0057 LYS C 3.479 H A 0058 SER CB
H A 0058 SER C 2.490 C A 0059 LEU CA
H A 0058 SER C 3.396 C A 0059 LEU C
H A 0058 SER C 3.570 C A 0059 LEU CB
H A 0058 SER C 3.716 C A 0059 LEU CG
H A 0058 SER C 3.730 C A 0059 LEU CD2
C A 0059 LEU C 2.425 C A 0060 SER CA
C A 0059 LEU C 3.034 C A 0060 SER C
C A 0059 LEU C 3.625 C A 0060 SER CB
C A 0060 SER C 2.443 C A 0061 HIS CA
C A 0060 SER C 3.637 C A 0061 HIS C
C A 0060 SER C 3.388 C A 0061 HIS CB
C A 0060 SER C 3.642 C A 0061 HIS CG
C A 0061 HIS C 2.460 C A 0062 LYS CA
C A 0061 HIS C 3.473 C A 0062 LYS C
C A 0061 HIS C 3.547 C A 0062 LYS CB
C A 0061 HIS C 3.672 C A 0062 LYS CG
C A 0062 LYS C 2.438 C A 0063 GLN CA
C A 0062 LYS C 3.518 C A 0063 GLN C
C A 0062 LYS C 3.379 C A 0063 GLN CB
C A 0062 LYS CD 3.742 C A 0090 GLU CD
C A 0062 LYS CE 3.410 C A 0090 GLU CD
C A 0063 GLN C 2.479 C A 0064 LEU CA
C A 0063 GLN C 2.946 C A 0064 LEU C
C A 0063 GLN C 3.393 C A 0064 LEU CB
C A 0063 GLN CD 3.619 C A 0072 THR CB
C A 0064 LEU C 2.461 C A 0065 LEU CA
C A 0064 LEU C 2.969 C A 0065 LEU C
C A 0064 LEU C 3.716 C A 0065 LEU CB
C A 0065 LEU C 2.472 C A 0066 MET CA
C A 0065 LEU C 3.613 C A 0066 MET C
C A 0065 LEU C 3.436 C A 0066 MET CB
C A 0065 LEU CA 3.581 C A 0070 GLN CD
C A 0066 MET C 2.434 C A 0067 SER CA
C A 0066 MET C 3.368 C A 0067 SER C
C A 0066 MET C 3.622 C A 0067 SER CB
C A 0067 SER CA 2.932 C A 0068 PRO CD
C A 0067 SER C 2.492 C A 0068 PRO CA
C A 0067 SER C 3.134 C A 0068 PRO C
C A 0067 SER C 3.667 C A 0068 PRO CB
C A 0067 SER C 3.568 C A 0068 PRO CG
C A 0067 SER C 2.495 C A 0068 PRO CD
C A 0067 SER CB 3.752 C A 0068 PRO CD
C A 0068 PRO C 2.468 C A 0069 GLY CA
C A 0068 PRO C 3.566 C A 0069 GLY C
C A 0069 GLY CA 3.791 C A 0070 GLN CA
C A 0069 GLY C 2.469 C A 0070 GLN CA
C A 0069 GLY C 3.448 C A 0070 GLN C
C A 0069 GLY C 3.510 C A 0070 GLN CB
C A 0070 GLN C 2.490 C A 0071 SER CA
C A 0070 GLN C 3.508 C A 0071 SER C
C A 0070 GLN C 3.550 C A 0071 SER CB
C A 0071 SER C 2.450 C A 0072 THR CA
C A 0071 SER C 3.603 C A 0072 THR C
C A 0071 SER C 3.448 C A 0072 THR CB
C A 0072 THR C 2.475 C A 0073 SER CA
C A 0072 THR C 3.009 C A 0073 SER C
C A 0072 THR C 3.731 C A 0073 SER CB
C A 0073 SER C 2.483 C A 0074 THR CA
C A 0073 SER C 3.583 C A 0074 THR C
C A 0073 SER C 3.511 C A 0074 THR CB
C A 0074 THR C 2.485 C A 0075 THR CA
C A 0074 THR C 3.577 C A 0075 THR C
C A 0074 THR C 3.580 C A 0075 THR CB
C A 0075 THR C 2.463 C A 0076 PHE CA
C A 0075 THR C 3.485 C A 0076 PHE C
C A 0075 THR C 3.522 C A 0076 PHE CB
C A 0075 THR C 3.616 C A 0076 PHE CG
C A 0076 PHE CA 2.981 C A 0077 PRO CD
C A 0076 PHE C 2.451 C A 0077 PRO CA
C A 0076 PHE C 3.167 C A 0077 PRO C
C A 0076 PHE C 3.600 C A 0077 PRO CB
C A 0076 PHE C 3.629 C A 0077 PRO CG
C A 0076 PHE C 2.511 C A 0077 PRO CD
C A 0076 PHE CB 3.448 C A 0077 PRO CD
C A 0076 PHE CD2 3.721 E A 0101 ILE CD1
C A 0076 PHE CE2 3.498 E A 0101 ILE CD1
C A 0077 PRO C 2.453 C A 0078 ALA CA
C A 0077 PRO C 3.493 C A 0078 ALA C
C A 0077 PRO C 3.529 C A 0078 ALA CB
C A 0078 ALA C 2.451 C A 0079 ASP CA
C A 0078 ALA C 3.438 C A 0079 ASP C
C A 0078 ALA C 3.470 C A 0079 ASP CB
C A 0079 ASP C 2.508 H A 0080 ALA CA
C A 0079 ASP C 2.968 H A 0080 ALA C
C A 0079 ASP C 3.415 H A 0080 ALA CB
C A 0079 ASP C 3.464 H A 0081 PRO CD
H A 0080 ALA CA 2.876 H A 0081 PRO CD
H A 0080 ALA C 2.490 H A 0081 PRO CA
H A 0080 ALA C 2.984 H A 0081 PRO C
H A 0080 ALA C 3.475 H A 0081 PRO CB
H A 0080 ALA C 3.625 H A 0081 PRO CG
H A 0080 ALA C 2.481 H A 0081 PRO CD
H A 0080 ALA C 3.744 C A 0085 TYR CZ
H A 0080 ALA CB 3.771 C A 0103 VAL CG1
H A 0080 ALA CB 3.762 C A 0103 VAL CG2
H A 0081 PRO C 2.510 H A 0082 ALA CA
H A 0081 PRO C 3.072 H A 0082 ALA C
H A 0081 PRO C 3.461 H A 0082 ALA CB
H A 0082 ALA C 2.465 C A 0083 GLY CA
H A 0082 ALA C 3.631 C A 0083 GLY C
H A 0082 ALA CA 3.619 C A 0103 VAL C
C A 0083 GLY C 2.472 C A 0084 GLU CA
C A 0083 GLY C 3.229 C A 0084 GLU C
C A 0083 GLY C 3.707 C A 0084 GLU CB
C A 0083 GLY C 3.790 C A 0085 TYR CD2
C A 0083 GLY C 3.769 E A 0102 THR CG2
C A 0084 GLU C 2.443 C A 0085 TYR CA
C A 0084 GLU C 3.143 C A 0085 TYR C
C A 0084 GLU C 3.660 C A 0085 TYR CB
C A 0084 GLU CD 3.393 E A 0102 THR CG2
C A 0085 TYR C 2.465 C A 0086 THR CA
C A 0085 TYR C 3.738 C A 0086 THR C
C A 0085 TYR C 3.272 C A 0086 THR CB
C A 0086 THR CA 3.799 E A 0087 PHE CA
C A 0086 THR C 2.432 E A 0087 PHE CA
C A 0086 THR C 3.426 E A 0087 PHE C
C A 0086 THR C 3.569 E A 0087 PHE CB
C A 0086 THR C 3.762 E A 0087 PHE CG
C A 0086 THR C 3.651 E A 0087 PHE CD1
C A 0086 THR CG2 3.514 C A 0098 VAL CG1
E A 0087 PHE C 2.435 E A 0088 TYR CA
E A 0087 PHE C 3.539 E A 0088 TYR C
E A 0087 PHE C 3.433 E A 0088 TYR CB
E A 0087 PHE C 3.765 E A 0088 TYR CD1
E A 0087 PHE CD2 3.533 C A 0099 GLY CA
E A 0087 PHE CD2 3.360 C A 0099 GLY C
E A 0087 PHE CE2 3.425 C A 0099 GLY CA
E A 0087 PHE CE2 3.070 C A 0099 GLY C
E A 0087 PHE CZ 3.480 C A 0099 GLY C
E A 0087 PHE CZ 3.517 E A 0100 LYS CA
E A 0087 PHE CZ 3.305 E A 0100 LYS C
E A 0087 PHE CE1 3.578 E A 0101 ILE CB
E A 0087 PHE CZ 3.601 E A 0101 ILE CB
E A 0088 TYR C 2.452 E A 0089 CYS CA
E A 0088 TYR C 3.301 E A 0089 CYS C
E A 0088 TYR C 3.622 E A 0089 CYS CB
E A 0089 CYS C 2.491 C A 0090 GLU CA
E A 0089 CYS C 3.089 C A 0090 GLU C
E A 0089 CYS C 3.554 C A 0090 GLU CB
E A 0089 CYS C 3.456 C A 0091 PRO CD
E A 0089 CYS CB 3.348 C A 0097 MET CB
C A 0090 GLU CA 3.023 C A 0091 PRO CD
C A 0090 GLU C 2.491 C A 0091 PRO CA
C A 0090 GLU C 3.332 C A 0091 PRO C
C A 0090 GLU C 3.584 C A 0091 PRO CB
C A 0090 GLU C 3.662 C A 0091 PRO CG
C A 0090 GLU C 2.518 C A 0091 PRO CD
C A 0090 GLU CB 3.012 C A 0091 PRO CD
C A 0091 PRO C 2.448 C A 0092 HIS CA
C A 0091 PRO C 3.520 C A 0092 HIS C
C A 0091 PRO C 3.455 C A 0092 HIS CB
C A 0091 PRO C 3.512 C A 0092 HIS CG
C A 0091 PRO C 3.345 C A 0092 HIS CD2
C A 0092 HIS C 2.434 C A 0093 ARG CA
C A 0092 HIS C 3.290 C A 0093 ARG C
C A 0092 HIS C 3.582 C A 0093 ARG CB
C A 0092 HIS C 3.793 C A 0093 ARG CG
C A 0092 HIS CB 3.705 C A 0097 MET CG
C A 0093 ARG C 2.449 C A 0094 GLY CA
C A 0093 ARG C 3.188 C A 0094 GLY C
C A 0094 GLY C 2.455 C A 0095 ALA CA
C A 0094 GLY C 3.216 C A 0095 ALA C
C A 0094 GLY C 3.635 C A 0095 ALA CB
C A 0095 ALA C 2.529 C A 0096 GLY CA
C A 0095 ALA C 3.136 C A 0096 GLY C
C A 0096 GLY C 2.429 C A 0097 MET CA
C A 0096 GLY C 3.270 C A 0097 MET C
C A 0096 GLY C 3.660 C A 0097 MET CB
C A 0097 MET C 2.468 C A 0098 VAL CA
C A 0097 MET C 3.635 C A 0098 VAL C
C A 0097 MET C 3.454 C A 0098 VAL CB
C A 0097 MET C 3.409 C A 0098 VAL CG2
C A 0098 VAL C 2.474 C A 0099 GLY CA
C A 0098 VAL C 3.671 C A 0099 GLY C
C A 0099 GLY C 2.476 E A 0100 LYS CA
C A 0099 GLY C 3.668 E A 0100 LYS C
C A 0099 GLY C 3.470 E A 0100 LYS CB
C A 0099 GLY C 3.643 E A 0100 LYS CG
E A 0100 LYS C 2.455 E A 0101 ILE CA
E A 0100 LYS C 3.419 E A 0101 ILE C
E A 0100 LYS C 3.655 E A 0101 ILE CB
E A 0101 ILE C 2.449 E A 0102 THR CA
E A 0101 ILE C 3.314 E A 0102 THR C
E A 0101 ILE C 3.638 E A 0102 THR CB
E A 0101 ILE CG2 3.573 C A 0103 VAL CG2
E A 0102 THR C 2.417 C A 0103 VAL CA
E A 0102 THR C 3.205 C A 0103 VAL C
E A 0102 THR C 3.634 C A 0103 VAL CB
C A 0103 VAL C 2.464 C A 0104 ALA CA
C A 0103 VAL C 3.535 C A 0104 ALA C
C A 0103 VAL C 3.503 C A 0104 ALA CB
C A 0104 ALA C 2.482 C A 0105 GLY CA
C A 0104 ALA C 3.683 C A 0105 GLY C
CHARGE_ATTR 2.00 12.00 54
C A 0001 GLU OE1 2.518 C A 0024 LYS NZ
C A 0001 GLU OE2 2.631 C A 0024 LYS NZ
C A 0010 ASP OD1 11.67 E A 0006 LYS NZ
C A 0010 ASP OD1 3.963 C A 0011 LYS NZ
C A 0010 ASP OD2 2.448 C A 0011 LYS NZ
C A 0010 ASP OD1 5.325 C A 0035 LYS NZ
C A 0010 ASP OD2 7.130 C A 0035 LYS NZ
C A 0017 GLU OE1 2.596 E A 0006 LYS NZ
C A 0017 GLU OE2 2.621 E A 0006 LYS NZ
C A 0017 GLU OE2 10.52 C A 0035 LYS NZ
C A 0027 ASP OD1 4.682 C A 0024 LYS NZ
C A 0027 ASP OD2 2.891 C A 0024 LYS NZ
E A 0030 GLU OE1 7.382 E A 0006 LYS NZ
E A 0030 GLU OE2 9.438 E A 0006 LYS NZ
E A 0030 GLU OE1 11.31 C A 0061 HIS ND1
E A 0030 GLU OE1 9.304 C A 0061 HIS NE2
E A 0030 GLU OE2 9.888 C A 0061 HIS ND1
E A 0030 GLU OE2 8.021 C A 0061 HIS NE2
C A 0044 ASP OD1 5.707 C A 0051 LYS NZ
C A 0044 ASP OD2 7.452 C A 0051 LYS NZ
C A 0044 ASP OD1 10.08 H A 0057 LYS NZ
C A 0044 ASP OD2 11.48 H A 0057 LYS NZ
C A 0044 ASP OD1 10.92 C A 0061 HIS ND1
C A 0044 ASP OD1 11.99 C A 0061 HIS NE2
C A 0044 ASP OD2 10.12 C A 0061 HIS ND1
C A 0044 ASP OD2 10.86 C A 0061 HIS NE2
C A 0044 ASP OD1 7.947 E A 0100 LYS NZ
C A 0044 ASP OD2 6.409 E A 0100 LYS NZ
C A 0054 ASP OD1 7.973 C A 0051 LYS NZ
C A 0054 ASP OD2 7.288 C A 0051 LYS NZ
C A 0054 ASP OD1 7.282 H A 0057 LYS NZ
C A 0054 ASP OD2 7.793 H A 0057 LYS NZ
C A 0084 GLU OE1 2.803 E A 0020 LYS NZ
C A 0084 GLU OE2 2.486 E A 0020 LYS NZ
C A 0084 GLU OE1 5.202 E A 0100 LYS NZ
C A 0084 GLU OE2 6.780 E A 0100 LYS NZ
C A 0090 GLU OE1 9.988 C A 0039 HIS ND1
C A 0090 GLU OE1 11.46 C A 0039 HIS NE2
C A 0090 GLU OE2 11.60 C A 0039 HIS ND1
C A 0090 GLU OE2 11.77 H A 0057 LYS NZ
C A 0090 GLU OE1 11.13 C A 0061 HIS ND1
C A 0090 GLU OE1 11.43 C A 0061 HIS NE2
C A 0090 GLU OE2 11.33 C A 0061 HIS ND1
C A 0090 GLU OE2 11.93 C A 0061 HIS NE2
C A 0090 GLU OE1 2.735 C A 0062 LYS NZ
C A 0090 GLU OE2 2.482 C A 0062 LYS NZ
C A 0090 GLU OE1 9.295 C A 0092 HIS ND1
C A 0090 GLU OE1 9.717 C A 0092 HIS NE2
C A 0090 GLU OE2 10.78 C A 0092 HIS ND1
C A 0090 GLU OE2 11.31 C A 0092 HIS NE2
C A 0090 GLU OE1 7.752 C A 0093 ARG NH1
C A 0090 GLU OE1 9.766 C A 0093 ARG NH2
C A 0090 GLU OE2 7.426 C A 0093 ARG NH1
C A 0090 GLU OE2 9.201 C A 0093 ARG NH2
CHARGE_REPU 2.00 12.00 44
C A 0001 GLU OE1 4.060 C A 0027 ASP OD1
C A 0001 GLU OE1 3.117 C A 0027 ASP OD2
C A 0001 GLU OE2 5.534 C A 0027 ASP OD1
C A 0001 GLU OE2 4.542 C A 0027 ASP OD2
E A 0006 LYS NZ 10.96 C A 0035 LYS NZ
C A 0010 ASP OD1 11.72 C A 0017 GLU OE1
C A 0010 ASP OD1 10.14 C A 0017 GLU OE2
C A 0010 ASP OD2 10.41 C A 0017 GLU OE2
C A 0011 LYS NZ 8.217 C A 0035 LYS NZ
C A 0017 GLU OE1 9.662 E A 0030 GLU OE1
C A 0017 GLU OE1 11.66 E A 0030 GLU OE2
C A 0017 GLU OE2 9.928 E A 0030 GLU OE1
E A 0020 LYS NZ 7.807 E A 0100 LYS NZ
C A 0027 ASP OD1 11.93 E A 0030 GLU OE1
C A 0035 LYS NZ 10.91 C A 0039 HIS ND1
C A 0035 LYS NZ 9.338 C A 0039 HIS NE2
C A 0039 HIS ND1 11.94 C A 0061 HIS NE2
C A 0039 HIS ND1 2.857 C A 0092 HIS ND1
C A 0039 HIS ND1 4.471 C A 0092 HIS NE2
C A 0039 HIS NE2 4.289 C A 0092 HIS ND1
C A 0039 HIS NE2 5.173 C A 0092 HIS NE2
C A 0039 HIS ND1 11.55 C A 0093 ARG NH1
C A 0044 ASP OD1 8.682 C A 0054 ASP OD1
C A 0044 ASP OD1 9.216 C A 0054 ASP OD2
C A 0044 ASP OD2 10.70 C A 0054 ASP OD1
C A 0044 ASP OD2 11.35 C A 0054 ASP OD2
C A 0044 ASP OD1 11.58 C A 0079 ASP OD2
C A 0044 ASP OD1 11.29 C A 0084 GLU OE1
C A 0044 ASP OD2 9.541 C A 0084 GLU OE1
C A 0044 ASP OD2 11.35 C A 0084 GLU OE2
C A 0051 LYS NZ 11.86 H A 0057 LYS NZ
C A 0051 LYS NZ 10.59 E A 0100 LYS NZ
C A 0054 ASP OD1 11.46 C A 0079 ASP OD1
C A 0054 ASP OD1 9.924 C A 0079 ASP OD2
H A 0057 LYS NZ 10.99 C A 0061 HIS ND1
H A 0057 LYS NZ 11.55 C A 0062 LYS NZ
C A 0061 HIS ND1 11.54 C A 0062 LYS NZ
C A 0062 LYS NZ 11.99 C A 0092 HIS ND1
C A 0062 LYS NZ 9.375 C A 0093 ARG NH1
C A 0062 LYS NZ 11.11 C A 0093 ARG NH2
C A 0092 HIS ND1 9.268 C A 0093 ARG NH1
C A 0092 HIS ND1 11.08 C A 0093 ARG NH2
C A 0092 HIS NE2 9.309 C A 0093 ARG NH1
C A 0092 HIS NE2 11.01 C A 0093 ARG NH2
HB_MM 2.00 3.20 171
C A 0002 THR N 2.193 C A 0001 GLU O
C A 0002 THR N 2.740 C A 0028 THR O
E A 0003 TYR N 2.488 C A 0001 GLU O
E A 0003 TYR N 2.204 C A 0002 THR O
E A 0004 THR N 2.201 E A 0003 TYR O
E A 0005 VAL N 2.232 E A 0004 THR O
E A 0005 VAL N 2.761 E A 0030 GLU O
E A 0006 LYS N 2.203 E A 0005 VAL O
E A 0006 LYS N 2.802 C A 0017 GLU O
E A 0007 LEU N 2.230 E A 0006 LYS O
E A 0007 LEU N 2.825 E A 0032 LEU O
C A 0008 GLY N 3.123 E A 0006 LYS O
C A 0008 GLY N 2.232 E A 0007 LEU O
C A 0008 GLY N 2.771 C A 0015 VAL O
C A 0009 SER N 2.199 C A 0008 GLY O
C A 0009 SER N 2.710 C A 0013 LEU O
C A 0010 ASP N 2.197 C A 0009 SER O
C A 0011 LYS N 2.178 C A 0010 ASP O
C A 0012 GLY N 2.220 C A 0011 LYS O
C A 0013 LEU N 2.213 C A 0012 GLY O
C A 0014 LEU N 3.194 C A 0012 GLY O
C A 0014 LEU N 2.201 C A 0013 LEU O
C A 0015 VAL N 2.196 C A 0014 LEU O
C A 0016 PHE N 2.219 C A 0015 VAL O
C A 0017 GLU N 3.154 E A 0006 LYS O
C A 0017 GLU N 2.207 C A 0016 PHE O
C A 0018 PRO N 2.209 C A 0017 GLU O
C A 0019 ALA N 3.034 C A 0016 PHE O
C A 0019 ALA N 2.211 C A 0018 PRO O
E A 0020 LYS N 2.199 C A 0019 ALA O
E A 0021 LEU N 2.204 E A 0020 LYS O
E A 0021 LEU N 2.795 E A 0100 LYS O
E A 0022 THR N 2.179 E A 0021 LEU O
C A 0023 ILE N 2.215 E A 0022 THR O
C A 0023 ILE N 2.899 E A 0102 THR O
C A 0024 LYS N 2.221 C A 0023 ILE O
C A 0025 PRO N 2.205 C A 0024 LYS O
C A 0025 PRO N 3.116 C A 0104 ALA O
C A 0026 GLY N 2.699 C A 0024 LYS O
C A 0026 GLY N 2.204 C A 0025 PRO O
C A 0027 ASP N 2.221 C A 0026 GLY O
C A 0028 THR N 2.212 C A 0027 ASP O
E A 0029 VAL N 2.189 C A 0028 THR O
E A 0029 VAL N 2.764 C A 0074 THR O
E A 0030 GLU N 2.737 E A 0003 TYR O
E A 0030 GLU N 2.190 E A 0029 VAL O
E A 0031 PHE N 2.207 E A 0030 GLU O
E A 0032 LEU N 2.972 E A 0005 VAL O
E A 0032 LEU N 2.224 E A 0031 PHE O
E A 0033 ASN N 2.177 E A 0032 LEU O
E A 0033 ASN N 2.998 C A 0070 GLN O
C A 0034 ASN N 2.836 E A 0007 LEU O
C A 0034 ASN N 2.186 E A 0033 ASN O
C A 0035 LYS N 2.866 E A 0007 LEU O
C A 0035 LYS N 2.202 C A 0034 ASN O
C A 0036 VAL N 2.227 C A 0035 LYS O
C A 0037 PRO N 2.221 C A 0036 VAL O
C A 0038 PRO N 2.210 C A 0037 PRO O
C A 0039 HIS N 2.187 C A 0038 PRO O
C A 0039 HIS N 2.898 C A 0065 LEU O
C A 0040 ASN N 2.198 C A 0039 HIS O
E A 0041 VAL N 2.200 C A 0040 ASN O
E A 0041 VAL N 2.937 C A 0061 HIS O
E A 0042 VAL N 2.210 E A 0041 VAL O
E A 0042 VAL N 3.024 E A 0088 TYR O
E A 0043 PHE N 2.205 E A 0042 VAL O
C A 0044 ASP N 2.232 E A 0043 PHE O
C A 0044 ASP N 2.644 C A 0086 THR O
C A 0045 ALA N 2.514 E A 0043 PHE O
C A 0045 ALA N 2.183 C A 0044 ASP O
C A 0046 ALA N 2.661 C A 0044 ASP O
C A 0046 ALA N 2.207 C A 0045 ALA O
C A 0047 LEU N 2.201 C A 0046 ALA O
C A 0048 ASN N 2.200 C A 0047 LEU O
C A 0049 PRO N 2.226 C A 0048 ASN O
C A 0050 ALA N 3.029 C A 0048 ASN O
C A 0050 ALA N 2.202 C A 0049 PRO O
C A 0051 LYS N 2.835 C A 0048 ASN O
C A 0051 LYS N 2.223 C A 0050 ALA O
C A 0052 SER N 2.560 C A 0050 ALA O
C A 0052 SER N 2.195 C A 0051 LYS O
C A 0053 ALA N 2.214 C A 0052 SER O
C A 0054 ASP N 2.239 C A 0053 ALA O
C A 0055 LEU N 3.007 C A 0053 ALA O
C A 0055 LEU N 2.229 C A 0054 ASP O
H A 0056 ALA N 2.953 C A 0053 ALA O
H A 0056 ALA N 2.201 C A 0055 LEU O
H A 0057 LYS N 2.958 C A 0053 ALA O
H A 0057 LYS N 2.964 C A 0055 LEU O
H A 0057 LYS N 2.196 H A 0056 ALA O
H A 0058 SER N 2.631 C A 0055 LEU O
H A 0058 SER N 2.977 H A 0056 ALA O
H A 0058 SER N 2.196 H A 0057 LYS O
C A 0059 LEU N 3.167 H A 0056 ALA O
C A 0059 LEU N 2.231 H A 0058 SER O
C A 0060 SER N 3.085 H A 0056 ALA O
C A 0060 SER N 2.205 C A 0059 LEU O
C A 0061 HIS N 2.912 E A 0041 VAL O
C A 0061 HIS N 2.207 C A 0060 SER O
C A 0062 LYS N 2.203 C A 0061 HIS O
C A 0063 GLN N 2.205 C A 0062 LYS O
C A 0064 LEU N 2.221 C A 0063 GLN O
C A 0065 LEU N 2.953 C A 0039 HIS O
C A 0065 LEU N 2.834 C A 0063 GLN O
C A 0065 LEU N 2.216 C A 0064 LEU O
C A 0066 MET N 2.482 C A 0064 LEU O
C A 0066 MET N 2.224 C A 0065 LEU O
C A 0067 SER N 2.205 C A 0066 MET O
C A 0068 PRO N 2.215 C A 0067 SER O
C A 0069 GLY N 2.647 C A 0067 SER O
C A 0069 GLY N 2.210 C A 0068 PRO O
C A 0070 GLN N 2.214 C A 0069 GLY O
C A 0071 SER N 2.229 C A 0070 GLN O
C A 0072 THR N 3.004 E A 0031 PHE O
C A 0072 THR N 2.200 C A 0071 SER O
C A 0073 SER N 2.186 C A 0072 THR O
C A 0074 THR N 2.736 E A 0029 VAL O
C A 0074 THR N 2.844 C A 0072 THR O
C A 0074 THR N 2.205 C A 0073 SER O
C A 0075 THR N 2.206 C A 0074 THR O
C A 0076 PHE N 2.974 C A 0027 ASP O
C A 0076 PHE N 2.215 C A 0075 THR O
C A 0077 PRO N 2.205 C A 0076 PHE O
C A 0078 ALA N 2.208 C A 0077 PRO O
C A 0079 ASP N 2.211 C A 0078 ALA O
H A 0080 ALA N 2.238 C A 0079 ASP O
H A 0081 PRO N 2.690 C A 0079 ASP O
H A 0081 PRO N 2.228 H A 0080 ALA O
H A 0082 ALA N 2.610 H A 0080 ALA O
H A 0082 ALA N 2.243 H A 0081 PRO O
C A 0083 GLY N 2.525 H A 0081 PRO O
C A 0083 GLY N 2.203 H A 0082 ALA O
C A 0084 GLU N 2.227 C A 0083 GLY O
C A 0085 TYR N 3.069 C A 0083 GLY O
C A 0085 TYR N 2.199 C A 0084 GLU O
C A 0085 TYR N 2.796 E A 0101 ILE O
C A 0086 THR N 2.191 C A 0085 TYR O
E A 0087 PHE N 2.206 C A 0086 THR O
E A 0087 PHE N 2.769 C A 0099 GLY O
E A 0088 TYR N 2.879 E A 0042 VAL O
E A 0088 TYR N 2.205 E A 0087 PHE O
E A 0089 CYS N 2.222 E A 0088 TYR O
E A 0089 CYS N 2.920 C A 0097 MET O
C A 0090 GLU N 3.051 C A 0040 ASN O
C A 0090 GLU N 3.092 E A 0088 TYR O
C A 0090 GLU N 2.203 E A 0089 CYS O
C A 0091 PRO N 2.851 E A 0089 CYS O
C A 0091 PRO N 2.209 C A 0090 GLU O
C A 0092 HIS N 2.795 E A 0089 CYS O
C A 0092 HIS N 2.198 C A 0091 PRO O
C A 0093 ARG N 2.206 C A 0092 HIS O
C A 0094 GLY N 2.193 C A 0093 ARG O
C A 0095 ALA N 2.832 C A 0093 ARG O
C A 0095 ALA N 2.210 C A 0094 GLY O
C A 0096 GLY N 2.832 C A 0094 GLY O
C A 0096 GLY N 2.224 C A 0095 ALA O
C A 0097 MET N 2.566 C A 0095 ALA O
C A 0097 MET N 2.201 C A 0096 GLY O
C A 0098 VAL N 2.939 C A 0096 GLY O
C A 0098 VAL N 2.229 C A 0097 MET O
C A 0099 GLY N 2.822 E A 0087 PHE O
C A 0099 GLY N 2.210 C A 0098 VAL O
E A 0100 LYS N 2.766 C A 0019 ALA O
E A 0100 LYS N 2.195 C A 0099 GLY O
E A 0101 ILE N 2.214 E A 0100 LYS O
E A 0102 THR N 2.744 E A 0021 LEU O
E A 0102 THR N 2.195 E A 0101 ILE O
C A 0103 VAL N 2.204 E A 0102 THR O
C A 0104 ALA N 2.861 E A 0102 THR O
C A 0104 ALA N 2.212 C A 0103 VAL O
C A 0105 GLY N 2.218 C A 0104 ALA O
HB_MS 2.00 3.20 49
C A 0001 GLU N 2.929 E A 0003 TYR OH
C A 0001 GLU N 2.435 C A 0027 ASP OD1
C A 0001 GLU N 2.754 C A 0027 ASP OD2
E A 0004 THR O 2.858 E A 0006 LYS NZ
E A 0005 VAL N 3.171 E A 0004 THR OG1
C A 0008 GLY O 2.656 C A 0034 ASN ND2
C A 0009 SER O 2.733 C A 0034 ASN ND2
C A 0010 ASP O 2.551 C A 0035 LYS NZ
C A 0011 LYS N 2.632 C A 0010 ASP OD1
C A 0017 GLU O 2.510 E A 0006 LYS NZ
C A 0018 PRO N 2.975 C A 0017 GLU OE1
C A 0028 THR N 2.613 C A 0027 ASP OD1
E A 0029 VAL O 2.977 C A 0002 THR OG1
E A 0031 PHE N 2.641 E A 0030 GLU OE2
C A 0035 LYS O 2.748 C A 0039 HIS NE2
C A 0036 VAL O 2.856 C A 0039 HIS NE2
C A 0037 PRO O 2.892 C A 0092 HIS NE2
E A 0043 PHE N 3.045 C A 0060 SER OG
E A 0043 PHE O 2.749 E A 0088 TYR OH
C A 0044 ASP O 2.720 C A 0048 ASN ND2
C A 0045 ALA O 2.731 C A 0051 LYS NZ
C A 0052 SER N 2.807 C A 0048 ASN OD1
C A 0052 SER O 2.839 C A 0048 ASN ND2
C A 0052 SER O 2.756 C A 0051 LYS NZ
C A 0053 ALA N 2.936 C A 0052 SER OG
C A 0053 ALA N 2.897 C A 0054 ASP OD2
C A 0054 ASP O 2.798 H A 0057 LYS NZ
C A 0054 ASP O 3.169 H A 0058 SER OG
C A 0055 LEU N 2.755 C A 0054 ASP OD1
C A 0059 LEU O 2.908 C A 0061 HIS ND1
C A 0063 GLN N 3.054 C A 0040 ASN OD1
C A 0063 GLN O 2.876 C A 0070 GLN NE2
C A 0064 LEU N 2.677 C A 0040 ASN OD1
C A 0066 MET N 3.005 C A 0070 GLN OE1
C A 0067 SER O 2.701 E A 0033 ASN ND2
C A 0068 PRO N 3.130 C A 0067 SER OG
C A 0069 GLY N 2.878 E A 0033 ASN OD1
C A 0070 GLN N 2.717 E A 0033 ASN OD1
C A 0072 THR N 2.599 E A 0030 GLU OE2
C A 0072 THR O 2.798 C A 0074 THR OG1
H A 0080 ALA N 3.037 C A 0079 ASP OD1
H A 0080 ALA N 2.853 C A 0079 ASP OD2
H A 0080 ALA O 2.709 C A 0085 TYR OH
H A 0081 PRO N 3.005 C A 0085 TYR OH
C A 0084 GLU O 2.474 E A 0100 LYS NZ
C A 0085 TYR O 2.713 C A 0086 THR OG1
C A 0085 TYR O 2.710 E A 0100 LYS NZ
C A 0086 THR N 2.806 C A 0044 ASP OD2
C A 0090 GLU O 2.728 C A 0093 ARG NH1
HB_SS 2.00 3.20 16
C A 0001 GLU OE2 2.561 E A 0003 TYR OH
E A 0020 LYS NZ 2.814 E A 0022 THR OG1
E A 0020 LYS NZ 2.634 E A 0102 THR OG1
C A 0024 LYS NZ 2.802 E A 0003 TYR OH
E A 0030 GLU OE1 2.833 E A 0004 THR OG1
C A 0035 LYS NZ 2.689 C A 0034 ASN OD1
C A 0044 ASP OD1 2.824 C A 0048 ASN ND2
C A 0051 LYS NZ 2.509 C A 0048 ASN OD1
C A 0054 ASP OD1 2.837 C A 0052 SER OG
H A 0057 LYS NZ 2.426 H A 0058 SER OG
C A 0063 GLN NE2 2.824 C A 0072 THR OG1
C A 0070 GLN NE2 3.122 C A 0063 GLN OE1
C A 0084 GLU OE1 2.791 E A 0102 THR OG1
C A 0084 GLU OE2 2.897 E A 0102 THR OG1
C A 0090 GLU OE1 2.866 C A 0040 ASN ND2
E A 0100 LYS NZ 2.589 C A 0086 THR OG1
AROMATIC 0.00 8.00 2
E A 0031 PHE 4.288 C A 0061 HIS
C A 0024 LYS 5.253 E A 0003 TYR