
      ##############################
      ##                          ##
      ##  Force Field Definition  ##
      ##                          ##
      ##############################


forcefield              CHARMM19

vdwtype                 LENNARD-JONES
radiusrule              ARITHMETIC
radiustype              R-MIN
radiussize              RADIUS
epsilonrule             GEOMETRIC
vdw-14-scale            1.0
chg-14-scale            1.0
dielectric              1.0


      #############################
      ##                         ##
      ##  Literature References  ##
      ##                         ##
      #############################


W. E. Reiher III, "Theoretical Studies of Hydrogen Bonding", Ph.D.
Thesis, Department of Chemistry, Harvard University, Cambridge, MA,
1985

L. Nilsson and M. Karplus, "Empirical Energy Functions for Energy
Minimizations and Dynamics of Nucleic Acids", J. Comput. Chem., 7,
591-616 (1986)

E. Neria, S. Fischer and M. Karplus, "Simulation of Activation Free
Energies in Molecular Systems", J. Chem. Phys., 105, 1902-1921 (1996)


      #############################
      ##                         ##
      ##  Atom Type Definitions  ##
      ##                         ##
      #############################


   ######################################################
   ##                                                  ##
   ##  TINKER Atom Class Numbers to CHARMM Atom Names  ##
   ##                                                  ##
   ##     1  H        7  CH3     13  NC2     19  S     ##
   ##     2  HC       8  CR1     14  NR      20  SH1   ##
   ##     3  HT       9  N       15  O                 ##
   ##     4  C       10  NH1     16  OC                ##
   ##     5  CH1     11  NH2     17  OH1               ##
   ##     6  CH2     12  NH3     18  OT                ##
   ##                                                  ##
   ######################################################


atom      1     1    H       "Amide CONHR Hydrogen"      1      1.008     1
atom      2     1    H       "Amide CONH2 Hydrogen"      1      1.008     1
atom      3     1    H       "HIP Imidazolium HN"        1      1.008     1
atom      4     1    H       "Hydroxyl Hydrogen"         1      1.008     1
atom      5     2    HC      "LYS/ARG/N-Term H"          1      1.008     1
atom      6     3    HT      "Modified TIP3P H"          1      1.008     1
atom      7     4    C       "Amide Carbon"              6     12.011     3
atom      8     4    C       "Carboxylate Carbon"        6     12.011     3
atom      9     4    C       "C-Terminal Carbon"         6     12.011     3
atom     10     4    C       "PHE CG/TYR CG"             6     12.011     3
atom     11     4    C       "TYR CZ Carbon"             6     12.011     3
atom     12     4    C       "TRP CG Carbon"             6     12.011     3
atom     13     4    C       "TRP CE2 Carbon"            6     12.011     3
atom     14     4    C       "HID CG/HIE CG"             6     12.011     3
atom     15     4    C       "HIP CG Carbon"             6     12.011     3
atom     16     4    C       "ARG CZ Carbon"             6     12.011     3
atom     17     5    CH1     "Aliphatic Methine"         6     13.019     3
atom     18     5    CH1     "Backbone CA Methine"       6     13.019     3
atom     19     5    CH1     "N-Term CA/THR CB"          6     13.019     3
atom     20     6    CH2     "Aliphatic Methylene"       6     14.027     2
atom     21     6    CH2     "MET CG Methylene"          6     14.027     2
atom     22     6    CH2     "GLY CA/PRO CD"             6     14.027     2
atom     23     6    CH2     "CYS CB Methylene"          6     14.027     2
atom     24     6    CH2     "SER CB/HIP CB/LYS CE"      6     14.027     2
atom     25     6    CH2     "ASP CB/GLU CB"             6     14.027     2
atom     26     7    CH3     "Aliphatic Methyl"          6     15.035     1
atom     27     7    CH3     "MET CE Methyl"             6     15.035     1
atom     28     7    CH3     "N-Me Amide Methyl"         6     15.035     1
atom     29     8    CR1     "Aromatic Methine"          6     13.019     2
atom     30     8    CR1     "TRP CE3 Methine"           6     13.019     2
atom     31     8    CR1     "TRP CD1 Methine"           6     13.019     2
atom     32     8    CR1     "HID CD2/HIE CD2"           6     13.019     2
atom     33     8    CR1     "HID CE1/HIE CE1"           6     13.019     2
atom     34     8    CR1     "HIP CD2 Methine"           6     13.019     2
atom     35     8    CR1     "HIP CE1 Methine"           6     13.019     2
atom     36     9    N       "PRO Nitrogen"              7     14.007     3
atom     37    10    NH1     "Amide NHR Nitrogen"        7     15.015     3
atom     38    10    NH1     "HIP ND1/HIP NE2"           7     15.015     3
atom     39    10    NH1     "TRP NE1 Nitrogen"          7     15.015     3
atom     40    10    NH1     "ARG NE/HIDE NH"            7     15.015     3
atom     41    11    NH2     "Amide NH2 Nitrogen"        7     16.023     3
atom     42    12    NH3     "Ammonium Nitrogen"         7     17.031     4
atom     43    12    NH3     "N-Terminal PRO N"          7     17.031     4
atom     44    13    NC2     "ARG NH2 Nitrogen"          7     16.023     3
atom     45    14    NR      "HID NE2/HIE ND1"           7     14.007     2
atom     46    15    O       "Amide Oxygen"              8     15.999     1
atom     47    16    OC      "Carboxylate Oxygen"        8     15.999     1
atom     48    16    OC      "C-Terminal Oxygen"         8     15.999     1
atom     49    17    OH1     "Hydroxyl Oxygen"           8     15.999     2
atom     50    18    OT      "Modified TIP3P O"          8     15.999     2
atom     51    19    S       "MET Sulfide Sulfur"       16     32.060     2
atom     52    19    S       "CYS Disulfide Sulfur"     16     32.060     2
atom     53    20    SH1     "CYS Thiol Sulfur"         16     33.068     1


      ################################
      ##                            ##
      ##  Van der Waals Parameters  ##
      ##                            ##
      ################################


vdw          1               0.800     0.0498
vdw          2               0.600     0.0498
vdw          3               0.800     0.0498
vdw          4               2.100     0.120
vdw          5               2.365     0.0486
vdw          6               2.235     0.1142
vdw          7               2.165     0.1811
vdw          8               2.100     0.120
vdw          9               1.600     0.2384
vdw         10               1.600     0.2384
vdw         11               1.600     0.2384
vdw         12               1.600     0.2384
vdw         13               1.600     0.2384
vdw         14               1.600     0.2384
vdw         15               1.600     0.1591
vdw         16               1.600     0.6469
vdw         17               1.600     0.1591
vdw         18               1.600     0.1591
vdw         19               1.890     0.043
vdw         20               1.890     0.043


      ####################################
      ##                                ##
      ##  1-4 Van der Waals Parameters  ##
      ##                                ##
      ####################################


vdw14        4               1.900     0.100
vdw14        5               1.900     0.100
vdw14        6               1.900     0.100
vdw14        7               1.900     0.100
vdw14        8               1.900     0.100


      #####################################
      ##                                 ##
      ##  Van der Waals Pair Parameters  ##
      ##                                 ##
      #####################################


vdwpr        3    3          0.449     0.04598
vdwpr        3   19        1.99275     0.08362
vdwpr       19   19         3.5365     0.152073


      ##################################
      ##                              ##
      ##  Bond Stretching Parameters  ##
      ##                              ##
      ##################################


bond         1   10          405.0     0.980
bond         1   11          405.0     0.980
bond         1   17          450.0     0.960
bond         2   10          405.0     0.980
bond         2   12          405.0     1.040
bond         2   13          405.0     1.000
bond         3   18          450.0     0.9572
bond         4    4          450.0     1.380
bond         4    5          405.0     1.520
bond         4    6          405.0     1.520
bond         4    7          405.0     1.520
bond         4    8          450.0     1.380
bond         4    9          471.0     1.330
bond         4   10          471.0     1.330
bond         4   11          471.0     1.330
bond         4   13          400.0     1.330
bond         4   14          471.0     1.330
bond         4   15          580.0     1.230
bond         4   16          580.0     1.230
bond         4   17          450.0     1.380
bond         5    5          225.0     1.530
bond         5    6          225.0     1.520
bond         5    7          225.0     1.520
bond         5    9          422.0     1.450
bond         5   10          422.0     1.450
bond         5   11          422.0     1.450
bond         5   12          422.0     1.450
bond         5   17          400.0     1.420
bond         6    6          225.0     1.520
bond         6    7          225.0     1.540
bond         6    8          250.0     1.450
bond         6    9          422.0     1.450
bond         6   10          422.0     1.450
bond         6   11          422.0     1.450
bond         6   12          422.0     1.450
bond         6   17          400.0     1.420
bond         6   19          450.0     1.810
bond         6   20          450.0     1.810
bond         7   10          422.0     1.490
bond         7   14          422.0     1.490
bond         7   19          450.0     1.770
bond         8    8          450.0     1.380
bond         8   10          450.0     1.305
bond         8   14          450.0     1.305
bond        16   19          400.0     1.430
bond        19   19          500.0     2.020


      ################################
      ##                            ##
      ##  Angle Bending Parameters  ##
      ##                            ##
      ################################


angle        4    4    4      70.0     106.5
angle        4    4    6      65.0     126.5
angle        4    4    7      65.0     126.5
angle        4    4    8      70.0     122.5
angle        4    4   10      65.0     109.0
angle        4    4   14      65.0     112.5
angle        4    4   15      65.0     119.0
angle        4    4   17      65.0     119.0
angle        5    4    9      20.0     117.5
angle        5    4   10      20.0     117.5
angle        5    4   15      85.0     121.5
angle        5    4   16      85.0     117.5
angle        5    4   17      85.0     120.0
angle        6    4    8      70.0     121.5
angle        6    4    9      20.0     117.5
angle        6    4   10      20.0     117.5
angle        6    4   11      20.0     117.5
angle        6    4   13      20.0     117.5
angle        6    4   14      60.0     116.0
angle        6    4   15      85.0     121.6
angle        6    4   16      85.0     118.5
angle        6    4   17      85.0     120.0
angle        7    4    9      20.0     117.5
angle        7    4   10      20.0     117.5
angle        7    4   15      85.0     121.5
angle        8    4    8      65.0     120.5
angle        8    4   10      65.0     110.5
angle        8    4   14      65.0     122.5
angle        8    4   17      65.0     119.0
angle        9    4   15      85.0     121.0
angle       10    4   14      70.0     120.0
angle       10    4   15      65.0     121.0
angle       11    4   15      65.0     121.0
angle       13    4   10      70.0     120.0
angle       13    4   13      70.0     120.0
angle       15    4   17      85.0     120.0
angle       16    4   16      85.0     122.5
angle        4    5    5      70.0     110.0
angle        4    5    6      70.0     109.5
angle        4    5    7      70.0     106.5
angle        4    5    9      45.0     111.6
angle        4    5   10      45.0     111.6
angle        4    5   11      45.0     111.6
angle        4    5   12      45.0     111.6
angle        5    5    6      45.0     112.5
angle        5    5    7      45.0     111.0
angle        5    5   10      50.0     110.0
angle        5    5   11      50.0     109.5
angle        5    5   12      50.0     107.5
angle        5    5   17      50.0     104.5
angle        6    5    7      50.0     111.5
angle        6    5    9      65.0     104.0
angle        6    5   10      65.0     110.0
angle        6    5   11      65.0     110.0
angle        6    5   12      65.0     110.0
angle        7    5    7      50.0     111.0
angle        7    5   10      65.0     108.5
angle        7    5   11      65.0     109.5
angle        7    5   12      65.0     109.5
angle        7    5   17      60.0     110.5
angle        4    6    5      70.0     112.5
angle        4    6    6      70.0     113.0
angle        4    6   10      70.0     111.6
angle        4    6   11      70.0     111.6
angle        4    6   12      70.0     111.6
angle        5    6    5      45.0     117.0
angle        5    6    6      45.0     112.5
angle        5    6    7      45.0     113.0
angle        5    6   17      45.0     111.0
angle        5    6   19      50.0     112.5
angle        5    6   20      50.0     112.5
angle        6    6    6      45.0     110.0
angle        6    6    7      45.0     111.0
angle        6    6    9      65.0     105.0
angle        6    6   10      65.0     111.0
angle        6    6   11      65.0     109.5
angle        6    6   12      65.0     110.5
angle        6    6   19      50.0     112.5
angle        7    6   17      45.0     111.0
angle        4    8    4      90.0     126.5
angle        4    8    6      90.0     122.0
angle        4    8    8      90.0     119.0
angle        4    8   10      90.0     109.5
angle        4    8   14      90.0     106.5
angle        8    8    8      90.0     120.5
angle       10    8   10      70.0     109.0
angle       10    8   14      70.0     109.0
angle        4    9    5      80.0     120.0
angle        4    9    6      80.0     120.0
angle        5    9    6      60.0     110.0
angle        5    9    7      60.0     110.0
angle        6    9    7      60.0     109.5
angle        4   10    1      30.0     120.0
angle        4   10    5      77.5     120.0
angle        4   10    6      77.5     120.0
angle        4   10    7      77.5     120.0
angle        4   10    8      60.0     108.0
angle        5   10    1      35.0     120.0
angle        5   10    7      60.0     120.0
angle        6   10    1      35.0     120.0
angle        6   10    7      60.0     120.0
angle        7   10    1      35.0     120.0
angle        8   10    1      35.0     120.0
angle        8   10    8      65.0     110.0
angle        1   11    1      40.0     125.0
angle        2   11    2      40.0     120.0
angle        4   11    1      30.0     120.0
angle        5   11    1      35.0     120.0
angle        5   11    6      60.0     120.0
angle        6   11    1      35.0     120.0
angle        2   12    2      40.0     109.5
angle        5   12    2      35.0     109.5
angle        5   12    6      35.0     109.5
angle        6   12    2      35.0     109.5
angle        2   13    2      40.0     120.0
angle        4   13    2      35.0     120.0
angle        4   14    4      70.0     102.5
angle        4   14    8      70.0     109.5
angle        7   14    4      70.0     109.5
angle        7   14    8      70.0     109.5
angle        8   14    8      65.0     110.0
angle        4   17    1      50.0     109.5
angle        5   17    1      35.0     109.5
angle        6   17    1      35.0     109.5
angle        3   18    3      55.0     104.52
angle        6   19    7      50.0      99.5
angle        6   19   19      50.0     104.2
angle       16   19   16      85.0     109.5


      ####################################
      ##                                ##
      ##  Improper Dihedral Parameters  ##
      ##                                ##
      ####################################


improper     4    5    9   15          100.00       0.00
improper     4    5   10   15          100.00       0.00
improper     4    6    9   15          100.00       0.00
improper     4    6   10   15          100.00       0.00
improper     4    7    9   15          100.00       0.00
improper     4    7   10   15          100.00       0.00
improper     4    8    4    6           90.00       0.00
improper     4    8    8    6           90.00       0.00
improper     4    8    8   17          150.00       0.00
improper     4   10    8    6           90.00       0.00
improper     4   13   13   10          100.00       0.00
improper     4   14    8    6           90.00       0.00
improper     4   15   11    6           90.00       0.00
improper     4   16   16    5          100.00       0.00
improper     4   16   16    6          100.00       0.00
improper     5    6    7    5           55.00      35.26439
improper     5    7    7    5           55.00      35.26439
improper     5    7    7    6           55.00      35.26439
improper     5    9    4    6           55.00      35.26439
improper     5   10    4    5           55.00      35.26439
improper     5   10    4    6           55.00      35.26439
improper     5   10    4    7           55.00      35.26439
improper     5   17    7    5           55.00      35.26439
improper     9    5    6    4           45.00       0.00
improper    10    4    5    1           45.00       0.00
improper    10    4    6    1           45.00       0.00
improper    10    4    7    1           45.00       0.00
improper    10    8    4    1           45.00       0.00
improper    10    8    8    1           45.00       0.00
improper    11    1    1    4           45.00       0.00
improper    13    4    2    2           45.00       0.00


   ##########################################################
   ##                                                      ##
   ##  The following improper dihedral parameters are to   ##
   ##  replace the CHARMM19 improper dihedrals for TRP at  ##
   ##  CD2 and CE2 which do not involve directly bonded    ##
   ##  atoms in the authentic CHARMM19 parameter set       ##
   ##                                                      ##
   ##########################################################


improper     4    4    4    8           90.00       0.00
improper     4   10    4    8           90.00       0.00


      ############################
      ##                        ##
      ##  Torsional Parameters  ##
      ##                        ##
      ############################


   ############################################################
   ##                                                        ##
   ##  All torsional parameters have been reduced as needed  ##
   ##  to account for degeneracy; authentic CHARMM19 uses    ##
   ##  at most one torsion across each pair of bonded atoms  ##
   ##  while TINKER has a torsion for each four atom set     ##
   ##  across a bond; for example, the generic CHARMM19      ##
   ##  parameter between two trigonal atoms is reduced by a  ##
   ##  factor of (3-1)x(3-1)=4 for use with the TINKER code  ##
   ##                                                        ##
   ############################################################


torsion      4    4    4    6          0.000  180.0  2
torsion      4    4    4    8          2.500  180.0  2
torsion      4    4    4   10          0.000  180.0  2
torsion      6    4    4    8          0.000  180.0  2
torsion      8    4    4    8          5.000  180.0  2
torsion      8    4    4   10          2.500  180.0  2
torsion      9    4    5    5          0.000    0.0  3
torsion      9    4    5    6          0.000    0.0  3
torsion      9    4    5    7          0.000    0.0  3
torsion      9    4    5    9          0.000    0.0  3
torsion      9    4    5   10          0.000    0.0  3
torsion      9    4    5   12          0.000    0.0  3
torsion     10    4    5    5          0.000    0.0  3
torsion     10    4    5    6          0.000    0.0  3
torsion     10    4    5    7          0.000    0.0  3
torsion     10    4    5    9          0.000    0.0  3
torsion     10    4    5   10          0.000    0.0  3
torsion     10    4    5   12          0.000    0.0  3
torsion     15    4    5    5          0.000    0.0  3
torsion     15    4    5    6          0.000    0.0  3
torsion     15    4    5    7          0.000    0.0  3
torsion     15    4    5    9          0.000    0.0  3
torsion     15    4    5   10          0.000    0.0  3
torsion     15    4    5   12          0.000    0.0  3
torsion     16    4    5    5          0.000    0.0  3
torsion     16    4    5    6          0.000    0.0  3
torsion     16    4    5    7          0.000    0.0  3
torsion     16    4    5    9          0.000    0.0  3
torsion     16    4    5   10          0.000    0.0  3
torsion      4    4    6    5          0.000    0.0  3
torsion      8    4    6    5          0.000    0.0  3
torsion      9    4    6   10          0.000    0.0  3
torsion     10    4    6    5          0.000    0.0  3
torsion     10    4    6   10          0.000    0.0  3
torsion     10    4    6   12          0.000    0.0  3
torsion     11    4    6    5          0.000    0.0  3
torsion     11    4    6    6          0.000    0.0  3
torsion     14    4    6    5          0.000    0.0  3
torsion     15    4    6    5          0.000    0.0  3
torsion     15    4    6    6          0.000    0.0  3
torsion     15    4    6   10          0.000    0.0  3
torsion     15    4    6   12          0.000    0.0  3
torsion     16    4    6    5          0.000    0.0  3
torsion     16    4    6    6          0.000    0.0  3
torsion     16    4    6   10          0.000    0.0  3
torsion      4    4    8    8          5.000  180.0  2
torsion      4    4    8   10          5.000  180.0  2
torsion      6    4    8    8          5.000  180.0  2
torsion      6    4    8   10          5.000  180.0  2
torsion      6    4    8   14          5.000  180.0  2
torsion      8    4    8    8          5.000  180.0  2
torsion     10    4    8    8          5.000  180.0  2
torsion     10    4    8   10          5.000  180.0  2
torsion     10    4    8   14          5.000  180.0  2
torsion     14    4    8   10          5.000  180.0  2
torsion     17    4    8    8          5.000  180.0  2
torsion      5    4    9    5          2.500  180.0  2
torsion      5    4    9    6          2.500  180.0  2
torsion      6    4    9    5          2.500  180.0  2
torsion      6    4    9    6          2.500  180.0  2
torsion      7    4    9    5          2.050  180.0  2
torsion      7    4    9    6          2.050  180.0  2
torsion     15    4    9    5          2.050  180.0  2
torsion     15    4    9    6          2.050  180.0  2
torsion      4    4   10    1          2.050  180.0  2
torsion      4    4   10    8          2.050  180.0  2
torsion      5    4   10    1          2.050  180.0  2
torsion      5    4   10    5          2.050  180.0  2
torsion      5    4   10    6          2.050  180.0  2
torsion      5    4   10    7          2.050  180.0  2
torsion      6    4   10    1          2.050  180.0  2
torsion      6    4   10    5          2.050  180.0  2
torsion      6    4   10    6          2.050  180.0  2
torsion      6    4   10    7          2.050  180.0  2
torsion      6    4   10    8          2.050  180.0  2
torsion      7    4   10    1          2.050  180.0  2
torsion      7    4   10    5          2.050  180.0  2
torsion      7    4   10    6          2.050  180.0  2
torsion      8    4   10    1          2.050  180.0  2
torsion      8    4   10    8          2.050  180.0  2
torsion     13    4   10    1          2.050  180.0  2
torsion     13    4   10    6          2.050  180.0  2
torsion     15    4   10    1          2.050  180.0  2
torsion     15    4   10    5          2.050  180.0  2
torsion     15    4   10    6          2.050  180.0  2
torsion     15    4   10    7          2.050  180.0  2
torsion      6    4   11    1          2.050  180.0  2
torsion     15    4   11    1          2.050  180.0  2
torsion     10    4   13    2          2.050  180.0  2
torsion     13    4   13    2          2.050  180.0  2
torsion      6    4   14    8          0.000  180.0  2
torsion      8    4   14    8          0.000  180.0  2
torsion      8    4   17    1          0.900  180.0  2
torsion      4    5    5    6          0.400    0.0  3
torsion      4    5    5    7          0.400    0.0  3
torsion      4    5    5   17          0.400    0.0  3
torsion      6    5    5   10          0.400    0.0  3
torsion      6    5    5   12          0.400    0.0  3
torsion      7    5    5   10          0.400    0.0  3
torsion      7    5    5   12          0.400    0.0  3
torsion     10    5    5   17          0.400    0.0  3
torsion     12    5    5   17          0.400    0.0  3
torsion      4    5    6    4          0.800    0.0  3
torsion      4    5    6    5          0.800    0.0  3
torsion      4    5    6    6          0.800    0.0  3
torsion      4    5    6   17          0.800    0.0  3
torsion      4    5    6   19          0.800    0.0  3
torsion      4    5    6   20          0.800    0.0  3
torsion      5    5    6    7          0.800    0.0  3
torsion      7    5    6    5          0.800    0.0  3
torsion      7    5    6    7          0.800    0.0  3
torsion      9    5    6    6          0.800    0.0  3
torsion     10    5    6    4          0.800    0.0  3
torsion     10    5    6    5          0.800    0.0  3
torsion     10    5    6    6          0.800    0.0  3
torsion     10    5    6   17          0.800    0.0  3
torsion     10    5    6   19          0.800    0.0  3
torsion     10    5    6   20          0.800    0.0  3
torsion     12    5    6    4          0.800    0.0  3
torsion     12    5    6    5          0.800    0.0  3
torsion     12    5    6    6          0.800    0.0  3
torsion     12    5    6   17          0.800    0.0  3
torsion     12    5    6   20          0.800    0.0  3
torsion      4    5    9    4          0.075    0.0  3
torsion      4    5    9    6          0.075    0.0  3
torsion      6    5    9    4          0.075    0.0  3
torsion      6    5    9    6          0.075    0.0  3
torsion      4    5   10    1          0.075    0.0  3
torsion      4    5   10    4          0.075    0.0  3
torsion      5    5   10    1          0.075    0.0  3
torsion      5    5   10    4          0.075    0.0  3
torsion      6    5   10    1          0.075    0.0  3
torsion      6    5   10    4          0.075    0.0  3
torsion      7    5   10    1          0.075    0.0  3
torsion      7    5   10    4          0.075    0.0  3
torsion      4    5   12    2          0.100    0.0  3
torsion      4    5   12    6          0.100    0.0  3
torsion      5    5   12    2          0.100    0.0  3
torsion      6    5   12    2          0.100    0.0  3
torsion      6    5   12    6          0.100    0.0  3
torsion      7    5   12    2          0.100    0.0  3
torsion      5    5   17    1          0.250    0.0  3
torsion      7    5   17    1          0.250    0.0  3
torsion      5    6   17    1          0.500    0.0  3
torsion      4    6    6    5          1.600    0.0  3
torsion      5    6    6    6          1.600    0.0  3
torsion      5    6    6   19          1.600    0.0  3
torsion      6    6    6    6          1.600    0.0  3
torsion      6    6    6    9          1.600    0.0  3
torsion      6    6    6   10          1.600    0.0  3
torsion      6    6    6   12          1.600    0.0  3
torsion      6    6    9    4          0.150    0.0  3
torsion      6    6    9    5          0.150    0.0  3
torsion      4    6   10    1          0.150    0.0  3
torsion      4    6   10    4          0.150    0.0  3
torsion      6    6   10    1          0.150    0.0  3
torsion      6    6   10    4          0.150    0.0  3
torsion      4    6   12    2          0.200    0.0  3
torsion      6    6   12    2          0.200    0.0  3
torsion      6    6   12    5          0.200    0.0  3
torsion      5    6   19   19          1.200    0.0  2
torsion      6    6   19    7          1.200    0.0  2
torsion      6   19   19    6          4.000    0.0  2


   #############################################################
   ##                                                         ##
   ##  The following torsional parameters involving aromatic  ##
   ##  carbons are all set to zero in the authentic CHARMM19  ##
   ##  parameter set, but are set to large 2-fold barriers    ##
   ##  to replace improper dihedrals that do not involve      ##
   ##  the three atoms bonded to a trigonal center and thus   ##
   ##  cannot be handled by the TINKER improper formulation   ##
   ##                                                         ##
   #############################################################


torsion      4    8    8    4         10.000  180.0  2
torsion      4    8    8    8         10.000  180.0  2
torsion      8    8    8    8         10.000  180.0  2
torsion      4    8   10    1          4.100  180.0  2
torsion      4    8   10    4          4.100  180.0  2
torsion      4    8   10    8          4.100  180.0  2
torsion     10    8   10    1          4.100  180.0  2
torsion     10    8   10    4          4.100  180.0  2
torsion     10    8   10    8          4.100  180.0  2
torsion     14    8   10    1          4.100  180.0  2
torsion     14    8   10    4          4.100  180.0  2
torsion     14    8   10    8          4.100  180.0  2
torsion      4    8   14    8          8.200  180.0  2
torsion     10    8   14    4          8.200  180.0  2
torsion     10    8   14    8          8.200  180.0  2


      ########################################
      ##                                    ##
      ##  Atomic Partial Charge Parameters  ##
      ##                                    ##
      ########################################


charge       1         0.250
charge       2         0.300
charge       3         0.350
charge       4         0.400
charge       5         0.350
charge       6         0.417
charge       7         0.550
charge       8         0.360
charge       9         0.140
charge      10         0.000
charge      11         0.250
charge      12        -0.030
charge      13        -0.040
charge      14         0.100
charge      15         0.150
charge      16         0.500
charge      17         0.000
charge      18         0.100
charge      19         0.250
charge      20         0.000
charge      21         0.060
charge      22         0.100
charge      23         0.190
charge      24         0.250
charge      25        -0.160
charge      26         0.000
charge      27         0.060
charge      28         0.100
charge      29         0.000
charge      30        -0.030
charge      31         0.060
charge      32         0.100
charge      33         0.300
charge      34         0.200
charge      35         0.450
charge      36        -0.200
charge      37        -0.350
charge      38        -0.300
charge      39        -0.360
charge      40        -0.400
charge      41        -0.600
charge      42        -0.300
charge      43        -0.200
charge      44        -0.450
charge      45        -0.400
charge      46        -0.550
charge      47        -0.600
charge      48        -0.570
charge      49        -0.650
charge      50        -0.834
charge      51        -0.120
charge      52        -0.190
charge      53        -0.190


      ########################################
      ##                                    ##
      ##  Biopolymer Atom Type Conversions  ##
      ##                                    ##
      ########################################


biotype      1    N       "Glycine"                  37
biotype      2    CA      "Glycine"                  22
biotype      3    C       "Glycine"                   7
biotype      4    HN      "Glycine"                   1
biotype      5    O       "Glycine"                  46
biotype      6    HA      "Glycine"                   0
biotype      7    N       "Alanine"                  37
biotype      8    CA      "Alanine"                  18
biotype      9    C       "Alanine"                   7
biotype     10    HN      "Alanine"                   1
biotype     11    O       "Alanine"                  46
biotype     12    HA      "Alanine"                   0
biotype     13    CB      "Alanine"                  26
biotype     14    HB      "Alanine"                   0
biotype     15    N       "Valine"                   37
biotype     16    CA      "Valine"                   18
biotype     17    C       "Valine"                    7
biotype     18    HN      "Valine"                    1
biotype     19    O       "Valine"                   46
biotype     20    HA      "Valine"                    0
biotype     21    CB      "Valine"                   17
biotype     22    HB      "Valine"                    0
biotype     23    CG1     "Valine"                   26
biotype     24    HG1     "Valine"                    0
biotype     25    CG2     "Valine"                   26
biotype     26    HG2     "Valine"                    0
biotype     27    N       "Leucine"                  37
biotype     28    CA      "Leucine"                  18
biotype     29    C       "Leucine"                   7
biotype     30    HN      "Leucine"                   1
biotype     31    O       "Leucine"                  46
biotype     32    HA      "Leucine"                   0
biotype     33    CB      "Leucine"                  20
biotype     34    HB      "Leucine"                   0
biotype     35    CG      "Leucine"                  17
biotype     36    HG      "Leucine"                   0
biotype     37    CD1     "Leucine"                  26
biotype     38    HD1     "Leucine"                   0
biotype     39    CD2     "Leucine"                  26
biotype     40    HD2     "Leucine"                   0
biotype     41    N       "Isoleucine"               37
biotype     42    CA      "Isoleucine"               18
biotype     43    C       "Isoleucine"                7
biotype     44    HN      "Isoleucine"                1
biotype     45    O       "Isoleucine"               46
biotype     46    HA      "Isoleucine"                0
biotype     47    CB      "Isoleucine"               17
biotype     48    HB      "Isoleucine"                0
biotype     49    CG1     "Isoleucine"               20
biotype     50    HG1     "Isoleucine"                0
biotype     51    CG2     "Isoleucine"               26
biotype     52    HG2     "Isoleucine"                0
biotype     53    CD      "Isoleucine"               26
biotype     54    HD      "Isoleucine"                0
biotype     55    N       "Serine"                   37
biotype     56    CA      "Serine"                   18
biotype     57    C       "Serine"                    7
biotype     58    HN      "Serine"                    1
biotype     59    O       "Serine"                   46
biotype     60    HA      "Serine"                    0
biotype     61    CB      "Serine"                   24
biotype     62    HB      "Serine"                    0
biotype     63    OG      "Serine"                   49
biotype     64    HG      "Serine"                    4
biotype     65    N       "Threonine"                37
biotype     66    CA      "Threonine"                18
biotype     67    C       "Threonine"                 7
biotype     68    HN      "Threonine"                 1
biotype     69    O       "Threonine"                46
biotype     70    HA      "Threonine"                 0
biotype     71    CB      "Threonine"                19
biotype     72    HB      "Threonine"                 0
biotype     73    OG1     "Threonine"                49
biotype     74    HG1     "Threonine"                 4
biotype     75    CG2     "Threonine"                26
biotype     76    HG2     "Threonine"                 0
biotype     77    N       "Cysteine (-SH)"           37
biotype     78    CA      "Cysteine (-SH)"           18
biotype     79    C       "Cysteine (-SH)"            7
biotype     80    HN      "Cysteine (-SH)"            1
biotype     81    O       "Cysteine (-SH)"           46
biotype     82    HA      "Cysteine (-SH)"            0
biotype     83    CB      "Cysteine (-SH)"           23
biotype     84    HB      "Cysteine (-SH)"            0
biotype     85    SG      "Cysteine (-SH)"           53
biotype     86    HG      "Cysteine (-SH)"            0
biotype     87    N       "Cystine (-SS-)"           37
biotype     88    CA      "Cystine (-SS-)"           18
biotype     89    C       "Cystine (-SS-)"            7
biotype     90    HN      "Cystine (-SS-)"            1
biotype     91    O       "Cystine (-SS-)"           46
biotype     92    HA      "Cystine (-SS-)"            0
biotype     93    CB      "Cystine (-SS-)"           23
biotype     94    HB      "Cystine (-SS-)"            0
biotype     95    SG      "Cystine (-SS-)"           52
biotype     96    N       "Proline"                  36
biotype     97    CA      "Proline"                  18
biotype     98    C       "Proline"                   7
biotype     99    O       "Proline"                  46
biotype    100    HA      "Proline"                   0
biotype    101    CB      "Proline"                  20
biotype    102    HB      "Proline"                   0
biotype    103    CG      "Proline"                  20
biotype    104    HG      "Proline"                   0
biotype    105    CD      "Proline"                  22
biotype    106    HD      "Proline"                   0
biotype    107    N       "Phenylalanine"            37
biotype    108    CA      "Phenylalanine"            18
biotype    109    C       "Phenylalanine"             7
biotype    110    HN      "Phenylalanine"             1
biotype    111    O       "Phenylalanine"            46
biotype    112    HA      "Phenylalanine"             0
biotype    113    CB      "Phenylalanine"            20
biotype    114    HB      "Phenylalanine"             0
biotype    115    CG      "Phenylalanine"            10
biotype    116    CD      "Phenylalanine"            29
biotype    117    HD      "Phenylalanine"             0
biotype    118    CE      "Phenylalanine"            29
biotype    119    HE      "Phenylalanine"             0
biotype    120    CZ      "Phenylalanine"            29
biotype    121    HZ      "Phenylalanine"             0
biotype    122    N       "Tyrosine"                 37
biotype    123    CA      "Tyrosine"                 18
biotype    124    C       "Tyrosine"                  7
biotype    125    HN      "Tyrosine"                  1
biotype    126    O       "Tyrosine"                 46
biotype    127    HA      "Tyrosine"                  0
biotype    128    CB      "Tyrosine"                 20
biotype    129    HB      "Tyrosine"                  0
biotype    130    CG      "Tyrosine"                 10
biotype    131    CD      "Tyrosine"                 29
biotype    132    HD      "Tyrosine"                  0
biotype    133    CE      "Tyrosine"                 29
biotype    134    HE      "Tyrosine"                  0
biotype    135    CZ      "Tyrosine"                 11
biotype    136    OH      "Tyrosine"                 49
biotype    137    HH      "Tyrosine"                  4
biotype    138    N       "Tryptophan"               37
biotype    139    CA      "Tryptophan"               18
biotype    140    C       "Tryptophan"                7
biotype    141    HN      "Tryptophan"                1
biotype    142    O       "Tryptophan"               46
biotype    143    HA      "Tryptophan"                0
biotype    144    CB      "Tryptophan"               20
biotype    145    HB      "Tryptophan"                0
biotype    146    CG      "Tryptophan"               12
biotype    147    CD1     "Tryptophan"               31
biotype    148    HD1     "Tryptophan"                0
biotype    149    CD2     "Tryptophan"               14
biotype    150    NE1     "Tryptophan"               39
biotype    151    HE1     "Tryptophan"                2
biotype    152    CE2     "Tryptophan"               13
biotype    153    CE3     "Tryptophan"               30
biotype    154    HE3     "Tryptophan"                0
biotype    155    CZ2     "Tryptophan"               29
biotype    156    HZ2     "Tryptophan"                0
biotype    157    CZ3     "Tryptophan"               29
biotype    158    HZ3     "Tryptophan"                0
biotype    159    CH2     "Tryptophan"               29
biotype    160    HH2     "Tryptophan"                0
biotype    161    N       "Histidine (+)"            37
biotype    162    CA      "Histidine (+)"            18
biotype    163    C       "Histidine (+)"             7
biotype    164    HN      "Histidine (+)"             1
biotype    165    O       "Histidine (+)"            46
biotype    166    HA      "Histidine (+)"             0
biotype    167    CB      "Histidine (+)"            22
biotype    168    HB      "Histidine (+)"             0
biotype    169    CG      "Histidine (+)"            15
biotype    170    ND1     "Histidine (+)"            38
biotype    171    HD1     "Histidine (+)"             3
biotype    172    CD2     "Histidine (+)"            34
biotype    173    HD2     "Histidine (+)"             0
biotype    174    CE1     "Histidine (+)"            35
biotype    175    HE1     "Histidine (+)"             0
biotype    176    NE2     "Histidine (+)"            38
biotype    177    HE2     "Histidine (+)"             3
biotype    178    N       "Histidine (HD)"           37
biotype    179    CA      "Histidine (HD)"           18
biotype    180    C       "Histidine (HD)"            7
biotype    181    HN      "Histidine (HD)"            1
biotype    182    O       "Histidine (HD)"           46
biotype    183    HA      "Histidine (HD)"            0
biotype    184    CB      "Histidine (HD)"           20
biotype    185    HB      "Histidine (HD)"            0
biotype    186    CG      "Histidine (HD)"           14
biotype    187    ND1     "Histidine (HD)"           40
biotype    188    HD1     "Histidine (HD)"            2
biotype    189    CD2     "Histidine (HD)"           32
biotype    190    HD2     "Histidine (HD)"            0
biotype    191    CE1     "Histidine (HD)"           33
biotype    192    HE1     "Histidine (HD)"            0
biotype    193    NE2     "Histidine (HD)"           45
biotype    194    N       "Histidine (HE)"           37
biotype    195    CA      "Histidine (HE)"           18
biotype    196    C       "Histidine (HE)"            7
biotype    197    HN      "Histidine (HE)"            1
biotype    198    O       "Histidine (HE)"           46
biotype    199    HA      "Histidine (HE)"            0
biotype    200    CB      "Histidine (HE)"           20
biotype    201    HB      "Histidine (HE)"            0
biotype    202    CG      "Histidine (HE)"           14
biotype    203    ND1     "Histidine (HE)"           45
biotype    204    CD2     "Histidine (HE)"           32
biotype    205    HD2     "Histidine (HE)"            0
biotype    206    CE1     "Histidine (HE)"           33
biotype    207    HE1     "Histidine (HE)"            0
biotype    208    NE2     "Histidine (HE)"           40
biotype    209    HE2     "Histidine (HE)"            2
biotype    210    N       "Aspartic Acid"            37
biotype    211    CA      "Aspartic Acid"            18
biotype    212    C       "Aspartic Acid"             7
biotype    213    HN      "Aspartic Acid"             1
biotype    214    O       "Aspartic Acid"            46
biotype    215    HA      "Aspartic Acid"             0
biotype    216    CB      "Aspartic Acid"            25
biotype    217    HB      "Aspartic Acid"             0
biotype    218    CG      "Aspartic Acid"             8
biotype    219    OD      "Aspartic Acid"            47
biotype    220    N       "Asparagine"               37
biotype    221    CA      "Asparagine"               18
biotype    222    C       "Asparagine"                7
biotype    223    HN      "Asparagine"                1
biotype    224    O       "Asparagine"               46
biotype    225    HA      "Asparagine"                0
biotype    226    CB      "Asparagine"               20
biotype    227    HB      "Asparagine"                0
biotype    228    CG      "Asparagine"                7
biotype    229    OD1     "Asparagine"               46
biotype    230    ND2     "Asparagine"               41
biotype    231    HD2     "Asparagine"                2
biotype    232    N       "Glutamic Acid"            37
biotype    233    CA      "Glutamic Acid"            18
biotype    234    C       "Glutamic Acid"             7
biotype    235    HN      "Glutamic Acid"             1
biotype    236    O       "Glutamic Acid"            46
biotype    237    HA      "Glutamic Acid"             0
biotype    238    CB      "Glutamic Acid"            20
biotype    239    HB      "Glutamic Acid"             0
biotype    240    CG      "Glutamic Acid"            25
biotype    241    HG      "Glutamic Acid"             0
biotype    242    CD      "Glutamic Acid"             8
biotype    243    OE      "Glutamic Acid"            47
biotype    244    N       "Glutamine"                37
biotype    245    CA      "Glutamine"                18
biotype    246    C       "Glutamine"                 7
biotype    247    HN      "Glutamine"                 1
biotype    248    O       "Glutamine"                46
biotype    249    HA      "Glutamine"                 0
biotype    250    CB      "Glutamine"                20
biotype    251    HB      "Glutamine"                 0
biotype    252    CG      "Glutamine"                20
biotype    253    HG      "Glutamine"                 0
biotype    254    CD      "Glutamine"                 7
biotype    255    OE1     "Glutamine"                46
biotype    256    NE2     "Glutamine"                41
biotype    257    HE2     "Glutamine"                 2
biotype    258    N       "Methionine"               37
biotype    259    CA      "Methionine"               18
biotype    260    C       "Methionine"                7
biotype    261    HN      "Methionine"                1
biotype    262    O       "Methionine"               46
biotype    263    HA      "Methionine"                0
biotype    264    CB      "Methionine"               20
biotype    265    HB      "Methionine"                0
biotype    266    CG      "Methionine"               21
biotype    267    HG      "Methionine"                0
biotype    268    SD      "Methionine"               51
biotype    269    CE      "Methionine"               27
biotype    270    HE      "Methionine"                0
biotype    271    N       "Lysine"                   37
biotype    272    CA      "Lysine"                   18
biotype    273    C       "Lysine"                    7
biotype    274    HN      "Lysine"                    1
biotype    275    O       "Lysine"                   46
biotype    276    HA      "Lysine"                    0
biotype    277    CB      "Lysine"                   20
biotype    278    HB      "Lysine"                    0
biotype    279    CG      "Lysine"                   20
biotype    280    HG      "Lysine"                    0
biotype    281    CD      "Lysine"                   20
biotype    282    HD      "Lysine"                    0
biotype    283    CE      "Lysine"                   24
biotype    284    HE      "Lysine"                    0
biotype    285    NZ      "Lysine"                   42
biotype    286    HZ      "Lysine"                    5
biotype    287    N       "Arginine"                 37
biotype    288    CA      "Arginine"                 18
biotype    289    C       "Arginine"                  7
biotype    290    HN      "Arginine"                  1
biotype    291    O       "Arginine"                 46
biotype    292    HA      "Arginine"                  0
biotype    293    CB      "Arginine"                 20
biotype    294    HB      "Arginine"                  0
biotype    295    CG      "Arginine"                 20
biotype    296    HG      "Arginine"                  0
biotype    297    CD      "Arginine"                 22
biotype    298    HD      "Arginine"                  0
biotype    299    NE      "Arginine"                 40
biotype    300    HE      "Arginine"                  2
biotype    301    CZ      "Arginine"                 16
biotype    302    NH      "Arginine"                 44
biotype    303    HH      "Arginine"                  5
biotype    304    N       "Ornithine"                37
biotype    305    CA      "Ornithine"                18
biotype    306    C       "Ornithine"                 7
biotype    307    HN      "Ornithine"                 1
biotype    308    O       "Ornithine"                46
biotype    309    HA      "Ornithine"                 0
biotype    310    CB      "Ornithine"                20
biotype    311    HB      "Ornithine"                 0
biotype    312    CG      "Ornithine"                20
biotype    313    HG      "Ornithine"                 0
biotype    314    CD      "Ornithine"                24
biotype    315    HD      "Ornithine"                 0
biotype    316    NE      "Ornithine"                42
biotype    317    HE      "Ornithine"                 5
biotype    318    N       "MethylAlanine (AIB)"     999
biotype    319    CA      "MethylAlanine (AIB)"     999
biotype    320    C       "MethylAlanine (AIB)"     999
biotype    321    HN      "MethylAlanine (AIB)"     999
biotype    322    O       "MethylAlanine (AIB)"     999
biotype    323    CB      "MethylAlanine (AIB)"     999
biotype    324    HB      "MethylAlanine (AIB)"       0
biotype    325    N       "Pyroglutamic Acid"       999
biotype    326    CA      "Pyroglutamic Acid"       999
biotype    327    C       "Pyroglutamic Acid"       999
biotype    328    HN      "Pyroglutamic Acid"       999
biotype    329    O       "Pyroglutamic Acid"       999
biotype    330    HA      "Pyroglutamic Acid"         0
biotype    331    CB      "Pyroglutamic Acid"       999
biotype    332    HB      "Pyroglutamic Acid"         0
biotype    333    CG      "Pyroglutamic Acid"       999
biotype    334    HG      "Pyroglutamic Acid"         0
biotype    335    CD      "Pyroglutamic Acid"       999
biotype    336    OE      "Pyroglutamic Acid"       999
biotype    337    C       "Formyl N-Terminus"         7
biotype    338    H       "Formyl N-Terminus"         0
biotype    339    O       "Formyl N-Terminus"        46
biotype    340    CH3     "Acetyl N-Terminus"        26
biotype    341    H       "Acetyl N-Terminus"         0
biotype    342    C       "Acetyl N-Terminus"         7
biotype    343    O       "Acetyl N-Terminus"        46
biotype    344    N       "Amide C-Terminus"         41
biotype    345    HN      "Amide C-Terminus"          2
biotype    346    N       "N-MeAmide C-Terminus"     37
biotype    347    HN      "N-MeAmide C-Terminus"      1
biotype    348    CH3     "N-MeAmide C-Terminus"     28
biotype    349    H       "N-MeAmide C-Terminus"      0
biotype    350    N       "N-Terminal GLY"           42
biotype    351    CA      "N-Terminal GLY"           24
biotype    352    C       "N-Terminal GLY"            7
biotype    353    HN      "N-Terminal GLY"            5
biotype    354    O       "N-Terminal GLY"           46
biotype    355    HA      "N-Terminal GLY"            0
biotype    356    N       "N-Terminal ALA"           42
biotype    357    CA      "N-Terminal ALA"           19
biotype    358    C       "N-Terminal ALA"            7
biotype    359    HN      "N-Terminal ALA"            5
biotype    360    O       "N-Terminal ALA"           46
biotype    361    HA      "N-Terminal ALA"            0
biotype    362    N       "N-Terminal VAL"           42
biotype    363    CA      "N-Terminal VAL"           19
biotype    364    C       "N-Terminal VAL"            7
biotype    365    HN      "N-Terminal VAL"            5
biotype    366    O       "N-Terminal VAL"           46
biotype    367    HA      "N-Terminal VAL"            0
biotype    368    N       "N-Terminal LEU"           42
biotype    369    CA      "N-Terminal LEU"           19
biotype    370    C       "N-Terminal LEU"            7
biotype    371    HN      "N-Terminal LEU"            5
biotype    372    O       "N-Terminal LEU"           46
biotype    373    HA      "N-Terminal LEU"            0
biotype    374    N       "N-Terminal ILE"           42
biotype    375    CA      "N-Terminal ILE"           19
biotype    376    C       "N-Terminal ILE"            7
biotype    377    HN      "N-Terminal ILE"            5
biotype    378    O       "N-Terminal ILE"           46
biotype    379    HA      "N-Terminal ILE"            0
biotype    380    N       "N-Terminal SER"           42
biotype    381    CA      "N-Terminal SER"           19
biotype    382    C       "N-Terminal SER"            7
biotype    383    HN      "N-Terminal SER"            5
biotype    384    O       "N-Terminal SER"           46
biotype    385    HA      "N-Terminal SER"            0
biotype    386    N       "N-Terminal THR"           42
biotype    387    CA      "N-Terminal THR"           19
biotype    388    C       "N-Terminal THR"            7
biotype    389    HN      "N-Terminal THR"            5
biotype    390    O       "N-Terminal THR"           46
biotype    391    HA      "N-Terminal THR"            0
biotype    392    N       "N-Terminal CYS (-SH)"     42
biotype    393    CA      "N-Terminal CYS (-SH)"     19
biotype    394    C       "N-Terminal CYS (-SH)"      7
biotype    395    HN      "N-Terminal CYS (-SH)"      5
biotype    396    O       "N-Terminal CYS (-SH)"     46
biotype    397    HA      "N-Terminal CYS (-SH)"      0
biotype    398    N       "N-Terminal CYS (-SS)"     42
biotype    399    CA      "N-Terminal CYS (-SS)"     19
biotype    400    C       "N-Terminal CYS (-SS)"      7
biotype    401    HN      "N-Terminal CYS (-SS)"      5
biotype    402    O       "N-Terminal CYS (-SS)"     46
biotype    403    HA      "N-Terminal CYS (-SS)"      0
biotype    404    N       "N-Terminal PRO"           43
biotype    405    CA      "N-Terminal PRO"           19
biotype    406    C       "N-Terminal PRO"            7
biotype    407    HN      "N-Terminal PRO"            5
biotype    408    O       "N-Terminal PRO"           46
biotype    409    HA      "N-Terminal PRO"            0
biotype    410    CD      "N-Terminal PRO"           24
biotype    411    HD      "N-Terminal PRO"            0
biotype    412    N       "N-Terminal PHE"           42
biotype    413    CA      "N-Terminal PHE"           19
biotype    414    C       "N-Terminal PHE"            7
biotype    415    HN      "N-Terminal PHE"            5
biotype    416    O       "N-Terminal PHE"           46
biotype    417    HA      "N-Terminal PHE"            0
biotype    418    N       "N-Terminal TYR"           42
biotype    419    CA      "N-Terminal TYR"           19
biotype    420    C       "N-Terminal TYR"            7
biotype    421    HN      "N-Terminal TYR"            5
biotype    422    O       "N-Terminal TYR"           46
biotype    423    HA      "N-Terminal TYR"            0
biotype    424    N       "N-Terminal TRP"           42
biotype    425    CA      "N-Terminal TRP"           19
biotype    426    C       "N-Terminal TRP"            7
biotype    427    HN      "N-Terminal TRP"            5
biotype    428    O       "N-Terminal TRP"           46
biotype    429    HA      "N-Terminal TRP"            0
biotype    430    N       "N-Terminal HIS (+)"       42
biotype    431    CA      "N-Terminal HIS (+)"       19
biotype    432    C       "N-Terminal HIS (+)"        7
biotype    433    HN      "N-Terminal HIS (+)"        5
biotype    434    O       "N-Terminal HIS (+)"       46
biotype    435    HA      "N-Terminal HIS (+)"        0
biotype    436    N       "N-Terminal HIS (HD)"      42
biotype    437    CA      "N-Terminal HIS (HD)"      19
biotype    438    C       "N-Terminal HIS (HD)"       7
biotype    439    HN      "N-Terminal HIS (HD)"       5
biotype    440    O       "N-Terminal HIS (HD)"      46
biotype    441    HA      "N-Terminal HIS (HD)"       0
biotype    442    N       "N-Terminal HIS (HE)"      42
biotype    443    CA      "N-Terminal HIS (HE)"      19
biotype    444    C       "N-Terminal HIS (HE)"       7
biotype    445    HN      "N-Terminal HIS (HE)"       5
biotype    446    O       "N-Terminal HIS (HE)"      46
biotype    447    HA      "N-Terminal HIS (HE)"       0
biotype    448    N       "N-Terminal ASP"           42
biotype    449    CA      "N-Terminal ASP"           19
biotype    450    C       "N-Terminal ASP"            7
biotype    451    HN      "N-Terminal ASP"            5
biotype    452    O       "N-Terminal ASP"           46
biotype    453    HA      "N-Terminal ASP"            0
biotype    454    N       "N-Terminal ASN"           42
biotype    455    CA      "N-Terminal ASN"           19
biotype    456    C       "N-Terminal ASN"            7
biotype    457    HN      "N-Terminal ASN"            5
biotype    458    O       "N-Terminal ASN"           46
biotype    459    HA      "N-Terminal ASN"            0
biotype    460    N       "N-Terminal GLU"           42
biotype    461    CA      "N-Terminal GLU"           19
biotype    462    C       "N-Terminal GLU"            7
biotype    463    HN      "N-Terminal GLU"            5
biotype    464    O       "N-Terminal GLU"           46
biotype    465    HA      "N-Terminal GLU"            0
biotype    466    N       "N-Terminal GLN"           42
biotype    467    CA      "N-Terminal GLN"           19
biotype    468    C       "N-Terminal GLN"            7
biotype    469    HN      "N-Terminal GLN"            5
biotype    470    O       "N-Terminal GLN"           46
biotype    471    HA      "N-Terminal GLN"            0
biotype    472    N       "N-Terminal MET"           42
biotype    473    CA      "N-Terminal MET"           19
biotype    474    C       "N-Terminal MET"            7
biotype    475    HN      "N-Terminal MET"            5
biotype    476    O       "N-Terminal MET"           46
biotype    477    HA      "N-Terminal MET"            0
biotype    478    N       "N-Terminal LYS"           42
biotype    479    CA      "N-Terminal LYS"           19
biotype    480    C       "N-Terminal LYS"            7
biotype    481    HN      "N-Terminal LYS"            5
biotype    482    O       "N-Terminal LYS"           46
biotype    483    HA      "N-Terminal LYS"            0
biotype    484    N       "N-Terminal ARG"           42
biotype    485    CA      "N-Terminal ARG"           19
biotype    486    C       "N-Terminal ARG"            7
biotype    487    HN      "N-Terminal ARG"            5
biotype    488    O       "N-Terminal ARG"           46
biotype    489    HA      "N-Terminal ARG"            0
biotype    490    N       "N-Terminal ORN"           42
biotype    491    CA      "N-Terminal ORN"           19
biotype    492    C       "N-Terminal ORN"            7
biotype    493    HN      "N-Terminal ORN"            5
biotype    494    O       "N-Terminal ORN"           46
biotype    495    HA      "N-Terminal ORN"            0
biotype    496    N       "N-Terminal AIB"          999
biotype    497    CA      "N-Terminal AIB"          999
biotype    498    C       "N-Terminal AIB"          999
biotype    499    HN      "N-Terminal AIB"          999
biotype    500    O       "N-Terminal AIB"          999
biotype    501    N       "C-Terminal GLY"           37
biotype    502    CA      "C-Terminal GLY"           22
biotype    503    C       "C-Terminal GLY"            9
biotype    504    HN      "C-Terminal GLY"            1
biotype    505    OXT     "C-Terminal GLY"           48
biotype    506    HA      "C-Terminal GLY"            0
biotype    507    N       "C-Terminal ALA"           37
biotype    508    CA      "C-Terminal ALA"           18
biotype    509    C       "C-Terminal ALA"            9
biotype    510    HN      "C-Terminal ALA"            1
biotype    511    OXT     "C-Terminal ALA"           48
biotype    512    HA      "C-Terminal ALA"            0
biotype    513    N       "C-Terminal VAL"           37
biotype    514    CA      "C-Terminal VAL"           18
biotype    515    C       "C-Terminal VAL"            9
biotype    516    HN      "C-Terminal VAL"            1
biotype    517    OXT     "C-Terminal VAL"           48
biotype    518    HA      "C-Terminal VAL"            0
biotype    519    N       "C-Terminal LEU"           37
biotype    520    CA      "C-Terminal LEU"           18
biotype    521    C       "C-Terminal LEU"            9
biotype    522    HN      "C-Terminal LEU"            1
biotype    523    OXT     "C-Terminal LEU"           48
biotype    524    HA      "C-Terminal LEU"            0
biotype    525    N       "C-Terminal ILE"           37
biotype    526    CA      "C-Terminal ILE"           18
biotype    527    C       "C-Terminal ILE"            9
biotype    528    HN      "C-Terminal ILE"            1
biotype    529    OXT     "C-Terminal ILE"           48
biotype    530    HA      "C-Terminal ILE"            0
biotype    531    N       "C-Terminal SER"           37
biotype    532    CA      "C-Terminal SER"           18
biotype    533    C       "C-Terminal SER"            9
biotype    534    HN      "C-Terminal SER"            1
biotype    535    OXT     "C-Terminal SER"           48
biotype    536    HA      "C-Terminal SER"            0
biotype    537    N       "C-Terminal THR"           37
biotype    538    CA      "C-Terminal THR"           18
biotype    539    C       "C-Terminal THR"            9
biotype    540    HN      "C-Terminal THR"            1
biotype    541    OXT     "C-Terminal THR"           48
biotype    542    HA      "C-Terminal THR"            0
biotype    543    N       "C-Terminal CYS (-SH)"     37
biotype    544    CA      "C-Terminal CYS (-SH)"     18
biotype    545    C       "C-Terminal CYS (-SH)"      9
biotype    546    HN      "C-Terminal CYS (-SH)"      1
biotype    547    OXT     "C-Terminal CYS (-SH)"     48
biotype    548    HA      "C-Terminal CYS (-SH)"      0
biotype    549    N       "C-Terminal CYS (-SS)"     37
biotype    550    CA      "C-Terminal CYS (-SS)"     18
biotype    551    C       "C-Terminal CYS (-SS)"      9
biotype    552    HN      "C-Terminal CYS (-SS)"      1
biotype    553    OXT     "C-Terminal CYS (-SS)"     48
biotype    554    HA      "C-Terminal CYS (-SS)"      0
biotype    555    N       "C-Terminal PRO"           36
biotype    556    CA      "C-Terminal PRO"           18
biotype    557    C       "C-Terminal PRO"            9
biotype    558    OXT     "C-Terminal PRO"           48
biotype    559    HA      "C-Terminal PRO"            0
biotype    560    N       "C-Terminal PHE"           37
biotype    561    CA      "C-Terminal PHE"           18
biotype    562    C       "C-Terminal PHE"            9
biotype    563    HN      "C-Terminal PHE"            1
biotype    564    OXT     "C-Terminal PHE"           48
biotype    565    HA      "C-Terminal PHE"            0
biotype    566    N       "C-Terminal TYR"           37
biotype    567    CA      "C-Terminal TYR"           18
biotype    568    C       "C-Terminal TYR"            9
biotype    569    HN      "C-Terminal TYR"            1
biotype    570    OXT     "C-Terminal TYR"           48
biotype    571    HA      "C-Terminal TYR"            0
biotype    572    N       "C-Terminal TRP"           37
biotype    573    CA      "C-Terminal TRP"           18
biotype    574    C       "C-Terminal TRP"            9
biotype    575    HN      "C-Terminal TRP"            1
biotype    576    OXT     "C-Terminal TRP"           48
biotype    577    HA      "C-Terminal TRP"            0
biotype    578    N       "C-Terminal HIS (+)"       37
biotype    579    CA      "C-Terminal HIS (+)"       18
biotype    580    C       "C-Terminal HIS (+)"        9
biotype    581    HN      "C-Terminal HIS (+)"        1
biotype    582    OXT     "C-Terminal HIS (+)"       48
biotype    583    HA      "C-Terminal HIS (+)"        0
biotype    584    N       "C-Terminal HIS (HD)"      37
biotype    585    CA      "C-Terminal HIS (HD)"      18
biotype    586    C       "C-Terminal HIS (HD)"       9
biotype    587    HN      "C-Terminal HIS (HD)"       1
biotype    588    OXT     "C-Terminal HIS (HD)"      48
biotype    589    HA      "C-Terminal HIS (HD)"       0
biotype    590    N       "C-Terminal HIS (HE)"      37
biotype    591    CA      "C-Terminal HIS (HE)"      18
biotype    592    C       "C-Terminal HIS (HE)"       9
biotype    593    HN      "C-Terminal HIS (HE)"       1
biotype    594    OXT     "C-Terminal HIS (HE)"      48
biotype    595    HA      "C-Terminal HIS (HE)"       0
biotype    596    N       "C-Terminal ASP"           37
biotype    597    CA      "C-Terminal ASP"           18
biotype    598    C       "C-Terminal ASP"            9
biotype    599    HN      "C-Terminal ASP"            1
biotype    600    OXT     "C-Terminal ASP"           48
biotype    601    HA      "C-Terminal ASP"            0
biotype    602    N       "C-Terminal ASN"           37
biotype    603    CA      "C-Terminal ASN"           18
biotype    604    C       "C-Terminal ASN"            9
biotype    605    HN      "C-Terminal ASN"            1
biotype    606    OXT     "C-Terminal ASN"           48
biotype    607    HA      "C-Terminal ASN"            0
biotype    608    N       "C-Terminal GLU"           37
biotype    609    CA      "C-Terminal GLU"           18
biotype    610    C       "C-Terminal GLU"            9
biotype    611    HN      "C-Terminal GLU"            1
biotype    612    OXT     "C-Terminal GLU"           48
biotype    613    HA      "C-Terminal GLU"            0
biotype    614    N       "C-Terminal GLN"           37
biotype    615    CA      "C-Terminal GLN"           18
biotype    616    C       "C-Terminal GLN"            9
biotype    617    HN      "C-Terminal GLN"            1
biotype    618    OXT     "C-Terminal GLN"           48
biotype    619    HA      "C-Terminal GLN"            0
biotype    620    N       "C-Terminal MET"           37
biotype    621    CA      "C-Terminal MET"           18
biotype    622    C       "C-Terminal MET"            9
biotype    623    HN      "C-Terminal MET"            1
biotype    624    OXT     "C-Terminal MET"           48
biotype    625    HA      "C-Terminal MET"            0
biotype    626    N       "C-Terminal LYS"           37
biotype    627    CA      "C-Terminal LYS"           18
biotype    628    C       "C-Terminal LYS"            9
biotype    629    HN      "C-Terminal LYS"            1
biotype    630    OXT     "C-Terminal LYS"           48
biotype    631    HA      "C-Terminal LYS"            0
biotype    632    N       "C-Terminal ARG"           37
biotype    633    CA      "C-Terminal ARG"           18
biotype    634    C       "C-Terminal ARG"            9
biotype    635    HN      "C-Terminal ARG"            1
biotype    636    OXT     "C-Terminal ARG"           48
biotype    637    HA      "C-Terminal ARG"            0
biotype    638    N       "C-Terminal ORN"           37
biotype    639    CA      "C-Terminal ORN"           18
biotype    640    C       "C-Terminal ORN"            9
biotype    641    HN      "C-Terminal ORN"            1
biotype    642    OXT     "C-Terminal ORN"           48
biotype    643    HA      "C-Terminal ORN"            0
biotype    644    N       "C-Terminal AIB"          999
biotype    645    CA      "C-Terminal AIB"          999
biotype    646    C       "C-Terminal AIB"          999
biotype    647    HN      "C-Terminal AIB"          999
biotype    648    OXT     "C-Terminal AIB"          999
