Complet list of 2stw con file
Complete list of 2stw.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "B"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "C"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "B"
AND
CHAIN(S) "A"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "C"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "C"
AND
CHAIN(S) "A"
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 432
C A 0010 VAL C 2.438 C A 0011 ILE CA
C A 0010 VAL C 3.529 C A 0011 ILE C
C A 0010 VAL C 3.388 C A 0011 ILE CB
C A 0010 VAL CA 3.743 C A 0012 PRO CD
C A 0010 VAL C 2.986 C A 0012 PRO CD
C A 0010 VAL CG2 3.408 C A 0043 PHE CE1
C A 0010 VAL CG2 3.471 C A 0043 PHE CZ
C A 0011 ILE CA 2.839 C A 0012 PRO CD
C A 0011 ILE C 2.423 C A 0012 PRO CA
C A 0011 ILE C 2.986 C A 0012 PRO C
C A 0011 ILE C 3.632 C A 0012 PRO CB
C A 0011 ILE C 3.627 C A 0012 PRO CG
C A 0011 ILE C 2.473 C A 0012 PRO CD
C A 0011 ILE CD1 3.422 C A 0013 ALA CB
C A 0011 ILE CG1 3.527 H A 0064 ARG CZ
C A 0011 ILE CD1 3.392 H A 0064 ARG CZ
C A 0012 PRO C 2.404 C A 0013 ALA CA
C A 0012 PRO C 2.874 C A 0013 ALA C
C A 0012 PRO C 3.675 C A 0013 ALA CB
C A 0012 PRO C 3.779 C A 0016 LEU CD1
C A 0012 PRO CB 3.618 C A 0016 LEU CD1
C A 0012 PRO CG 3.424 C A 0038 LYS CB
C A 0013 ALA C 2.422 C A 0014 ALA CA
C A 0013 ALA C 2.973 C A 0014 ALA C
C A 0013 ALA C 3.688 C A 0014 ALA CB
C A 0014 ALA C 2.433 C A 0015 ALA CA
C A 0014 ALA C 3.179 C A 0015 ALA C
C A 0014 ALA C 3.672 C A 0015 ALA CB
C A 0015 ALA C 2.429 C A 0016 LEU CA
C A 0015 ALA C 3.039 C A 0016 LEU C
C A 0015 ALA C 3.681 C A 0016 LEU CB
C A 0016 LEU CA 3.686 C A 0017 ALA CA
C A 0016 LEU C 2.349 C A 0017 ALA CA
C A 0016 LEU C 2.784 C A 0017 ALA C
C A 0016 LEU C 3.668 C A 0017 ALA CB
C A 0016 LEU CD1 3.045 C A 0037 ASP CG
C A 0017 ALA C 2.420 C A 0018 GLY CA
C A 0017 ALA C 2.789 C A 0018 GLY C
C A 0017 ALA C 3.583 C A 0019 TYR CA
C A 0017 ALA C 3.679 C A 0019 TYR CB
C A 0018 GLY CA 3.750 C A 0019 TYR CA
C A 0018 GLY C 2.421 C A 0019 TYR CA
C A 0018 GLY C 2.923 C A 0019 TYR C
C A 0018 GLY C 3.650 C A 0019 TYR CB
C A 0019 TYR CA 3.762 C A 0020 THR CA
C A 0019 TYR C 2.407 C A 0020 THR CA
C A 0019 TYR C 3.134 C A 0020 THR C
C A 0019 TYR C 3.637 C A 0020 THR CB
C A 0019 TYR CD1 3.727 C A 0025 ILE CD1
C A 0019 TYR CE1 3.534 C A 0025 ILE CB
C A 0019 TYR CE1 3.456 C A 0025 ILE CD1
C A 0019 TYR CZ 3.475 C A 0025 ILE CA
C A 0019 TYR CZ 3.308 C A 0025 ILE CB
C A 0019 TYR CZ 3.714 C A 0025 ILE CG1
C A 0020 THR CA 3.778 C A 0021 GLY CA
C A 0020 THR C 2.422 C A 0021 GLY CA
C A 0020 THR C 2.977 C A 0021 GLY C
C A 0021 GLY CA 3.791 C A 0022 SER CA
C A 0021 GLY C 2.416 C A 0022 SER CA
C A 0021 GLY C 3.103 C A 0022 SER C
C A 0021 GLY C 3.644 C A 0022 SER CB
C A 0022 SER CA 3.776 C A 0023 GLY CA
C A 0022 SER C 2.425 C A 0023 GLY CA
C A 0022 SER C 3.193 C A 0023 GLY C
C A 0023 GLY CA 2.866 C A 0024 PRO CD
C A 0023 GLY C 2.423 C A 0024 PRO CA
C A 0023 GLY C 2.899 C A 0024 PRO C
C A 0023 GLY C 3.649 C A 0024 PRO CB
C A 0023 GLY C 3.660 C A 0024 PRO CG
C A 0023 GLY C 2.464 C A 0024 PRO CD
C A 0024 PRO C 2.407 C A 0025 ILE CA
C A 0024 PRO C 3.049 C A 0025 ILE C
C A 0024 PRO C 3.698 C A 0025 ILE CB
C A 0025 ILE CA 3.769 C A 0026 GLN CA
C A 0025 ILE C 2.385 C A 0026 GLN CA
C A 0025 ILE C 3.059 C A 0026 GLN C
C A 0025 ILE C 3.636 C A 0026 GLN CB
C A 0025 ILE CG2 3.567 H A 0030 PHE CB
C A 0025 ILE CD1 3.654 H A 0030 PHE CB
C A 0026 GLN C 2.415 H A 0027 LEU CA
C A 0026 GLN C 2.869 H A 0027 LEU C
C A 0026 GLN C 3.678 H A 0027 LEU CB
C A 0026 GLN CD 3.753 H A 0027 LEU CA
C A 0026 GLN CD 3.155 H A 0028 TRP CD1
C A 0026 GLN CB 3.765 H A 0029 GLN CB
H A 0027 LEU C 2.416 H A 0028 TRP CA
H A 0027 LEU C 2.991 H A 0028 TRP C
H A 0027 LEU C 3.685 H A 0028 TRP CB
H A 0027 LEU CD2 3.561 H A 0065 TRP CZ2
H A 0027 LEU CD2 3.493 H A 0065 TRP CH2
H A 0027 LEU CB 3.590 C A 0086 TYR CZ
H A 0027 LEU CD1 3.480 C A 0086 TYR CD1
H A 0027 LEU CD1 3.216 C A 0086 TYR CE1
H A 0027 LEU CD1 3.710 C A 0086 TYR CZ
H A 0028 TRP C 2.406 H A 0029 GLN CA
H A 0028 TRP C 2.852 H A 0029 GLN C
H A 0028 TRP C 3.703 H A 0029 GLN CB
H A 0028 TRP CD2 3.754 H A 0029 GLN CA
H A 0028 TRP CE3 3.536 H A 0029 GLN CA
H A 0028 TRP CZ3 3.699 H A 0032 LEU CD2
H A 0028 TRP CB 3.502 C A 0091 ILE CG1
H A 0028 TRP CG 3.202 C A 0091 ILE CG1
H A 0028 TRP CD1 3.723 C A 0091 ILE CG1
H A 0028 TRP CD2 3.273 C A 0091 ILE CG1
H A 0028 TRP CD2 3.796 C A 0091 ILE CD1
H A 0028 TRP CE3 3.647 C A 0091 ILE CG1
H A 0028 TRP CE3 3.568 C A 0091 ILE CD1
H A 0029 GLN C 2.429 H A 0030 PHE CA
H A 0029 GLN C 2.967 H A 0030 PHE C
H A 0029 GLN C 3.692 H A 0030 PHE CB
H A 0030 PHE C 2.434 H A 0031 LEU CA
H A 0030 PHE C 2.940 H A 0031 LEU C
H A 0030 PHE C 3.694 H A 0031 LEU CB
H A 0030 PHE CD2 3.688 H A 0031 LEU CA
H A 0030 PHE CE2 3.799 H A 0065 TRP CZ3
H A 0031 LEU C 2.412 H A 0032 LEU CA
H A 0031 LEU C 3.008 H A 0032 LEU C
H A 0031 LEU C 3.692 H A 0032 LEU CB
H A 0032 LEU C 2.421 H A 0033 GLU CA
H A 0032 LEU C 3.009 H A 0033 GLU C
H A 0032 LEU C 3.725 H A 0033 GLU CB
H A 0033 GLU C 2.426 H A 0034 LEU CA
H A 0033 GLU C 3.050 H A 0034 LEU C
H A 0033 GLU C 3.694 H A 0034 LEU CB
H A 0034 LEU C 2.414 H A 0035 LEU CA
H A 0034 LEU C 3.029 H A 0035 LEU C
H A 0034 LEU C 3.677 H A 0035 LEU CB
H A 0034 LEU CA 3.757 C A 0037 ASP CB
H A 0034 LEU C 3.488 C A 0037 ASP CB
H A 0035 LEU C 2.428 H A 0036 THR CA
H A 0035 LEU C 3.041 H A 0036 THR C
H A 0035 LEU C 3.699 H A 0036 THR CB
H A 0035 LEU CD2 3.511 E A 0046 TRP CZ2
H A 0035 LEU CD2 3.714 C A 0051 TRP CZ2
H A 0035 LEU CG 3.704 E A 0053 PHE CD1
H A 0035 LEU CG 3.716 E A 0053 PHE CE1
H A 0035 LEU CD1 3.674 E A 0053 PHE CG
H A 0035 LEU CD1 3.560 E A 0053 PHE CD2
H A 0035 LEU CD1 3.579 E A 0053 PHE CE2
H A 0035 LEU CD1 3.712 E A 0053 PHE CZ
H A 0035 LEU CD1 3.535 E A 0104 PHE CE1
H A 0035 LEU CD1 3.672 E A 0104 PHE CZ
H A 0036 THR C 2.437 C A 0037 ASP CA
H A 0036 THR C 3.529 C A 0037 ASP C
H A 0036 THR C 3.444 C A 0037 ASP CB
H A 0036 THR CG2 3.456 C A 0051 TRP CH2
C A 0037 ASP C 2.451 C A 0038 LYS CA
C A 0037 ASP C 3.068 C A 0038 LYS C
C A 0037 ASP C 3.703 C A 0038 LYS CB
C A 0038 LYS C 2.424 H A 0039 SER CA
C A 0038 LYS C 3.038 H A 0039 SER C
C A 0038 LYS C 3.694 H A 0039 SER CB
C A 0038 LYS CD 3.748 H A 0039 SER CA
C A 0038 LYS CD 3.636 H A 0039 SER C
H A 0039 SER C 2.460 H A 0040 CYS CA
H A 0039 SER C 3.188 H A 0040 CYS C
H A 0039 SER C 2.907 H A 0040 CYS CB
H A 0040 CYS C 2.431 H A 0041 GLN CA
H A 0040 CYS C 3.253 H A 0041 GLN C
H A 0040 CYS C 3.640 H A 0041 GLN CB
H A 0040 CYS CA 3.557 C A 0044 ILE CG2
H A 0040 CYS C 3.509 C A 0044 ILE CG2
H A 0040 CYS CB 3.422 C A 0044 ILE CG2
H A 0041 GLN C 2.431 C A 0042 SER CA
H A 0041 GLN C 3.220 C A 0042 SER C
H A 0041 GLN C 3.656 C A 0042 SER CB
C A 0042 SER CA 3.765 C A 0043 PHE CD1
C A 0042 SER C 2.443 C A 0043 PHE CA
C A 0042 SER C 3.527 C A 0043 PHE C
C A 0042 SER C 3.447 C A 0043 PHE CB
C A 0042 SER C 3.315 C A 0043 PHE CG
C A 0042 SER C 3.181 C A 0043 PHE CD1
C A 0042 SER CB 3.452 C A 0043 PHE CD1
C A 0042 SER CB 3.280 C A 0043 PHE CE1
C A 0043 PHE C 2.400 C A 0044 ILE CA
C A 0043 PHE C 3.670 C A 0044 ILE C
C A 0043 PHE C 3.008 C A 0044 ILE CB
C A 0043 PHE C 3.775 C A 0044 ILE CG2
C A 0044 ILE C 2.450 E A 0045 SER CA
C A 0044 ILE C 3.581 E A 0045 SER C
C A 0044 ILE C 3.408 E A 0045 SER CB
C A 0044 ILE CD1 3.598 E A 0053 PHE CE2
C A 0044 ILE CD1 3.541 E A 0053 PHE CZ
C A 0044 ILE CG1 3.745 C A 0055 LEU CA
C A 0044 ILE CD1 3.620 C A 0055 LEU CA
C A 0044 ILE CD1 3.661 C A 0055 LEU CG
E A 0045 SER C 2.458 E A 0046 TRP CA
E A 0045 SER C 3.444 E A 0046 TRP C
E A 0045 SER C 3.519 E A 0046 TRP CB
E A 0046 TRP C 2.411 E A 0047 THR CA
E A 0046 TRP C 2.887 E A 0047 THR C
E A 0046 TRP C 3.747 E A 0047 THR CB
E A 0046 TRP CD1 3.782 E A 0053 PHE CE1
E A 0046 TRP CD2 3.737 E A 0053 PHE CD1
E A 0047 THR C 2.440 C A 0048 GLY CA
E A 0047 THR C 3.398 C A 0048 GLY C
E A 0047 THR CG2 3.442 E A 0052 GLU CB
C A 0048 GLY C 2.447 C A 0049 ASP CA
C A 0048 GLY C 3.575 C A 0049 ASP C
C A 0048 GLY C 3.390 C A 0049 ASP CB
C A 0049 ASP C 2.431 C A 0050 GLY CA
C A 0049 ASP C 3.177 C A 0050 GLY C
C A 0050 GLY C 2.425 C A 0051 TRP CA
C A 0050 GLY C 3.651 C A 0051 TRP C
C A 0050 GLY C 3.228 C A 0051 TRP CB
C A 0051 TRP C 2.440 E A 0052 GLU CA
C A 0051 TRP C 3.461 E A 0052 GLU C
C A 0051 TRP C 3.479 E A 0052 GLU CB
E A 0052 GLU C 2.423 E A 0053 PHE CA
E A 0052 GLU C 3.570 E A 0053 PHE C
E A 0052 GLU C 3.331 E A 0053 PHE CB
E A 0053 PHE C 2.448 E A 0054 LYS CA
E A 0053 PHE C 3.445 E A 0054 LYS C
E A 0053 PHE C 3.585 E A 0054 LYS CB
E A 0053 PHE C 3.690 E A 0054 LYS CG
E A 0053 PHE CD2 3.391 C A 0055 LEU CD1
E A 0053 PHE CE2 3.308 C A 0055 LEU CD1
E A 0054 LYS CA 3.787 C A 0055 LEU CA
E A 0054 LYS C 2.419 C A 0055 LEU CA
E A 0054 LYS C 3.261 C A 0055 LEU C
E A 0054 LYS C 3.582 C A 0055 LEU CB
E A 0054 LYS C 3.296 C A 0055 LEU CD1
C A 0055 LEU C 2.424 C A 0056 SER CA
C A 0055 LEU C 3.121 C A 0056 SER C
C A 0055 LEU C 3.679 C A 0056 SER CB
C A 0055 LEU CD2 3.567 H A 0076 TYR CE1
C A 0055 LEU CD2 3.493 H A 0076 TYR CZ
C A 0055 LEU CD1 3.628 E A 0102 TYR CD1
C A 0055 LEU CD2 3.751 E A 0102 TYR CD1
C A 0055 LEU CD2 3.719 E A 0102 TYR CE1
C A 0056 SER C 2.441 C A 0057 ASP CA
C A 0056 SER C 3.626 C A 0057 ASP C
C A 0056 SER C 3.331 C A 0057 ASP CB
C A 0056 SER C 3.654 C A 0057 ASP CG
C A 0056 SER C 3.616 C A 0058 PRO CD
C A 0057 ASP CA 2.865 C A 0058 PRO CD
C A 0057 ASP C 2.435 C A 0058 PRO CA
C A 0057 ASP C 3.089 C A 0058 PRO C
C A 0057 ASP C 3.637 C A 0058 PRO CB
C A 0057 ASP C 3.670 C A 0058 PRO CG
C A 0057 ASP C 2.477 C A 0058 PRO CD
C A 0058 PRO C 2.416 H A 0059 ASP CA
C A 0058 PRO C 3.050 H A 0059 ASP C
C A 0058 PRO C 3.692 H A 0059 ASP CB
H A 0059 ASP C 2.417 H A 0060 GLU CA
H A 0059 ASP C 3.158 H A 0060 GLU C
H A 0059 ASP C 3.647 H A 0060 GLU CB
H A 0060 GLU CA 3.794 H A 0061 VAL CA
H A 0060 GLU C 2.409 H A 0061 VAL CA
H A 0060 GLU C 2.982 H A 0061 VAL C
H A 0060 GLU C 3.674 H A 0061 VAL CB
H A 0061 VAL C 2.414 H A 0062 ALA CA
H A 0061 VAL C 2.950 H A 0062 ALA C
H A 0061 VAL C 3.692 H A 0062 ALA CB
H A 0062 ALA C 2.414 H A 0063 ARG CA
H A 0062 ALA C 3.111 H A 0063 ARG C
H A 0062 ALA C 3.728 H A 0063 ARG CB
H A 0063 ARG C 2.410 H A 0064 ARG CA
H A 0063 ARG C 2.967 H A 0064 ARG C
H A 0063 ARG C 3.724 H A 0064 ARG CB
H A 0064 ARG C 2.421 H A 0065 TRP CA
H A 0064 ARG C 2.930 H A 0065 TRP C
H A 0064 ARG C 3.688 H A 0065 TRP CB
H A 0065 TRP C 2.424 H A 0066 GLY CA
H A 0065 TRP C 3.168 H A 0066 GLY C
H A 0065 TRP CD2 3.743 H A 0079 LEU CD2
H A 0065 TRP CE2 3.362 H A 0079 LEU CD2
H A 0065 TRP CZ2 3.659 H A 0079 LEU CD2
H A 0066 GLY C 2.420 H A 0067 LYS CA
H A 0066 GLY C 3.041 H A 0067 LYS C
H A 0066 GLY C 3.700 H A 0067 LYS CB
H A 0067 LYS C 2.419 C A 0068 ARG CA
H A 0067 LYS C 2.890 C A 0068 ARG C
H A 0067 LYS C 3.675 C A 0068 ARG CB
C A 0068 ARG CA 3.800 C A 0069 LYS CA
C A 0068 ARG C 2.422 C A 0069 LYS CA
C A 0068 ARG C 3.326 C A 0069 LYS C
C A 0068 ARG C 3.542 C A 0069 LYS CB
C A 0068 ARG C 3.564 C A 0069 LYS CG
C A 0069 LYS C 2.424 C A 0070 ASN CA
C A 0069 LYS C 2.926 C A 0070 ASN C
C A 0069 LYS C 3.033 C A 0070 ASN CB
C A 0070 ASN C 2.423 C A 0071 LYS CA
C A 0070 ASN C 3.262 C A 0071 LYS C
C A 0070 ASN C 3.596 C A 0071 LYS CB
C A 0071 LYS CA 2.910 C A 0072 PRO CD
C A 0071 LYS C 2.451 C A 0072 PRO CA
C A 0071 LYS C 3.042 C A 0072 PRO C
C A 0071 LYS C 3.682 C A 0072 PRO CB
C A 0071 LYS C 3.692 C A 0072 PRO CG
C A 0071 LYS C 2.489 C A 0072 PRO CD
C A 0071 LYS CD 3.196 C A 0074 MET CE
C A 0072 PRO C 2.427 C A 0073 LYS CA
C A 0072 PRO C 3.562 C A 0073 LYS C
C A 0072 PRO C 3.384 C A 0073 LYS CB
C A 0072 PRO C 3.380 C A 0073 LYS CG
C A 0073 LYS CA 3.768 C A 0074 MET CA
C A 0073 LYS C 2.415 C A 0074 MET CA
C A 0073 LYS C 3.541 C A 0074 MET C
C A 0073 LYS C 3.315 C A 0074 MET CB
C A 0073 LYS C 3.576 C A 0074 MET CG
C A 0074 MET C 2.408 C A 0075 ASN CA
C A 0074 MET C 2.957 C A 0075 ASN C
C A 0074 MET C 3.694 C A 0075 ASN CB
C A 0074 MET CB 3.353 H A 0078 LYS CD
C A 0074 MET CG 3.296 H A 0078 LYS CD
C A 0074 MET CG 3.740 H A 0078 LYS CE
C A 0075 ASN C 2.418 H A 0076 TYR CA
C A 0075 ASN C 3.102 H A 0076 TYR C
C A 0075 ASN C 3.651 H A 0076 TYR CB
C A 0075 ASN CG 3.636 H A 0077 GLU CB
H A 0076 TYR C 2.411 H A 0077 GLU CA
H A 0076 TYR C 2.887 H A 0077 GLU C
H A 0076 TYR C 3.694 H A 0077 GLU CB
H A 0076 TYR CD1 3.689 H A 0079 LEU CD1
H A 0076 TYR CE1 3.419 H A 0079 LEU CD1
H A 0076 TYR CZ 3.694 E A 0102 TYR CZ
H A 0077 GLU C 2.427 H A 0078 LYS CA
H A 0077 GLU C 2.937 H A 0078 LYS C
H A 0077 GLU C 3.654 H A 0078 LYS CB
H A 0078 LYS CA 3.753 H A 0079 LEU CA
H A 0078 LYS C 2.379 H A 0079 LEU CA
H A 0078 LYS C 2.860 H A 0079 LEU C
H A 0078 LYS C 3.633 H A 0079 LEU CB
H A 0078 LYS CA 3.584 H A 0081 ARG CB
H A 0078 LYS C 3.371 H A 0081 ARG CB
H A 0079 LEU C 2.398 H A 0080 SER CA
H A 0079 LEU C 2.877 H A 0080 SER C
H A 0079 LEU C 3.671 H A 0080 SER CB
H A 0079 LEU C 3.626 H A 0083 LEU CB
H A 0080 SER C 2.448 H A 0081 ARG CA
H A 0080 SER C 3.274 H A 0081 ARG C
H A 0080 SER C 3.627 H A 0081 ARG CB
H A 0081 ARG C 2.430 H A 0082 GLY CA
H A 0081 ARG C 3.052 H A 0082 GLY C
H A 0082 GLY C 2.400 H A 0083 LEU CA
H A 0082 GLY C 2.949 H A 0083 LEU C
H A 0082 GLY C 3.689 H A 0083 LEU CB
H A 0083 LEU C 2.410 H A 0084 ARG CA
H A 0083 LEU C 2.895 H A 0084 ARG C
H A 0083 LEU C 3.678 H A 0084 ARG CB
H A 0083 LEU C 3.533 C A 0086 TYR CB
H A 0083 LEU CD1 3.646 E A 0102 TYR CE2
H A 0084 ARG C 2.426 H A 0085 TYR CA
H A 0084 ARG C 2.895 H A 0085 TYR C
H A 0084 ARG C 3.693 H A 0085 TYR CB
H A 0084 ARG C 3.712 C A 0087 TYR CD2
H A 0085 TYR C 2.426 C A 0086 TYR CA
H A 0085 TYR C 3.154 C A 0086 TYR C
H A 0085 TYR C 3.668 C A 0086 TYR CB
C A 0086 TYR C 2.420 C A 0087 TYR CA
C A 0086 TYR C 3.089 C A 0087 TYR C
C A 0086 TYR C 3.705 C A 0087 TYR CB
C A 0087 TYR C 2.416 C A 0088 ASP CA
C A 0087 TYR C 3.109 C A 0088 ASP C
C A 0087 TYR C 3.676 C A 0088 ASP CB
C A 0088 ASP C 2.421 C A 0089 LYS CA
C A 0088 ASP C 3.475 C A 0089 LYS C
C A 0088 ASP C 3.452 C A 0089 LYS CB
C A 0088 ASP C 3.486 C A 0089 LYS CG
C A 0089 LYS CA 3.780 C A 0090 ASN CA
C A 0089 LYS C 2.404 C A 0090 ASN CA
C A 0089 LYS C 3.057 C A 0090 ASN C
C A 0089 LYS C 3.663 C A 0090 ASN CB
C A 0090 ASN C 2.428 C A 0091 ILE CA
C A 0090 ASN C 3.588 C A 0091 ILE C
C A 0090 ASN C 3.298 C A 0091 ILE CB
C A 0091 ILE C 2.440 E A 0092 ILE CA
C A 0091 ILE C 3.528 E A 0092 ILE C
C A 0091 ILE C 3.452 E A 0092 ILE CB
E A 0092 ILE C 2.436 E A 0093 HIS CA
E A 0092 ILE C 3.429 E A 0093 HIS C
E A 0092 ILE C 3.511 E A 0093 HIS CB
E A 0092 ILE C 3.683 E A 0093 HIS CG
E A 0092 ILE C 3.331 E A 0093 HIS CD2
E A 0092 ILE CB 3.527 E A 0104 PHE CD2
E A 0092 ILE CB 3.575 E A 0104 PHE CE2
E A 0092 ILE CG1 3.366 E A 0104 PHE CD2
E A 0092 ILE CG1 3.169 E A 0104 PHE CE2
E A 0092 ILE CG1 3.468 E A 0104 PHE CZ
E A 0092 ILE CD1 3.087 E A 0104 PHE CE2
E A 0092 ILE CD1 3.087 E A 0104 PHE CZ
E A 0093 HIS C 2.418 E A 0094 LYS CA
E A 0093 HIS C 3.176 E A 0094 LYS C
E A 0093 HIS C 3.647 E A 0094 LYS CB
E A 0093 HIS CD2 3.680 C A 0105 VAL CG1
E A 0094 LYS C 2.433 C A 0095 THR CA
E A 0094 LYS C 3.258 C A 0095 THR C
E A 0094 LYS C 3.630 C A 0095 THR CB
C A 0095 THR C 2.440 C A 0096 ALA CA
C A 0095 THR C 3.179 C A 0096 ALA C
C A 0095 THR C 3.677 C A 0096 ALA CB
C A 0096 ALA C 2.418 C A 0097 GLY CA
C A 0096 ALA C 3.083 C A 0097 GLY C
C A 0097 GLY C 2.440 C A 0098 LYS CA
C A 0097 GLY C 3.392 C A 0098 LYS C
C A 0097 GLY C 3.538 C A 0098 LYS CB
C A 0098 LYS C 2.440 C A 0099 ARG CA
C A 0098 LYS C 3.509 C A 0099 ARG C
C A 0098 LYS C 3.435 C A 0099 ARG CB
C A 0098 LYS C 3.255 C A 0099 ARG CG
C A 0098 LYS CA 3.598 C A 0101 VAL CG2
C A 0098 LYS C 3.380 C A 0101 VAL CG2
C A 0098 LYS CB 3.693 C A 0101 VAL CG2
C A 0099 ARG C 2.417 C A 0100 TYR CA
C A 0099 ARG C 3.176 C A 0100 TYR C
C A 0099 ARG C 3.634 C A 0100 TYR CB
C A 0099 ARG C 3.781 C A 0100 TYR CG
C A 0100 TYR C 2.429 C A 0101 VAL CA
C A 0100 TYR C 3.228 C A 0101 VAL C
C A 0100 TYR C 3.653 C A 0101 VAL CB
C A 0100 TYR C 3.692 E A 0102 TYR CD1
C A 0101 VAL C 2.435 E A 0102 TYR CA
C A 0101 VAL C 3.391 E A 0102 TYR C
C A 0101 VAL C 3.528 E A 0102 TYR CB
C A 0101 VAL C 3.730 E A 0102 TYR CG
C A 0101 VAL C 3.413 E A 0102 TYR CD1
E A 0102 TYR CA 3.797 E A 0103 ARG CA
E A 0102 TYR C 2.404 E A 0103 ARG CA
E A 0102 TYR C 3.631 E A 0103 ARG C
E A 0102 TYR C 3.150 E A 0103 ARG CB
E A 0103 ARG CA 3.627 E A 0104 PHE CD1
E A 0103 ARG C 2.432 E A 0104 PHE CA
E A 0103 ARG C 3.574 E A 0104 PHE C
E A 0103 ARG C 3.367 E A 0104 PHE CB
E A 0103 ARG C 3.288 E A 0104 PHE CG
E A 0103 ARG C 2.911 E A 0104 PHE CD1
E A 0103 ARG C 3.754 E A 0104 PHE CE1
E A 0104 PHE C 2.451 C A 0105 VAL CA
E A 0104 PHE C 3.430 C A 0105 VAL C
E A 0104 PHE C 3.550 C A 0105 VAL CB
E A 0104 PHE C 3.630 C A 0105 VAL CG1
CHARGE_ATTR 2.00 12.00 56
H A 0033 GLU OE1 11.87 H A 0064 ARG NH1
H A 0033 GLU OE1 9.424 C A 0068 ARG NH1
H A 0033 GLU OE1 10.29 C A 0068 ARG NH2
H A 0033 GLU OE2 10.92 C A 0068 ARG NH1
H A 0033 GLU OE2 11.89 C A 0068 ARG NH2
C A 0037 ASP OD1 8.014 C A 0038 LYS NZ
C A 0037 ASP OD2 6.051 C A 0038 LYS NZ
C A 0037 ASP OD1 11.40 H A 0064 ARG NH1
C A 0037 ASP OD2 10.02 H A 0064 ARG NH1
C A 0037 ASP OD2 10.63 H A 0064 ARG NH2
C A 0049 ASP OD2 11.81 E A 0054 LYS NZ
C A 0049 ASP OD2 11.58 E A 0103 ARG NH1
C A 0049 ASP OD2 11.60 E A 0103 ARG NH2
E A 0052 GLU OE1 6.401 E A 0054 LYS NZ
E A 0052 GLU OE2 8.429 E A 0054 LYS NZ
E A 0052 GLU OE1 11.97 C A 0098 LYS NZ
E A 0052 GLU OE1 6.697 E A 0103 ARG NH1
E A 0052 GLU OE1 8.098 E A 0103 ARG NH2
E A 0052 GLU OE2 6.017 E A 0103 ARG NH1
E A 0052 GLU OE2 6.916 E A 0103 ARG NH2
H A 0059 ASP OD1 9.142 H A 0063 ARG NH1
H A 0059 ASP OD1 8.529 H A 0063 ARG NH2
H A 0059 ASP OD2 9.372 H A 0063 ARG NH1
H A 0059 ASP OD2 8.420 H A 0063 ARG NH2
H A 0059 ASP OD1 10.32 C A 0073 LYS NZ
H A 0059 ASP OD2 11.11 C A 0073 LYS NZ
H A 0060 GLU OE1 7.170 C A 0038 LYS NZ
H A 0060 GLU OE2 9.127 C A 0038 LYS NZ
H A 0060 GLU OE1 9.425 H A 0063 ARG NH1
H A 0060 GLU OE1 7.323 H A 0063 ARG NH2
H A 0060 GLU OE2 7.476 H A 0063 ARG NH1
H A 0060 GLU OE2 5.323 H A 0063 ARG NH2
H A 0060 GLU OE1 7.618 H A 0064 ARG NH1
H A 0060 GLU OE1 6.240 H A 0064 ARG NH2
H A 0060 GLU OE2 8.672 H A 0064 ARG NH1
H A 0060 GLU OE2 7.281 H A 0064 ARG NH2
H A 0060 GLU OE1 9.754 H A 0067 LYS NZ
H A 0060 GLU OE2 9.378 H A 0067 LYS NZ
H A 0077 GLU OE1 11.51 H A 0078 LYS NZ
H A 0077 GLU OE2 11.68 H A 0078 LYS NZ
H A 0077 GLU OE1 7.210 H A 0081 ARG NH1
H A 0077 GLU OE1 5.276 H A 0081 ARG NH2
H A 0077 GLU OE2 9.030 H A 0081 ARG NH1
H A 0077 GLU OE2 7.136 H A 0081 ARG NH2
H A 0077 GLU OE1 11.31 H A 0084 ARG NH1
H A 0077 GLU OE1 10.86 C A 0099 ARG NH1
H A 0077 GLU OE2 11.23 C A 0099 ARG NH1
C A 0088 ASP OD1 10.11 H A 0084 ARG NH1
C A 0088 ASP OD1 8.214 H A 0084 ARG NH2
C A 0088 ASP OD2 11.86 H A 0084 ARG NH1
C A 0088 ASP OD2 9.837 H A 0084 ARG NH2
C A 0088 ASP OD1 9.007 C A 0089 LYS NZ
C A 0088 ASP OD2 8.105 C A 0089 LYS NZ
C A 0088 ASP OD1 10.98 E A 0093 HIS ND1
C A 0088 ASP OD1 9.867 E A 0093 HIS NE2
C A 0088 ASP OD2 11.23 E A 0093 HIS NE2
CHARGE_REPU 2.00 12.00 61
H A 0033 GLU OE1 7.003 C A 0037 ASP OD1
H A 0033 GLU OE1 8.349 C A 0037 ASP OD2
H A 0033 GLU OE2 6.301 C A 0037 ASP OD1
H A 0033 GLU OE2 7.892 C A 0037 ASP OD2
C A 0037 ASP OD2 11.59 H A 0060 GLU OE1
C A 0038 LYS NZ 9.945 H A 0064 ARG NH1
C A 0038 LYS NZ 9.621 H A 0064 ARG NH2
C A 0049 ASP OD1 9.177 E A 0052 GLU OE1
C A 0049 ASP OD1 7.978 E A 0052 GLU OE2
C A 0049 ASP OD2 7.635 E A 0052 GLU OE1
C A 0049 ASP OD2 6.300 E A 0052 GLU OE2
E A 0054 LYS NZ 8.052 C A 0098 LYS NZ
C A 0057 ASP OD1 5.371 H A 0059 ASP OD1
C A 0057 ASP OD1 5.407 H A 0059 ASP OD2
C A 0057 ASP OD2 5.802 H A 0059 ASP OD1
C A 0057 ASP OD2 5.008 H A 0059 ASP OD2
C A 0057 ASP OD1 11.97 H A 0060 GLU OE2
C A 0057 ASP OD2 11.81 H A 0060 GLU OE1
C A 0057 ASP OD2 11.25 H A 0060 GLU OE2
H A 0059 ASP OD1 9.507 H A 0060 GLU OE1
H A 0059 ASP OD1 8.273 H A 0060 GLU OE2
H A 0059 ASP OD2 8.982 H A 0060 GLU OE1
H A 0059 ASP OD2 7.695 H A 0060 GLU OE2
H A 0063 ARG NH1 11.25 H A 0064 ARG NH2
H A 0063 ARG NH2 10.95 H A 0064 ARG NH1
H A 0063 ARG NH2 9.806 H A 0064 ARG NH2
H A 0063 ARG NH1 8.653 H A 0067 LYS NZ
H A 0063 ARG NH2 8.256 H A 0067 LYS NZ
H A 0063 ARG NH1 6.468 C A 0073 LYS NZ
H A 0063 ARG NH2 8.408 C A 0073 LYS NZ
H A 0064 ARG NH1 6.769 H A 0067 LYS NZ
H A 0064 ARG NH2 6.094 H A 0067 LYS NZ
H A 0064 ARG NH1 6.172 C A 0068 ARG NH1
H A 0064 ARG NH1 8.291 C A 0068 ARG NH2
H A 0064 ARG NH2 8.278 C A 0068 ARG NH1
H A 0064 ARG NH2 10.32 C A 0068 ARG NH2
H A 0067 LYS NZ 9.994 C A 0068 ARG NH1
H A 0067 LYS NZ 11.13 C A 0068 ARG NH2
C A 0068 ARG NH1 9.222 C A 0069 LYS NZ
C A 0068 ARG NH2 8.306 C A 0069 LYS NZ
C A 0069 LYS NZ 7.912 C A 0071 LYS NZ
C A 0069 LYS NZ 6.222 H A 0078 LYS NZ
C A 0071 LYS NZ 7.176 H A 0078 LYS NZ
H A 0078 LYS NZ 10.15 H A 0081 ARG NH1
H A 0078 LYS NZ 10.84 H A 0081 ARG NH2
H A 0081 ARG NH1 6.764 H A 0084 ARG NH1
H A 0081 ARG NH1 7.160 H A 0084 ARG NH2
H A 0081 ARG NH2 7.961 H A 0084 ARG NH1
H A 0081 ARG NH2 8.848 H A 0084 ARG NH2
H A 0084 ARG NH1 9.624 E A 0094 LYS NZ
H A 0084 ARG NH2 10.85 E A 0094 LYS NZ
E A 0093 HIS ND1 8.800 E A 0094 LYS NZ
E A 0093 HIS NE2 10.53 E A 0094 LYS NZ
E A 0093 HIS ND1 9.728 E A 0103 ARG NH1
E A 0093 HIS ND1 9.574 E A 0103 ARG NH2
E A 0093 HIS NE2 11.10 E A 0103 ARG NH1
E A 0093 HIS NE2 10.61 E A 0103 ARG NH2
E A 0094 LYS NZ 10.88 C A 0099 ARG NH1
E A 0094 LYS NZ 10.63 C A 0099 ARG NH2
C A 0098 LYS NZ 9.032 C A 0099 ARG NH1
C A 0098 LYS NZ 8.692 C A 0099 ARG NH2
HB_MM 2.00 3.20 151
C A 0011 ILE N 2.195 C A 0010 VAL O
C A 0012 PRO N 2.214 C A 0011 ILE O
C A 0013 ALA N 2.755 C A 0011 ILE O
C A 0013 ALA N 2.179 C A 0012 PRO O
C A 0014 ALA N 2.193 C A 0013 ALA O
C A 0015 ALA N 3.021 C A 0012 PRO O
C A 0015 ALA N 3.006 C A 0013 ALA O
C A 0015 ALA N 2.198 C A 0014 ALA O
C A 0016 LEU N 2.310 C A 0012 PRO O
C A 0016 LEU N 3.021 C A 0013 ALA O
C A 0016 LEU N 2.197 C A 0015 ALA O
C A 0017 ALA N 2.509 C A 0013 ALA O
C A 0017 ALA N 2.197 C A 0016 LEU O
C A 0018 GLY N 2.847 C A 0014 ALA O
C A 0018 GLY N 2.206 C A 0017 ALA O
C A 0019 TYR N 2.299 C A 0017 ALA O
C A 0019 TYR N 2.219 C A 0018 GLY O
C A 0020 THR N 3.038 C A 0018 GLY O
C A 0020 THR N 2.192 C A 0019 TYR O
C A 0021 GLY N 2.216 C A 0020 THR O
C A 0022 SER N 2.354 C A 0020 THR O
C A 0022 SER N 2.199 C A 0021 GLY O
C A 0023 GLY N 2.792 C A 0021 GLY O
C A 0023 GLY N 2.207 C A 0022 SER O
C A 0024 PRO N 2.220 C A 0023 GLY O
C A 0025 ILE N 2.191 C A 0024 PRO O
C A 0026 GLN N 2.187 C A 0025 ILE O
H A 0027 LEU N 2.192 C A 0026 GLN O
H A 0028 TRP N 2.191 H A 0027 LEU O
H A 0029 GLN N 2.186 H A 0028 TRP O
H A 0030 PHE N 3.038 C A 0026 GLN O
H A 0030 PHE N 3.102 H A 0027 LEU O
H A 0030 PHE N 3.076 H A 0028 TRP O
H A 0030 PHE N 2.193 H A 0029 GLN O
H A 0031 LEU N 3.125 H A 0027 LEU O
H A 0031 LEU N 3.039 H A 0028 TRP O
H A 0031 LEU N 2.201 H A 0030 PHE O
H A 0032 LEU N 2.439 H A 0028 TRP O
H A 0032 LEU N 2.194 H A 0031 LEU O
H A 0033 GLU N 2.670 H A 0029 GLN O
H A 0033 GLU N 2.961 H A 0030 PHE O
H A 0033 GLU N 2.197 H A 0032 LEU O
H A 0034 LEU N 2.823 H A 0030 PHE O
H A 0034 LEU N 2.200 H A 0033 GLU O
H A 0035 LEU N 2.823 H A 0031 LEU O
H A 0035 LEU N 3.165 H A 0032 LEU O
H A 0035 LEU N 2.190 H A 0034 LEU O
H A 0036 THR N 2.197 H A 0035 LEU O
C A 0037 ASP N 2.547 H A 0035 LEU O
C A 0037 ASP N 2.210 H A 0036 THR O
C A 0038 LYS N 2.203 C A 0037 ASP O
H A 0039 SER N 2.189 C A 0038 LYS O
H A 0040 CYS N 2.208 H A 0039 SER O
H A 0041 GLN N 2.197 H A 0040 CYS O
C A 0042 SER N 2.198 H A 0041 GLN O
C A 0043 PHE N 2.199 C A 0042 SER O
C A 0044 ILE N 2.189 C A 0043 PHE O
E A 0045 SER N 2.209 C A 0044 ILE O
E A 0046 TRP N 2.208 E A 0045 SER O
E A 0047 THR N 2.189 E A 0046 TRP O
C A 0048 GLY N 2.201 E A 0047 THR O
C A 0049 ASP N 2.210 C A 0048 GLY O
C A 0050 GLY N 2.192 C A 0049 ASP O
C A 0051 TRP N 2.198 C A 0050 GLY O
E A 0052 GLU N 2.199 C A 0051 TRP O
E A 0053 PHE N 2.187 E A 0052 GLU O
E A 0054 LYS N 2.213 E A 0053 PHE O
C A 0055 LEU N 2.206 E A 0054 LYS O
C A 0055 LEU N 2.714 C A 0100 TYR O
C A 0056 SER N 2.196 C A 0055 LEU O
C A 0057 ASP N 2.200 C A 0056 SER O
C A 0058 PRO N 2.225 C A 0057 ASP O
H A 0059 ASP N 2.634 C A 0057 ASP O
H A 0059 ASP N 2.187 C A 0058 PRO O
H A 0060 GLU N 2.193 H A 0059 ASP O
H A 0061 VAL N 2.192 H A 0060 GLU O
H A 0062 ALA N 2.817 C A 0058 PRO O
H A 0062 ALA N 2.197 H A 0061 VAL O
H A 0063 ARG N 2.196 H A 0062 ALA O
H A 0064 ARG N 2.913 H A 0060 GLU O
H A 0064 ARG N 3.087 H A 0061 VAL O
H A 0064 ARG N 2.184 H A 0063 ARG O
H A 0065 TRP N 2.907 H A 0061 VAL O
H A 0065 TRP N 2.199 H A 0064 ARG O
H A 0066 GLY N 3.194 H A 0064 ARG O
H A 0066 GLY N 2.195 H A 0065 TRP O
H A 0067 LYS N 2.881 H A 0063 ARG O
H A 0067 LYS N 3.019 H A 0064 ARG O
H A 0067 LYS N 2.192 H A 0066 GLY O
C A 0068 ARG N 3.114 H A 0064 ARG O
C A 0068 ARG N 2.194 H A 0067 LYS O
C A 0069 LYS N 2.720 H A 0067 LYS O
C A 0069 LYS N 2.194 C A 0068 ARG O
C A 0070 ASN N 2.571 H A 0067 LYS O
C A 0070 ASN N 2.198 C A 0069 LYS O
C A 0071 LYS N 2.962 H A 0066 GLY O
C A 0071 LYS N 2.748 C A 0069 LYS O
C A 0071 LYS N 2.198 C A 0070 ASN O
C A 0072 PRO N 2.230 C A 0071 LYS O
C A 0073 LYS N 2.199 C A 0072 PRO O
C A 0074 MET N 2.201 C A 0073 LYS O
C A 0075 ASN N 2.196 C A 0074 MET O
H A 0076 TYR N 2.196 C A 0075 ASN O
H A 0077 GLU N 2.193 H A 0076 TYR O
H A 0078 LYS N 2.945 H A 0076 TYR O
H A 0078 LYS N 2.195 H A 0077 GLU O
H A 0079 LEU N 3.084 H A 0076 TYR O
H A 0079 LEU N 2.177 H A 0078 LYS O
H A 0080 SER N 3.123 H A 0077 GLU O
H A 0080 SER N 3.182 H A 0078 LYS O
H A 0080 SER N 2.172 H A 0079 LEU O
H A 0081 ARG N 2.911 H A 0077 GLU O
H A 0081 ARG N 2.423 H A 0078 LYS O
H A 0081 ARG N 2.698 H A 0079 LEU O
H A 0081 ARG N 2.202 H A 0080 SER O
H A 0082 GLY N 2.637 H A 0078 LYS O
H A 0082 GLY N 2.201 H A 0081 ARG O
H A 0083 LEU N 2.761 H A 0079 LEU O
H A 0083 LEU N 2.190 H A 0082 GLY O
H A 0084 ARG N 2.188 H A 0083 LEU O
H A 0085 TYR N 2.185 H A 0084 ARG O
C A 0086 TYR N 3.195 H A 0082 GLY O
C A 0086 TYR N 2.816 H A 0083 LEU O
C A 0086 TYR N 2.391 H A 0084 ARG O
C A 0086 TYR N 2.194 H A 0085 TYR O
C A 0087 TYR N 2.960 H A 0084 ARG O
C A 0087 TYR N 3.034 H A 0085 TYR O
C A 0087 TYR N 2.192 C A 0086 TYR O
C A 0088 ASP N 2.722 C A 0086 TYR O
C A 0088 ASP N 2.190 C A 0087 TYR O
C A 0089 LYS N 2.198 C A 0088 ASP O
C A 0090 ASN N 2.191 C A 0089 LYS O
C A 0091 ILE N 2.856 C A 0089 LYS O
C A 0091 ILE N 2.204 C A 0090 ASN O
E A 0092 ILE N 2.201 C A 0091 ILE O
E A 0093 HIS N 2.206 E A 0092 ILE O
E A 0094 LYS N 2.194 E A 0093 HIS O
C A 0095 THR N 2.197 E A 0094 LYS O
C A 0096 ALA N 2.207 C A 0095 THR O
C A 0097 GLY N 3.093 C A 0095 THR O
C A 0097 GLY N 2.193 C A 0096 ALA O
C A 0098 LYS N 2.203 C A 0097 GLY O
C A 0099 ARG N 2.198 C A 0098 LYS O
C A 0100 TYR N 2.193 C A 0099 ARG O
C A 0101 VAL N 2.202 C A 0100 TYR O
E A 0102 TYR N 2.777 E A 0053 PHE O
E A 0102 TYR N 2.201 C A 0101 VAL O
E A 0103 ARG N 2.189 E A 0102 TYR O
E A 0104 PHE N 2.204 E A 0103 ARG O
C A 0105 VAL N 3.182 C A 0091 ILE O
C A 0105 VAL N 2.209 E A 0104 PHE O
HB_MS 2.00 3.20 11
C A 0023 GLY O 2.679 C A 0019 TYR OH
C A 0025 ILE N 2.327 C A 0019 TYR OH
H A 0027 LEU N 2.383 C A 0026 GLN OE1
H A 0028 TRP N 2.611 C A 0026 GLN OE1
H A 0035 LEU O 2.904 E A 0046 TRP NE1
C A 0048 GLY N 3.004 E A 0047 THR OG1
C A 0049 ASP N 3.175 E A 0047 THR OG1
C A 0057 ASP N 2.930 C A 0056 SER OG
H A 0076 TYR O 3.154 H A 0080 SER OG
H A 0077 GLU O 2.376 H A 0080 SER OG
E A 0094 LYS N 3.165 C A 0087 TYR OH
HB_SS 2.00 3.20 3
C A 0026 GLN NE2 2.492 C A 0086 TYR OH
H A 0028 TRP NE1 2.982 C A 0026 GLN OE1
C A 0086 TYR OH 3.187 C A 0026 GLN OE1
AROMATIC 0.00 8.00 13
H A 0064 ARG 7.445 H A 0030 PHE
C A 0068 ARG 5.629 H A 0030 PHE
E A 0046 TRP 5.421 C A 0051 TRP
H A 0076 TYR 5.992 E A 0102 TYR
C A 0038 LYS 4.997 C A 0043 PHE
E A 0046 TRP 5.388 E A 0053 PHE
C A 0087 TYR 5.230 E A 0093 HIS
C A 0069 LYS 7.685 H A 0065 TRP
H A 0084 ARG 5.290 H A 0085 TYR
C A 0089 LYS 7.277 C A 0086 TYR
E A 0094 LYS 6.465 C A 0087 TYR
C A 0089 LYS 7.932 H A 0028 TRP
C A 0068 ARG 6.348 C A 0019 TYR