Complet list of 1whe con file
Complete list of 1whe.con file
COMMENT BEGIN
#########################################################################
COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 302
C A 0001 ALA C 2.424 C A 0002 ASN CA
C A 0001 ALA C 2.895 C A 0002 ASN C
C A 0001 ALA C 3.039 C A 0002 ASN CB
C A 0002 ASN C 2.424 C A 0003 SER CA
C A 0002 ASN C 3.647 C A 0003 SER C
C A 0002 ASN C 3.203 C A 0003 SER CB
C A 0002 ASN CB 3.215 C A 0005 LEU CD2
C A 0002 ASN CG 3.659 C A 0005 LEU CD2
C A 0003 SER C 2.423 C A 0004 PHE CA
C A 0003 SER C 3.092 C A 0004 PHE C
C A 0003 SER C 3.682 C A 0004 PHE CB
C A 0004 PHE C 2.422 C A 0005 LEU CA
C A 0004 PHE C 2.961 C A 0005 LEU C
C A 0004 PHE C 3.712 C A 0005 LEU CB
C A 0004 PHE C 3.593 C A 0008 VAL CG1
C A 0004 PHE CD1 3.599 H A 0021 ALA CB
C A 0004 PHE CE1 3.588 H A 0021 ALA CB
C A 0005 LEU CA 3.431 C A 0008 VAL CG2
C A 0005 LEU C 3.752 C A 0008 VAL CG2
C A 0008 VAL C 2.420 C A 0009 LYS CA
C A 0008 VAL C 2.836 C A 0009 LYS C
C A 0008 VAL C 3.676 C A 0009 LYS CB
C A 0008 VAL CG2 3.524 C A 0010 GLN C
C A 0009 LYS C 2.423 C A 0010 GLN CA
C A 0009 LYS C 3.688 C A 0010 GLN C
C A 0009 LYS C 2.890 C A 0010 GLN CB
C A 0009 LYS C 3.509 C A 0010 GLN CG
C A 0010 GLN C 2.423 C A 0011 GLY CA
C A 0010 GLN C 3.009 C A 0011 GLY C
C A 0011 GLY C 2.426 C A 0012 ASN CA
C A 0011 GLY C 3.688 C A 0012 ASN C
C A 0011 GLY C 3.052 C A 0012 ASN CB
C A 0012 ASN C 2.415 H A 0013 LEU CA
C A 0012 ASN C 3.654 H A 0013 LEU C
C A 0012 ASN C 3.203 H A 0013 LEU CB
H A 0013 LEU CG 3.588 C A 0031 PHE CE1
H A 0013 LEU CD1 3.428 C A 0031 PHE CD1
H A 0013 LEU CD1 3.177 C A 0031 PHE CE1
H A 0013 LEU CD1 3.789 C A 0031 PHE CZ
H A 0017 CYS CA 3.796 H A 0018 LEU CA
H A 0017 CYS C 2.410 H A 0018 LEU CA
H A 0017 CYS C 3.331 H A 0018 LEU C
H A 0017 CYS C 3.561 H A 0018 LEU CB
H A 0017 CYS CA 3.454 H A 0022 CYS CB
H A 0017 CYS C 3.667 H A 0022 CYS C
H A 0017 CYS CB 3.440 H A 0027 ALA CB
H A 0021 ALA CA 3.783 H A 0022 CYS CA
H A 0021 ALA C 2.404 H A 0022 CYS CA
H A 0021 ALA C 3.612 H A 0022 CYS C
H A 0021 ALA C 3.190 H A 0022 CYS CB
H A 0022 CYS C 2.428 H A 0023 SER CA
H A 0022 CYS C 3.503 H A 0023 SER C
H A 0022 CYS C 3.429 H A 0023 SER CB
H A 0023 SER C 2.429 H A 0024 LEU CA
H A 0023 SER C 3.700 H A 0024 LEU C
H A 0023 SER C 2.994 H A 0024 LEU CB
H A 0023 SER C 3.141 H A 0024 LEU CG
H A 0023 SER C 3.215 H A 0024 LEU CD2
H A 0023 SER CB 3.622 H A 0024 LEU CD2
H A 0027 ALA C 2.422 H A 0028 ARG CA
H A 0027 ALA C 2.982 H A 0028 ARG C
H A 0027 ALA C 3.705 H A 0028 ARG CB
H A 0030 VAL C 2.422 C A 0031 PHE CA
H A 0030 VAL C 3.508 C A 0031 PHE C
H A 0030 VAL C 3.420 C A 0031 PHE CB
H A 0030 VAL C 3.315 C A 0031 PHE CD1
C A 0031 PHE CD2 3.462 H A 0036 GLN C
C A 0031 PHE CD2 3.722 H A 0036 GLN CB
C A 0031 PHE CD2 3.251 H A 0036 GLN CG
C A 0031 PHE CE2 3.694 H A 0036 GLN C
C A 0031 PHE CE2 3.410 H A 0036 GLN CG
C A 0031 PHE CE2 3.267 H A 0040 PHE CG
C A 0031 PHE CE2 3.695 H A 0040 PHE CD1
C A 0031 PHE CE2 3.146 H A 0040 PHE CD2
C A 0031 PHE CE2 3.479 H A 0040 PHE CE2
C A 0031 PHE CZ 3.575 H A 0040 PHE CG
C A 0031 PHE CZ 3.531 H A 0040 PHE CD1
C A 0031 PHE CZ 3.434 H A 0040 PHE CD2
C A 0031 PHE CZ 3.345 H A 0040 PHE CE1
C A 0031 PHE CZ 3.245 H A 0040 PHE CE2
C A 0031 PHE CZ 3.200 H A 0040 PHE CZ
C A 0033 ASP C 2.419 H A 0034 ALA CA
C A 0033 ASP C 3.096 H A 0034 ALA C
C A 0033 ASP C 3.672 H A 0034 ALA CB
C A 0033 ASP CB 2.950 H A 0036 GLN CB
H A 0036 GLN C 2.420 H A 0037 THR CA
H A 0036 GLN C 3.163 H A 0037 THR C
H A 0036 GLN C 3.656 H A 0037 THR CB
H A 0036 GLN C 3.659 H A 0040 PHE CB
H A 0037 THR C 2.440 H A 0038 ASP CA
H A 0037 THR C 2.990 H A 0038 ASP C
H A 0037 THR C 3.703 H A 0038 ASP CB
H A 0040 PHE C 2.408 H A 0041 TRP CA
H A 0040 PHE C 3.160 H A 0041 TRP C
H A 0040 PHE C 3.669 H A 0041 TRP CB
H A 0040 PHE C 3.580 H A 0041 TRP CE3
H A 0040 PHE CG 3.618 H A 0041 TRP CE3
H A 0040 PHE CD1 3.179 H A 0041 TRP CE3
H A 0040 PHE CD1 3.456 H A 0041 TRP CZ3
H A 0040 PHE CD2 3.683 H A 0041 TRP CA
H A 0040 PHE CD2 3.568 H A 0041 TRP CB
H A 0040 PHE CD2 3.682 H A 0041 TRP CE3
H A 0040 PHE CE1 3.583 H A 0041 TRP CD2
H A 0040 PHE CE1 2.756 H A 0041 TRP CE3
H A 0040 PHE CE1 2.761 H A 0041 TRP CZ3
H A 0040 PHE CE1 3.576 H A 0041 TRP CH2
H A 0040 PHE CE2 3.590 H A 0041 TRP CB
H A 0040 PHE CE2 3.399 H A 0041 TRP CG
H A 0040 PHE CE2 3.276 H A 0041 TRP CD2
H A 0040 PHE CE2 3.328 H A 0041 TRP CE3
H A 0040 PHE CZ 3.766 H A 0041 TRP CG
H A 0040 PHE CZ 3.081 H A 0041 TRP CD2
H A 0040 PHE CZ 3.591 H A 0041 TRP CE2
H A 0040 PHE CZ 2.843 H A 0041 TRP CE3
H A 0040 PHE CZ 3.193 H A 0041 TRP CZ3
H A 0040 PHE CZ 3.697 H A 0041 TRP CH2
H A 0040 PHE CA 3.700 C A 0065 ILE CG2
H A 0041 TRP C 2.443 C A 0042 SER CA
H A 0041 TRP C 2.785 C A 0042 SER C
H A 0041 TRP C 3.225 C A 0042 SER CB
H A 0041 TRP CE3 3.509 C A 0044 TYR CB
H A 0041 TRP CZ3 3.715 C A 0044 TYR CB
H A 0041 TRP CZ3 3.568 C A 0044 TYR CG
H A 0041 TRP CZ3 3.624 C A 0044 TYR CD2
H A 0041 TRP CH2 3.747 C A 0044 TYR CD2
C A 0042 SER C 2.426 C A 0043 LYS CA
C A 0042 SER C 3.104 C A 0043 LYS C
C A 0042 SER C 2.827 C A 0043 LYS CB
C A 0043 LYS C 2.463 C A 0044 TYR CA
C A 0043 LYS C 2.880 C A 0044 TYR C
C A 0043 LYS C 3.691 C A 0044 TYR CB
C A 0044 TYR CA 3.793 C A 0045 LYS CA
C A 0044 TYR C 2.415 C A 0045 LYS CA
C A 0044 TYR C 3.509 C A 0045 LYS C
C A 0044 TYR C 3.356 C A 0045 LYS CB
C A 0044 TYR CE1 3.685 C A 0065 ILE CG1
C A 0045 LYS C 2.457 C A 0046 ASP CA
C A 0045 LYS C 2.833 C A 0046 ASP C
C A 0045 LYS C 3.258 C A 0046 ASP CB
C A 0045 LYS C 3.200 C A 0046 ASP CG
C A 0046 ASP C 2.430 C A 0047 GLY CA
C A 0046 ASP C 3.386 C A 0047 GLY C
C A 0047 GLY C 2.423 C A 0048 ASP CA
C A 0047 GLY C 2.921 C A 0048 ASP C
C A 0047 GLY C 2.986 C A 0048 ASP CB
C A 0048 ASP C 2.455 C A 0049 GLN CA
C A 0048 ASP C 2.818 C A 0049 GLN C
C A 0048 ASP C 3.336 C A 0049 GLN CB
C A 0048 ASP CB 3.757 C A 0051 GLU CB
C A 0049 GLN C 2.451 C A 0050 CYS CA
C A 0049 GLN C 3.333 C A 0050 CYS C
C A 0049 GLN C 2.802 C A 0050 CYS CB
C A 0049 GLN CG 3.362 C A 0067 ASP C
C A 0049 GLN CA 3.034 E A 0068 TYR CD2
C A 0049 GLN CA 3.624 E A 0068 TYR CE2
C A 0049 GLN C 3.201 E A 0068 TYR CD2
C A 0049 GLN C 3.794 E A 0068 TYR CE2
C A 0049 GLN CB 3.425 E A 0068 TYR CB
C A 0049 GLN CB 3.781 E A 0068 TYR CG
C A 0049 GLN CB 3.436 E A 0068 TYR CD2
C A 0049 GLN CG 3.418 E A 0068 TYR CB
C A 0049 GLN CG 3.710 E A 0068 TYR CG
C A 0049 GLN CG 3.753 E A 0068 TYR CD2
C A 0050 CYS CA 3.798 C A 0051 GLU CA
C A 0050 CYS C 2.404 C A 0051 GLU CA
C A 0050 CYS C 2.947 C A 0051 GLU C
C A 0050 CYS C 3.665 C A 0051 GLU CB
C A 0050 CYS C 3.700 C A 0053 HIS CD2
C A 0051 GLU CA 3.778 C A 0052 GLY CA
C A 0051 GLU C 2.405 C A 0052 GLY CA
C A 0051 GLU C 3.159 C A 0052 GLY C
C A 0051 GLU CG 3.765 C A 0052 GLY CA
C A 0052 GLY C 2.437 C A 0053 HIS CA
C A 0052 GLY C 2.920 C A 0053 HIS C
C A 0052 GLY C 3.042 C A 0053 HIS CB
C A 0053 HIS CA 2.812 C A 0054 PRO CD
C A 0053 HIS C 2.441 C A 0054 PRO CA
C A 0053 HIS C 3.092 C A 0054 PRO C
C A 0053 HIS C 3.643 C A 0054 PRO CB
C A 0053 HIS C 3.663 C A 0054 PRO CG
C A 0053 HIS C 2.459 C A 0054 PRO CD
C A 0054 PRO C 2.422 C A 0055 CYS CA
C A 0054 PRO C 3.301 C A 0055 CYS C
C A 0054 PRO C 3.604 C A 0055 CYS CB
C A 0054 PRO CG 3.528 E A 0068 TYR CD2
C A 0054 PRO CG 3.669 E A 0068 TYR CE1
C A 0054 PRO CG 3.229 E A 0068 TYR CE2
C A 0054 PRO CG 3.318 E A 0068 TYR CZ
C A 0054 PRO CD 3.511 E A 0068 TYR CE2
C A 0055 CYS C 2.420 C A 0056 LEU CA
C A 0055 CYS C 3.349 C A 0056 LEU C
C A 0055 CYS C 3.523 C A 0056 LEU CB
C A 0055 CYS C 3.568 C A 0056 LEU CG
C A 0055 CYS C 3.453 C A 0056 LEU CD2
C A 0055 CYS CB 3.586 E A 0070 CYS CB
C A 0056 LEU C 2.430 C A 0057 ASN CA
C A 0056 LEU C 2.952 C A 0057 ASN C
C A 0056 LEU C 3.053 C A 0057 ASN CB
C A 0056 LEU C 3.692 C A 0057 ASN CG
C A 0056 LEU CG 3.558 C A 0080 ASN CB
C A 0056 LEU CD1 3.314 C A 0080 ASN CB
C A 0056 LEU CD1 3.367 C A 0082 GLU CB
C A 0056 LEU CD1 3.541 C A 0082 GLU CG
C A 0056 LEU CD1 3.663 C A 0082 GLU CD
C A 0057 ASN CA 3.796 C A 0058 GLN CA
C A 0057 ASN C 2.396 C A 0058 GLN CA
C A 0057 ASN C 3.028 C A 0058 GLN C
C A 0057 ASN C 2.787 C A 0058 GLN CB
C A 0057 ASN CB 3.116 E A 0076 PHE CD2
C A 0057 ASN CB 3.170 E A 0076 PHE CE2
C A 0057 ASN CG 3.300 E A 0076 PHE CD2
C A 0057 ASN CG 3.326 E A 0076 PHE CE2
C A 0058 GLN C 2.413 E A 0059 GLY CA
C A 0058 GLN C 2.950 E A 0059 GLY C
E A 0059 GLY C 2.427 E A 0060 HIS CA
E A 0059 GLY C 3.641 E A 0060 HIS C
E A 0059 GLY C 3.216 E A 0060 HIS CB
E A 0060 HIS C 2.417 E A 0061 CYS CA
E A 0060 HIS C 3.560 E A 0061 CYS C
E A 0060 HIS C 3.368 E A 0061 CYS CB
E A 0061 CYS C 2.420 E A 0062 LYS CA
E A 0061 CYS C 3.108 E A 0062 LYS C
E A 0061 CYS C 3.670 E A 0062 LYS CB
C A 0064 GLY C 2.438 C A 0065 ILE CA
C A 0064 GLY C 2.827 C A 0065 ILE C
C A 0064 GLY C 3.658 C A 0065 ILE CB
C A 0065 ILE C 2.427 C A 0066 GLY CA
C A 0065 ILE C 3.481 C A 0066 GLY C
C A 0066 GLY C 2.426 C A 0067 ASP CA
C A 0066 GLY C 3.657 C A 0067 ASP C
C A 0066 GLY C 3.161 C A 0067 ASP CB
C A 0066 GLY C 3.144 C A 0067 ASP CG
C A 0067 ASP C 2.410 E A 0068 TYR CA
C A 0067 ASP C 3.577 E A 0068 TYR C
C A 0067 ASP C 3.293 E A 0068 TYR CB
E A 0068 TYR C 2.425 E A 0069 THR CA
E A 0068 TYR C 3.625 E A 0069 THR C
E A 0068 TYR C 3.243 E A 0069 THR CB
E A 0068 TYR C 3.740 E A 0069 THR CG2
E A 0069 THR C 2.416 E A 0070 CYS CA
E A 0069 THR C 3.665 E A 0070 CYS C
E A 0069 THR C 3.173 E A 0070 CYS CB
E A 0070 CYS C 2.434 E A 0071 THR CA
E A 0070 CYS C 3.567 E A 0071 THR C
E A 0070 CYS C 3.324 E A 0071 THR CB
E A 0071 THR C 2.412 E A 0072 CYS CA
E A 0071 THR C 3.365 E A 0072 CYS C
E A 0071 THR C 3.570 E A 0072 CYS CB
E A 0072 CYS C 2.430 C A 0073 ALA CA
E A 0072 CYS C 3.167 C A 0073 ALA C
E A 0072 CYS C 3.664 C A 0073 ALA CB
E A 0072 CYS CB 3.710 E A 0076 PHE CB
E A 0072 CYS CB 3.137 C A 0081 CYS CB
C A 0073 ALA C 2.427 C A 0074 GLU CA
C A 0073 ALA C 3.042 C A 0074 GLU C
C A 0073 ALA C 3.688 C A 0074 GLU CB
C A 0073 ALA CB 3.181 E A 0076 PHE CD1
C A 0073 ALA CB 3.641 E A 0076 PHE CE1
C A 0074 GLU CA 3.788 C A 0075 GLY CA
C A 0074 GLU C 2.414 C A 0075 GLY CA
C A 0074 GLU C 3.206 C A 0075 GLY C
C A 0075 GLY CA 3.771 E A 0076 PHE CA
C A 0075 GLY C 2.378 E A 0076 PHE CA
C A 0075 GLY C 3.566 E A 0076 PHE C
C A 0075 GLY C 3.226 E A 0076 PHE CB
C A 0075 GLY C 3.176 E A 0076 PHE CG
C A 0075 GLY C 3.038 E A 0076 PHE CD1
C A 0075 GLY C 3.424 C A 0085 THR CG2
E A 0076 PHE C 2.423 E A 0077 GLU CA
E A 0076 PHE C 3.672 E A 0077 GLU C
E A 0076 PHE C 3.160 E A 0077 GLU CB
E A 0076 PHE CE2 3.551 E A 0084 SER CB
E A 0077 GLU C 2.430 C A 0078 GLY CA
E A 0077 GLU C 3.363 C A 0078 GLY C
E A 0077 GLU C 3.579 C A 0081 CYS CA
C A 0078 GLY C 2.420 C A 0079 LYS CA
C A 0078 GLY C 2.887 C A 0079 LYS C
C A 0078 GLY C 3.683 C A 0079 LYS CB
C A 0079 LYS C 2.423 C A 0080 ASN CA
C A 0079 LYS C 3.180 C A 0080 ASN C
C A 0079 LYS C 3.643 C A 0080 ASN CB
C A 0080 ASN C 2.404 C A 0081 CYS CA
C A 0080 ASN C 2.793 C A 0081 CYS C
C A 0080 ASN C 3.026 C A 0081 CYS CB
C A 0081 CYS C 2.439 C A 0082 GLU CA
C A 0081 CYS C 3.112 C A 0082 GLU C
C A 0081 CYS C 3.696 C A 0082 GLU CB
C A 0082 GLU C 2.411 E A 0083 PHE CA
C A 0082 GLU C 3.420 E A 0083 PHE C
C A 0082 GLU C 3.478 E A 0083 PHE CB
C A 0082 GLU C 3.469 E A 0083 PHE CG
C A 0082 GLU C 2.998 E A 0083 PHE CD1
E A 0083 PHE CA 3.780 E A 0084 SER CA
E A 0083 PHE C 2.411 E A 0084 SER CA
E A 0083 PHE C 3.265 E A 0084 SER C
E A 0083 PHE C 3.594 E A 0084 SER CB
E A 0084 SER C 2.424 C A 0085 THR CA
E A 0084 SER C 2.993 C A 0085 THR C
E A 0084 SER C 3.692 C A 0085 THR CB
C A 0085 THR C 2.420 C A 0086 ARG CA
C A 0085 THR C 3.470 C A 0086 ARG C
C A 0085 THR C 3.462 C A 0086 ARG CB
CHARGE_ATTR 2.00 12.00 23
C A 0046 ASP OD1 9.884 C A 0043 LYS NZ
C A 0046 ASP OD2 11.80 C A 0043 LYS NZ
C A 0046 ASP OD1 6.769 C A 0045 LYS NZ
C A 0046 ASP OD2 7.834 C A 0045 LYS NZ
C A 0048 ASP OD1 11.06 H A 0015 ARG NH1
C A 0048 ASP OD2 11.84 H A 0015 ARG NH1
C A 0048 ASP OD1 7.956 C A 0045 LYS NZ
C A 0048 ASP OD2 8.028 C A 0045 LYS NZ
C A 0048 ASP OD1 11.17 C A 0053 HIS ND1
C A 0048 ASP OD1 9.810 C A 0053 HIS NE2
C A 0048 ASP OD2 10.06 C A 0053 HIS ND1
C A 0048 ASP OD2 8.438 C A 0053 HIS NE2
C A 0051 GLU OE1 5.473 C A 0045 LYS NZ
C A 0051 GLU OE2 6.342 C A 0045 LYS NZ
C A 0051 GLU OE1 10.46 C A 0053 HIS ND1
C A 0051 GLU OE1 9.245 C A 0053 HIS NE2
C A 0051 GLU OE2 10.69 C A 0053 HIS ND1
C A 0051 GLU OE2 9.571 C A 0053 HIS NE2
C A 0067 ASP OD1 11.74 E A 0062 LYS NZ
C A 0074 GLU OE1 10.63 C A 0086 ARG NH1
C A 0074 GLU OE2 10.94 C A 0086 ARG NH1
E A 0077 GLU OE1 11.88 C A 0079 LYS NZ
E A 0077 GLU OE2 11.32 C A 0079 LYS NZ
CHARGE_REPU 2.00 12.00 32
C A 0033 ASP OD1 11.82 H A 0038 ASP OD2
C A 0033 ASP OD2 11.54 H A 0038 ASP OD2
C A 0033 ASP OD2 11.02 C A 0067 ASP OD1
C A 0033 ASP OD2 11.44 C A 0067 ASP OD2
H A 0038 ASP OD2 11.92 C A 0067 ASP OD2
C A 0043 LYS NZ 7.424 C A 0045 LYS NZ
C A 0046 ASP OD1 5.062 C A 0048 ASP OD1
C A 0046 ASP OD1 6.811 C A 0048 ASP OD2
C A 0046 ASP OD2 5.063 C A 0048 ASP OD1
C A 0046 ASP OD2 6.666 C A 0048 ASP OD2
C A 0046 ASP OD1 7.595 C A 0051 GLU OE1
C A 0046 ASP OD1 9.561 C A 0051 GLU OE2
C A 0046 ASP OD2 7.295 C A 0051 GLU OE1
C A 0046 ASP OD2 9.203 C A 0051 GLU OE2
C A 0046 ASP OD1 10.52 C A 0067 ASP OD1
C A 0046 ASP OD1 9.838 C A 0067 ASP OD2
C A 0046 ASP OD2 8.979 C A 0067 ASP OD1
C A 0046 ASP OD2 8.515 C A 0067 ASP OD2
C A 0048 ASP OD1 6.056 C A 0051 GLU OE1
C A 0048 ASP OD1 8.158 C A 0051 GLU OE2
C A 0048 ASP OD2 5.036 C A 0051 GLU OE1
C A 0048 ASP OD2 6.924 C A 0051 GLU OE2
C A 0053 HIS ND1 7.144 E A 0060 HIS ND1
C A 0053 HIS ND1 8.404 E A 0060 HIS NE2
C A 0053 HIS NE2 8.461 E A 0060 HIS ND1
C A 0053 HIS NE2 9.624 E A 0060 HIS NE2
E A 0060 HIS ND1 8.848 E A 0062 LYS NZ
E A 0060 HIS NE2 10.38 E A 0062 LYS NZ
C A 0074 GLU OE1 8.956 E A 0077 GLU OE1
C A 0074 GLU OE1 10.70 E A 0077 GLU OE2
C A 0074 GLU OE2 10.64 E A 0077 GLU OE1
E A 0077 GLU OE2 11.09 C A 0082 GLU OE2
HB_MM 2.00 3.20 91
C A 0002 ASN N 2.198 C A 0001 ALA O
C A 0003 SER N 2.197 C A 0002 ASN O
C A 0004 PHE N 2.195 C A 0003 SER O
C A 0005 LEU N 2.197 C A 0004 PHE O
C A 0009 LYS N 2.195 C A 0008 VAL O
C A 0010 GLN N 2.615 C A 0008 VAL O
C A 0010 GLN N 2.196 C A 0009 LYS O
C A 0011 GLY N 2.196 C A 0010 GLN O
C A 0012 ASN N 2.199 C A 0011 GLY O
H A 0013 LEU N 2.194 C A 0012 ASN O
H A 0017 CYS N 3.139 H A 0015 ARG O
H A 0018 LEU N 2.931 H A 0015 ARG O
H A 0018 LEU N 2.185 H A 0017 CYS O
H A 0022 CYS N 2.187 H A 0021 ALA O
H A 0023 SER N 2.200 H A 0022 CYS O
H A 0024 LEU N 2.199 H A 0023 SER O
H A 0028 ARG N 2.195 H A 0027 ALA O
H A 0030 VAL N 3.116 H A 0027 ALA O
C A 0031 PHE N 2.196 H A 0030 VAL O
C A 0033 ASP N 2.899 C A 0031 PHE O
H A 0034 ALA N 2.195 C A 0033 ASP O
H A 0036 GLN N 3.134 H A 0034 ALA O
H A 0037 THR N 3.062 H A 0034 ALA O
H A 0037 THR N 2.187 H A 0036 GLN O
H A 0038 ASP N 2.202 H A 0037 THR O
H A 0040 PHE N 2.673 H A 0038 ASP O
H A 0041 TRP N 3.198 H A 0037 THR O
H A 0041 TRP N 2.884 H A 0038 ASP O
H A 0041 TRP N 2.192 H A 0040 PHE O
C A 0042 SER N 2.214 H A 0041 TRP O
C A 0043 LYS N 2.733 H A 0041 TRP O
C A 0043 LYS N 2.201 C A 0042 SER O
C A 0044 TYR N 2.734 H A 0041 TRP O
C A 0044 TYR N 2.214 C A 0043 LYS O
C A 0045 LYS N 2.313 C A 0043 LYS O
C A 0045 LYS N 2.192 C A 0044 TYR O
C A 0046 ASP N 2.212 C A 0045 LYS O
C A 0047 GLY N 2.196 C A 0046 ASP O
C A 0048 ASP N 2.197 C A 0047 GLY O
C A 0049 GLN N 2.743 C A 0047 GLY O
C A 0049 GLN N 2.211 C A 0048 ASP O
C A 0050 CYS N 2.205 C A 0049 GLN O
C A 0051 GLU N 2.193 C A 0050 CYS O
C A 0052 GLY N 2.192 C A 0051 GLU O
C A 0053 HIS N 2.208 C A 0052 GLY O
C A 0054 PRO N 2.227 C A 0053 HIS O
C A 0055 CYS N 3.163 C A 0053 HIS O
C A 0055 CYS N 2.197 C A 0054 PRO O
C A 0056 LEU N 2.202 C A 0055 CYS O
C A 0057 ASN N 2.199 C A 0056 LEU O
C A 0058 GLN N 3.154 C A 0056 LEU O
C A 0058 GLN N 2.189 C A 0057 ASN O
E A 0059 GLY N 2.906 C A 0056 LEU O
E A 0059 GLY N 3.113 C A 0057 ASN O
E A 0059 GLY N 2.188 C A 0058 GLN O
E A 0060 HIS N 2.196 E A 0059 GLY O
E A 0060 HIS N 2.729 E A 0071 THR O
E A 0061 CYS N 2.194 E A 0060 HIS O
E A 0062 LYS N 2.196 E A 0061 CYS O
C A 0065 ILE N 2.205 C A 0064 GLY O
C A 0066 GLY N 2.794 C A 0064 GLY O
C A 0066 GLY N 2.200 C A 0065 ILE O
C A 0067 ASP N 2.887 C A 0064 GLY O
C A 0067 ASP N 2.198 C A 0066 GLY O
E A 0068 TYR N 2.194 C A 0067 ASP O
E A 0069 THR N 2.195 E A 0068 TYR O
E A 0070 CYS N 2.197 E A 0069 THR O
E A 0071 THR N 2.916 E A 0060 HIS O
E A 0071 THR N 2.203 E A 0070 CYS O
E A 0072 CYS N 2.190 E A 0071 THR O
C A 0073 ALA N 2.202 E A 0072 CYS O
C A 0074 GLU N 2.195 C A 0073 ALA O
C A 0075 GLY N 2.184 C A 0074 GLU O
E A 0076 PHE N 3.030 C A 0074 GLU O
E A 0076 PHE N 2.186 C A 0075 GLY O
E A 0077 GLU N 2.195 E A 0076 PHE O
E A 0077 GLU N 3.010 E A 0083 PHE O
C A 0078 GLY N 2.202 E A 0077 GLU O
C A 0079 LYS N 2.195 C A 0078 GLY O
C A 0080 ASN N 2.196 C A 0079 LYS O
C A 0081 CYS N 2.980 C A 0078 GLY O
C A 0081 CYS N 3.087 C A 0079 LYS O
C A 0081 CYS N 2.194 C A 0080 ASN O
C A 0082 GLU N 2.584 C A 0080 ASN O
C A 0082 GLU N 2.207 C A 0081 CYS O
E A 0083 PHE N 2.991 C A 0081 CYS O
E A 0083 PHE N 2.189 C A 0082 GLU O
E A 0084 SER N 2.191 E A 0083 PHE O
C A 0085 THR N 3.032 C A 0075 GLY O
C A 0085 THR N 2.197 E A 0084 SER O
C A 0086 ARG N 2.197 C A 0085 THR O
HB_MS 2.00 3.20 9
C A 0002 ASN O 2.803 C A 0003 SER OG
H A 0023 SER O 2.940 H A 0041 TRP NE1
H A 0034 ALA O 2.443 H A 0037 THR OG1
H A 0038 ASP N 2.793 H A 0037 THR OG1
C A 0047 GLY N 2.986 C A 0046 ASP OD2
C A 0048 ASP N 2.680 C A 0046 ASP OD2
C A 0050 CYS O 2.919 C A 0053 HIS NE2
C A 0081 CYS O 2.633 C A 0057 ASN ND2
C A 0086 ARG N 2.511 C A 0085 THR OG1
HB_SS 2.00 3.20 2
C A 0046 ASP OD2 2.585 C A 0049 GLN NE2
E A 0084 SER OG 2.935 C A 0057 ASN OD1
AROMATIC 0.00 8.00 3
H A 0040 PHE 3.744 H A 0041 TRP
H A 0041 TRP 4.876 C A 0044 TYR
C A 0086 ARG 7.807 E A 0076 PHE
SS_BOND 1.50 2.80 4
H A 0017 CYS SG 2.024 H A 0022 CYS SG
C A 0050 CYS SG 2.020 E A 0061 CYS SG
C A 0055 CYS SG 2.020 E A 0070 CYS SG
E A 0072 CYS SG 2.019 C A 0081 CYS SG