%VERSION VERSION_STAMP = V0001.000 DATE = 05/05/17 12:50:53 %FLAG CTITLE %FORMAT(a80) %FLAG POINTERS %FORMAT(10I8) 68 20 38 34 95 47 169 92 0 0 433 1 34 47 92 28 56 104 1 0 0 0 0 0 0 0 0 1 68 0 0 %FLAG FORCE_FIELD_TYPE %FORMAT(i2,a78) 2 >>>> CHARMM36 All-Hydrogen Parameter File for Proteins <<<<<<<<<< 2 CHARMM: >>>>>>>>>>>> All-hydrogen parameters used in the <<<<<<<<<<<<<<<< %FLAG ATOM_NAME %FORMAT(20a4) C15 N4 H152H151H2 C17 C18 H171H172H18 C19 C20 H192H191H202H201C21 C22 H211H212 H222H221C23 C24 H232H231H242H241C25 H251H252C14 C13 H141H142H131H132C8 N2 H8 C7 N1 C6 C1 H1 C2 C3 F1 H3 C4 C5 H4 C9 C10 H9 H101H102N3 C11 HN3 H112H111C12 H122H121C16 H162H161 %FLAG CHARGE %FORMAT(3E24.16) 3.0978814115456390E+00 -7.5260295468726390E+00 1.6400548649359263E+00 1.6400548649359263E+00 5.8313061864388498E+00 3.4076695527002028E+00 -1.3849352192792268E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 -3.5534522073611741E+00 -3.7174576938547665E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 -2.6969791112279680E+00 -3.2801097298718527E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 -2.6969791112279680E+00 -3.7174576938547665E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 -3.5534522073611741E+00 1.6400548649359263E+00 1.6400548649359263E+00 3.0978814115456390E+00 -3.0614357478803957E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 2.3507453064081609E+00 -1.0387014144594199E+01 1.6400548649359263E+00 1.5635189712389167E+01 -9.6034323757914812E+00 5.2846212314602081E-01 -4.8837189311425373E+00 5.0295015858035077E+00 2.9156530932194249E+00 -3.0614357478803957E+00 -3.8450175166831162E+00 4.7014906128163219E+00 -6.8517847690656488E+00 4.4099253034943802E+00 3.5170065436959308E+00 -2.8609845977215609E+00 8.5647309613320610E-01 1.6400548649359263E+00 1.6400548649359263E+00 1.6400548649359263E+00 -1.5799195198882758E+01 1.4942722102749553E+00 6.5784422915763274E+00 1.6400548649359263E+00 1.6400548649359263E+00 -3.8085718530178738E+00 1.6400548649359263E+00 1.6400548649359263E+00 -3.0614357478803957E+00 1.6400548649359263E+00 1.6400548649359263E+00 %FLAG ATOMIC_NUMBER %FORMAT(10I8) 6 7 1 1 1 6 6 1 1 1 6 6 1 1 1 1 6 6 1 1 1 1 6 6 1 1 1 1 6 1 1 6 6 1 1 1 1 6 7 1 6 7 6 6 1 6 6 9 1 6 6 1 6 6 1 1 1 7 6 1 1 1 6 1 1 6 1 1 %FLAG MASS %FORMAT(5E16.8) 1.20110000E+01 1.40070000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.40070000E+01 1.00800000E+00 1.20110000E+01 1.40070000E+01 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.89980000E+01 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.20110000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.40070000E+01 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.00800000E+00 1.00800000E+00 1.20110000E+01 1.00800000E+00 1.00800000E+00 %FLAG ATOM_TYPE_INDEX %FORMAT(10I8) 1 2 3 3 4 1 5 3 3 6 7 7 3 3 3 3 7 7 3 3 3 3 7 7 3 3 3 3 7 3 3 1 7 3 3 3 3 5 8 6 9 10 11 12 13 14 12 15 13 12 11 16 17 18 6 3 3 19 18 20 3 3 18 3 3 7 3 3 %FLAG NUMBER_EXCLUDED_ATOMS %FORMAT(10I8) 18 20 8 7 9 17 18 5 4 8 13 12 5 4 5 4 9 11 4 3 5 4 8 7 4 3 4 3 2 1 1 9 12 4 3 5 4 11 16 5 16 10 9 7 4 6 5 2 3 2 3 1 12 11 7 5 4 7 6 3 4 3 2 1 1 2 1 1 %FLAG NONBONDED_PARM_INDEX %FORMAT(10I8) 1 2 4 7 11 16 22 29 37 46 56 67 79 92 106 121 137 154 172 191 2 3 5 8 12 17 23 30 38 47 57 68 80 93 107 122 138 155 173 192 4 5 6 9 13 18 24 31 39 48 58 69 81 94 108 123 139 156 174 193 7 8 9 10 14 19 25 32 40 49 59 70 82 95 109 124 140 157 175 194 11 12 13 14 15 20 26 33 41 50 60 71 83 96 110 125 141 158 176 195 16 17 18 19 20 21 27 34 42 51 61 72 84 97 111 126 142 159 177 196 22 23 24 25 26 27 28 35 43 52 62 73 85 98 112 127 143 160 178 197 29 30 31 32 33 34 35 36 44 53 63 74 86 99 113 128 144 161 179 198 37 38 39 40 41 42 43 44 45 54 64 75 87 100 114 129 145 162 180 199 46 47 48 49 50 51 52 53 54 55 65 76 88 101 115 130 146 163 181 200 56 57 58 59 60 61 62 63 64 65 66 77 89 102 116 131 147 164 182 201 67 68 69 70 71 72 73 74 75 76 77 78 90 103 117 132 148 165 183 202 79 80 81 82 83 84 85 86 87 88 89 90 91 104 118 133 149 166 184 203 92 93 94 95 96 97 98 99 100 101 102 103 104 105 119 134 150 167 185 204 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 135 151 168 186 205 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 152 169 187 206 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 170 188 207 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 189 208 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 209 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 %FLAG RESIDUE_LABEL %FORMAT(20a4) UNK %FLAG RESIDUE_POINTER %FORMAT(10I8) 1 %FLAG BOND_FORCE_CONSTANT %FORMAT(5E16.8) 3.05000000E+02 3.00000000E+02 4.00000000E+02 3.05000000E+02 3.60000000E+02 3.00000000E+02 3.10000000E+02 4.00000000E+02 4.00000000E+02 3.50000000E+02 4.00000000E+02 2.22500000E+02 2.22500000E+02 2.00000000E+02 2.22500000E+02 2.22500000E+02 1.95000000E+02 1.95000000E+02 4.00000000E+02 3.40000000E+02 3.40000000E+02 3.09000000E+02 3.09000000E+02 2.84500000E+02 4.03000000E+02 3.07000000E+02 3.07000000E+02 4.50000000E+02 %FLAG BOND_EQUIL_VALUE %FORMAT(5E16.8) 1.37000000E+00 1.36000000E+00 1.35800000E+00 1.37500000E+00 1.38500000E+00 1.37500000E+00 1.36500000E+00 1.38000000E+00 1.38000000E+00 1.51000000E+00 1.45800000E+00 1.53800000E+00 1.53000000E+00 1.48000000E+00 1.53000000E+00 1.53000000E+00 1.51800000E+00 1.53000000E+00 1.47800000E+00 1.08000000E+00 1.08000000E+00 1.11100000E+00 1.11100000E+00 1.10000000E+00 1.04000000E+00 1.10000000E+00 1.10000000E+00 1.01800000E+00 %FLAG ANGLE_FORCE_CONSTANT %FORMAT(5E16.8) 1.00000000E+02 4.50000000E+01 1.00000000E+02 5.83500000E+01 5.83500000E+01 5.83500000E+01 5.83500000E+01 5.83500000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 8.50000000E+01 1.00000000E+02 1.70000000E+02 1.70000000E+02 6.00000000E+01 1.30000000E+02 1.00000000E+02 5.00000000E+01 4.00000000E+01 4.00000000E+01 6.00000000E+01 4.00000000E+01 5.00000000E+01 1.00000000E+02 1.30000000E+02 5.20000000E+01 5.80000000E+01 8.40000000E+01 1.40000000E+02 8.40000000E+01 5.80000000E+01 4.50000000E+01 3.55000000E+01 2.65000000E+01 3.00000000E+01 2.65000000E+01 2.65000000E+01 3.45000000E+01 3.34300000E+01 2.65000000E+01 3.55000000E+01 2.65000000E+01 3.34300000E+01 3.00000000E+01 3.00000000E+01 3.00000000E+01 3.00000000E+01 3.00000000E+01 5.20000000E+01 3.50000000E+01 3.50000000E+01 3.85000000E+01 5.40000000E+01 4.30000000E+01 3.50000000E+01 %FLAG ANGLE_EQUIL_VALUE %FORMAT(3E25.17) 1.91986217719376251E+00 2.01061929829746777E+00 1.91986217719376251E+00 1.92858882345373406E+00 1.98094870101356402E+00 1.98094870101356402E+00 1.98269403026555824E+00 1.92858882345373406E+00 2.09439510239319526E+00 2.21831347928479294E+00 2.19736952826086096E+00 1.91986217719376251E+00 1.97222205475359247E+00 1.95476876223364915E+00 1.95476876223364915E+00 1.79768912955415949E+00 2.26892802759262846E+00 1.91986217719376251E+00 2.09439510239319526E+00 2.07694180987325216E+00 2.13802833369305390E+00 2.07257848674326617E+00 2.07694180987325216E+00 2.09439510239319526E+00 1.84481301935800635E+00 2.31430658814448087E+00 1.85004900711398923E+00 1.91113553093379096E+00 1.87797427514589854E+00 1.80990643431811971E+00 1.87797427514589854E+00 1.91113553093379096E+00 1.78547182479019906E+00 1.90240888467381919E+00 1.95127810372966048E+00 1.93382481120971716E+00 1.95127810372966048E+00 1.95127810372966048E+00 1.92160750644575673E+00 1.92160750644575673E+00 1.92160750644575673E+00 1.90240888467381919E+00 1.92160750644575673E+00 1.92160750644575673E+00 2.12057504117311035E+00 2.12057504117311035E+00 2.09439510239319526E+00 2.09439510239319526E+00 2.09439510239319526E+00 1.96524073774561492E+00 1.94429678672168316E+00 1.94429678672168316E+00 1.86401164112994389E+00 1.90240888467381919E+00 1.95476876223364915E+00 1.94429678672168316E+00 %FLAG CHARMM_UREY_BRADLEY_COUNT %FORMAT(2I8) 104 29 %FLAG CHARMM_UREY_BRADLEY %FORMAT(10I8) 2 3 1 2 4 1 3 4 2 3 66 3 4 66 3 1 5 4 5 6 4 5 32 4 2 8 1 2 9 1 7 8 5 7 9 5 8 9 2 6 10 6 6 11 7 6 29 7 10 11 8 10 29 8 11 29 9 7 12 10 7 13 11 7 14 11 12 13 12 12 14 12 13 14 13 11 15 12 11 16 12 11 17 14 15 16 13 15 17 12 16 17 12 12 18 14 12 19 12 12 20 12 18 19 12 18 20 12 19 20 13 17 21 12 17 22 12 17 23 14 21 22 13 21 23 12 22 23 12 18 24 14 18 25 12 18 26 12 24 25 12 24 26 12 25 26 13 23 27 12 23 28 12 23 29 14 27 28 13 27 29 12 28 29 12 7 24 10 7 30 11 7 31 11 24 30 12 24 31 12 30 31 13 2 34 1 2 35 1 33 34 3 33 35 3 34 35 2 32 36 15 32 37 15 32 38 16 36 37 13 36 38 11 37 38 11 33 40 8 33 66 9 40 66 8 43 46 17 45 46 18 44 47 19 46 49 18 46 50 20 49 50 21 47 52 22 51 52 23 54 55 24 54 63 25 55 63 24 53 56 26 53 57 26 56 57 27 61 62 27 61 63 28 62 63 28 53 59 29 53 64 26 53 65 26 59 64 28 59 65 28 64 65 27 1 38 16 1 67 15 1 68 15 38 67 11 38 68 11 67 68 13 %FLAG CHARMM_UREY_BRADLEY_FORCE_CONSTANT %FORMAT(5E16.8) 3.50000000E+01 5.40000000E+00 2.25300000E+01 2.70000000E+01 2.25300000E+01 2.25300000E+01 1.11600000E+01 2.25300000E+01 1.11600000E+01 1.11600000E+01 2.25300000E+01 2.25300000E+01 5.40000000E+00 1.11600000E+01 2.25300000E+01 1.11600000E+01 3.50000000E+01 2.20000000E+01 3.50000000E+01 3.50000000E+01 2.20000000E+01 2.20000000E+01 2.20000000E+01 2.25300000E+01 1.11600000E+01 2.25300000E+01 5.40000000E+00 2.25300000E+01 1.11600000E+01 %FLAG CHARMM_UREY_BRADLEY_EQUIL_VALUE %FORMAT(5E16.8) 2.10100000E+00 1.80200000E+00 2.17900000E+00 2.07400000E+00 2.17900000E+00 2.17900000E+00 2.56100000E+00 2.17900000E+00 2.56100000E+00 2.56100000E+00 2.17900000E+00 2.17900000E+00 1.80200000E+00 2.56100000E+00 2.17900000E+00 2.56100000E+00 2.41620000E+00 2.15250000E+00 2.41620000E+00 2.41620000E+00 2.15250000E+00 2.15250000E+00 2.14600000E+00 2.17900000E+00 2.56100000E+00 2.17900000E+00 1.80200000E+00 2.17900000E+00 2.56100000E+00 %FLAG DIHEDRAL_FORCE_CONSTANT %FORMAT(5E16.8) 1.00000000E-01 1.00000000E-01 2.00000000E-01 2.00000000E-01 1.00000000E+00 1.95000000E-01 1.95000000E-01 5.00000000E-01 5.00000000E-01 2.00000000E-01 6.45000000E-02 1.49750000E-01 9.45800000E-02 1.12510000E-01 3.85000000E-01 4.20000000E-01 8.00000000E-02 5.50000000E-02 3.85000000E-01 4.20000000E-01 8.00000000E-02 5.50000000E-02 1.10000000E+01 0.00000000E+00 1.10000000E+01 1.10000000E+01 1.40000000E+01 2.80000000E+00 1.00000000E+01 1.50000000E+00 3.00000000E+00 1.50000000E+00 1.50000000E+00 4.00000000E+00 4.00000000E+00 1.70000000E+00 3.70000000E+00 2.25000000E+00 2.30000000E-01 6.00000000E+00 2.80000000E+00 1.50000000E+00 1.50000000E+00 1.30000000E+01 3.10000000E+00 4.50000000E+00 3.00000000E+00 3.00000000E+00 3.10000000E+00 3.00000000E+00 3.10000000E+00 4.50000000E+00 3.00000000E+00 1.80000000E-01 6.90000000E-01 4.10000000E-01 1.80000000E-01 6.90000000E-01 1.00000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.00000000E-01 1.95000000E-01 1.95000000E-01 1.00000000E-01 1.00000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 1.95000000E-01 2.20000000E-01 2.00000000E-01 1.40000000E+00 3.00000000E+00 0.00000000E+00 0.00000000E+00 1.40000000E-01 1.40000000E+00 1.00000000E+00 3.00000000E+00 4.20000000E+00 4.20000000E+00 2.40000000E+00 4.20000000E+00 2.40000000E+00 2.40000000E+00 5.50000000E-01 8.50000000E-01 1.90000000E-01 1.90000000E-01 0.00000000E+00 1.90000000E-01 0.00000000E+00 1.90000000E-01 0.00000000E+00 0.00000000E+00 5.50000000E-01 8.50000000E-01 1.90000000E-01 %FLAG DIHEDRAL_PERIODICITY %FORMAT(5E16.8) 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 6.00000000E+00 3.00000000E+00 2.00000000E+00 3.00000000E+00 4.00000000E+00 5.00000000E+00 1.00000000E+00 2.00000000E+00 3.00000000E+00 4.00000000E+00 1.00000000E+00 2.00000000E+00 3.00000000E+00 4.00000000E+00 2.00000000E+00 1.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 3.00000000E+00 3.00000000E+00 4.00000000E+00 6.00000000E+00 2.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 1.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 2.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 1.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 1.00000000E+00 3.00000000E+00 3.00000000E+00 %FLAG DIHEDRAL_PHASE %FORMAT(5E16.8) 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 3.14159265E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 %FLAG SCEE_SCALE_FACTOR %FORMAT(5E16.8) 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 %FLAG SCNB_SCALE_FACTOR %FORMAT(5E16.8) 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 1.00000000E+00 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1.3165904011680079E+06 9.5679635135808110E+05 1.2254480396417514E+06 4.1663725901317193E+04 9.1503821197263990E+05 6.2064871065477643E+05 9.2090077614846974E+04 3.4585193557154440E+05 3.4585193557154440E+05 1.3165904011680079E+06 1.8132585791999887E+02 6.0933367984903236E+02 8.6281909483965027E+00 3.0882604789375187E-06 1.8132585791999887E+02 9.7834489345010063E+00 1.8132585791999887E+02 6.0933367984903236E+02 1.1934892847807860E+03 6.0933367984903236E+02 4.5417090248318647E+02 7.9961544928008914E+02 1.3408536646110401E+00 4.7974312632174866E+02 1.9177170259300729E+02 9.1774657311857446E+00 1.8132585791999887E+02 1.8132585791999887E+02 6.0933367984903236E+02 3.0882604789375187E-06 %FLAG LENNARD_JONES_14_BCOEF %FORMAT(3E24.16) 6.0218727679999986E+01 2.4873253717000529E+02 1.0262905636000003E+03 4.3284666835651564E+01 1.7632874399834014E+02 2.5936227335495690E+01 3.9441127724648419E+00 1.5289896454943387E+01 1.1767828718274467E+00 7.5381690623420186E-04 6.0218727679999986E+01 2.4873253717000529E+02 4.3284666835651564E+01 3.9441127724648419E+00 6.0218727679999986E+01 4.9080198869751051E+01 1.9993800240513465E+02 2.1415913428452154E+01 1.3343463539896376E+00 4.9080198869751051E+01 3.3346578002780170E+01 6.0218727679999986E+01 2.4873253717000529E+02 4.3284666835651564E+01 3.9441127724648419E+00 6.0218727679999986E+01 4.9080198869751051E+01 6.0218727679999986E+01 2.4873253717000529E+02 1.0262905636000003E+03 1.7632874399834014E+02 1.5289896454943387E+01 2.4873253717000529E+02 1.9993800240513465E+02 2.4873253717000529E+02 1.0262905636000003E+03 1.8317868871678277E+02 7.5964829850312526E+02 1.3864355171684500E+02 1.5131124921416310E+01 1.8317868871678277E+02 1.5720701088235455E+02 1.8317868871678277E+02 7.5964829850312526E+02 5.4890317440000024E+02 2.4873253717000529E+02 1.0262905636000003E+03 1.7632874399834014E+02 1.5289896454943387E+01 2.4873253717000529E+02 1.9993800240513465E+02 2.4873253717000529E+02 1.0262905636000003E+03 7.5964829850312526E+02 1.0262905636000003E+03 1.7781756652504788E+02 7.3384788767303814E+02 1.2641001563899482E+02 1.1072301561614886E+01 1.7781756652504788E+02 1.4333548483224251E+02 1.7781756652504788E+02 7.3384788767303814E+02 5.4262988762866087E+02 7.3384788767303814E+02 5.2471421469860672E+02 1.8402795453569277E+02 7.6156934668163342E+02 1.3556756409573165E+02 1.3472076858702502E+01 1.8402795453569277E+02 1.5371916876176354E+02 1.8402795453569277E+02 7.6156934668163342E+02 5.5581782931842383E+02 7.6156934668163342E+02 5.4423298253871224E+02 5.6048914757883244E+02 3.1270616239530682E+01 1.2643170806603781E+02 1.6934870957959181E+01 4.9670622533690006E-01 3.1270616239530682E+01 1.9202338731312924E+01 3.1270616239530682E+01 1.2643170806603781E+02 1.0298969774877000E+02 1.2643170806603781E+02 9.0777198379719422E+01 9.9250320782952912E+01 1.0430951168000005E+01 1.5932377771000151E+02 6.5808443632196349E+02 1.1452046402941913E+02 1.0435141538735452E+01 1.5932377771000151E+02 1.2985400050695466E+02 1.5932377771000151E+02 6.5808443632196349E+02 4.8464525583152056E+02 6.5808443632196349E+02 4.7046105976396046E+02 4.8689220198534406E+02 8.2734273913535972E+01 4.2153109375999992E+02 1.5081190411881860E+02 6.2016283283809321E+02 1.0230483105405102E+02 7.5493059634400677E+00 1.5081190411881860E+02 1.1600277466692725E+02 1.5081190411881860E+02 6.2016283283809321E+02 4.6645225886887908E+02 6.2016283283809321E+02 4.4374983422840347E+02 4.6453890561435685E+02 7.1605721092450480E+01 3.9901079304651171E+02 3.7075305983999993E+02 4.1443560464507264E+01 1.6891733764258794E+02 2.5007453671445301E+01 1.1677803226525605E+00 4.1443560464507264E+01 2.8355787144691462E+01 4.1443560464507264E+01 1.6891733764258794E+02 1.3248791451440860E+02 1.6891733764258794E+02 1.2108390072527510E+02 1.2968064083733790E+02 1.6393543027144652E+01 1.0964935443415473E+02 9.8169493409449473E+01 2.4105357743208963E+01 6.0218727679999986E+01 2.4873253717000529E+02 4.3284666835651564E+01 3.9441127724648419E+00 6.0218727679999986E+01 4.9080198869751051E+01 6.0218727679999986E+01 2.4873253717000529E+02 1.8317868871678277E+02 2.4873253717000529E+02 1.7781756652504788E+02 1.8402795453569277E+02 3.1270616239530682E+01 1.5932377771000151E+02 1.5081190411881860E+02 4.1443560464507264E+01 6.0218727679999986E+01 6.0218727679999986E+01 2.4873253717000529E+02 4.3284666835651564E+01 3.9441127724648419E+00 6.0218727679999986E+01 4.9080198869751051E+01 6.0218727679999986E+01 2.4873253717000529E+02 1.8317868871678277E+02 2.4873253717000529E+02 1.7781756652504788E+02 1.8402795453569277E+02 3.1270616239530682E+01 1.5932377771000151E+02 1.5081190411881860E+02 4.1443560464507264E+01 6.0218727679999986E+01 6.0218727679999986E+01 2.4873253717000529E+02 1.0262905636000003E+03 1.7632874399834014E+02 1.5289896454943387E+01 2.4873253717000529E+02 1.9993800240513465E+02 2.4873253717000529E+02 1.0262905636000003E+03 7.5964829850312526E+02 1.0262905636000003E+03 7.3384788767303814E+02 7.6156934668163342E+02 1.2643170806603781E+02 6.5808443632196349E+02 6.2016283283809321E+02 1.6891733764258794E+02 2.4873253717000529E+02 2.4873253717000529E+02 1.0262905636000003E+03 3.9441127724648419E+00 1.5289896454943387E+01 1.1767828718274467E+00 7.5381690623420186E-04 3.9441127724648419E+00 1.3343463539896376E+00 3.9441127724648419E+00 1.5289896454943387E+01 1.5131124921416310E+01 1.5289896454943387E+01 1.1072301561614886E+01 1.3472076858702502E+01 4.9670622533690006E-01 1.0435141538735452E+01 7.5493059634400677E+00 1.1677803226525605E+00 3.9441127724648419E+00 3.9441127724648419E+00 1.5289896454943387E+01 7.5381690623420186E-04 %FLAG BONDS_INC_HYDROGEN %FORMAT(10I8) 129 132 20 138 144 20 147 153 21 111 117 22 195 201 23 195 198 23 0 9 24 0 6 24 3 12 25 93 99 24 93 102 24 96 105 23 96 108 23 15 21 24 15 24 24 18 27 22 84 87 23 84 90 23 69 81 23 69 78 23 66 75 23 66 72 23 51 63 23 51 60 23 48 54 23 48 57 23 33 45 23 33 42 23 30 39 23 30 36 23 156 162 26 186 192 27 186 189 27 174 183 27 174 180 27 171 177 28 159 165 27 159 168 27 %FLAG BONDS_WITHOUT_HYDROGEN %FORMAT(10I8) 129 135 1 129 126 2 135 138 1 135 141 3 138 147 4 147 150 2 150 126 5 150 114 6 126 123 7 123 120 8 120 114 9 120 156 10 114 111 11 111 195 12 111 96 12 195 0 13 0 3 14 3 93 14 3 15 14 93 96 13 15 18 15 18 84 12 18 30 12 84 69 16 69 66 16 66 51 16 51 48 16 48 33 16 33 30 16 156 186 17 156 159 17 186 174 18 174 171 19 171 159 19 %FLAG ANGLES_INC_HYDROGEN %FORMAT(10I8) 3 0 6 33 3 0 9 33 6 0 9 34 6 0 195 35 9 0 195 35 0 3 12 36 12 3 15 36 12 3 93 36 3 15 21 33 3 15 24 33 18 15 21 37 18 15 24 37 21 15 24 34 15 18 27 38 27 18 30 39 27 18 84 39 18 30 36 40 18 30 39 40 33 30 36 41 33 30 39 41 36 30 39 42 30 33 42 41 30 33 45 41 42 33 45 42 42 33 48 41 45 33 48 41 33 48 54 41 33 48 57 41 51 48 54 41 51 48 57 41 54 48 57 42 48 51 60 41 48 51 63 41 60 51 63 42 60 51 66 41 63 51 66 41 51 66 72 41 51 66 75 41 69 66 72 41 69 66 75 41 72 66 75 42 66 69 78 41 66 69 81 41 78 69 81 42 78 69 84 41 81 69 84 41 18 84 87 40 18 84 90 40 69 84 87 41 69 84 90 41 87 84 90 42 3 93 99 33 3 93 102 33 96 93 99 35 96 93 102 35 99 93 102 34 93 96 105 43 93 96 108 43 105 96 108 42 105 96 111 40 108 96 111 40 96 111 117 39 114 111 117 44 117 111 195 39 126 129 132 45 132 129 135 46 135 138 144 46 144 138 147 47 138 147 153 48 150 147 153 49 120 156 162 50 159 156 162 51 162 156 186 51 156 159 165 52 156 159 168 52 165 159 168 53 165 159 171 54 168 159 171 54 159 171 177 55 174 171 177 55 171 174 180 54 171 174 183 54 180 174 183 53 180 174 186 56 183 174 186 56 156 186 189 52 156 186 192 52 174 186 189 56 174 186 192 56 189 186 192 53 0 195 198 43 0 195 201 43 111 195 198 40 111 195 201 40 198 195 201 42 %FLAG ANGLES_WITHOUT_HYDROGEN %FORMAT(10I8) 3 0 195 1 0 3 15 2 0 3 93 2 15 3 93 2 3 15 18 3 15 18 30 4 15 18 84 4 30 18 84 5 18 30 33 6 30 33 48 7 33 48 51 7 48 51 66 7 51 66 69 7 66 69 84 7 18 84 69 6 3 93 96 1 93 96 111 8 96 111 114 9 96 111 195 5 114 111 195 9 111 114 120 10 111 114 150 11 120 114 150 12 114 120 123 13 114 120 156 14 123 120 156 15 120 123 126 16 123 126 129 17 123 126 150 18 129 126 150 19 126 129 135 20 129 135 138 21 129 135 141 22 138 135 141 22 135 138 147 23 138 147 150 24 114 150 126 25 114 150 147 26 126 150 147 19 120 156 159 27 120 156 186 27 159 156 186 28 156 159 171 29 159 171 174 30 171 174 186 31 156 186 174 32 0 195 111 8 %FLAG DIHEDRALS_INC_HYDROGEN %FORMAT(10I8) 0 3 15 21 59 0 3 15 24 59 0 3 93 99 59 0 3 93 102 59 0 195 111 117 60 3 0 195 198 61 3 0 195 201 61 3 15 18 27 62 3 93 96 105 61 3 93 96 108 61 6 0 3 12 63 6 0 3 15 59 6 0 3 93 59 6 0 195 111 64 6 0 195 198 65 6 0 195 201 65 9 0 3 12 63 9 0 3 15 59 9 0 3 93 59 9 0 195 111 64 9 0 195 198 65 9 0 195 201 65 12 3 0 195 66 12 3 15 18 67 12 3 15 21 63 12 3 15 24 63 12 3 93 96 66 12 3 93 99 63 12 3 93 102 63 15 3 93 99 59 15 3 93 102 59 15 18 30 36 68 15 18 30 39 68 15 18 84 87 68 15 18 84 90 68 18 30 33 42 69 18 30 33 45 69 18 84 69 78 69 18 84 69 81 69 21 15 3 93 59 21 15 18 27 70 21 15 18 30 71 21 15 18 84 71 24 15 3 93 59 24 15 18 27 70 24 15 18 30 71 24 15 18 84 71 27 18 30 33 72 27 18 30 36 73 27 18 30 39 73 27 18 84 69 72 27 18 84 87 73 27 18 84 90 73 30 18 84 87 74 30 18 84 90 74 30 33 48 54 75 30 33 48 57 75 33 48 51 60 75 33 48 51 63 75 36 30 18 84 74 36 30 33 42 76 36 30 33 45 76 36 30 33 48 75 39 30 18 84 74 39 30 33 42 76 39 30 33 45 76 39 30 33 48 75 42 33 48 51 75 42 33 48 54 76 42 33 48 57 76 45 33 48 51 75 45 33 48 54 76 45 33 48 57 76 48 51 66 72 75 48 51 66 75 75 51 66 69 78 75 51 66 69 81 75 54 48 51 60 76 54 48 51 63 76 54 48 51 66 75 57 48 51 60 76 57 48 51 63 76 57 48 51 66 75 60 51 66 69 75 60 51 66 72 76 60 51 66 75 76 63 51 66 69 75 63 51 66 72 76 63 51 66 75 76 66 69 84 87 75 66 69 84 90 75 72 66 69 78 76 72 66 69 81 76 72 66 69 84 75 75 66 69 78 76 75 66 69 81 76 75 66 69 84 75 78 69 84 87 76 78 69 84 90 76 81 69 84 87 76 81 69 84 90 76 93 96 111 117 60 96 111 195 198 74 96 111 195 201 74 99 93 96 105 65 99 93 96 108 65 99 93 96 111 64 102 93 96 105 65 102 93 96 108 65 102 93 96 111 64 105 96 111 114 77 105 96 111 117 73 105 96 111 195 74 108 96 111 114 77 108 96 111 117 73 108 96 111 195 74 114 111 195 198 77 114 111 195 201 77 114 120 156 162 78 114 150 147 153 79 117 111 114 120 80 117 111 114 150 81 117 111 195 198 73 117 111 195 201 73 120 156 159 165 82 120 156 159 168 82 120 156 186 189 82 120 156 186 192 82 123 120 156 162 83 123 126 129 132 84 126 150 147 153 85 129 135 138 144 86 132 129 126 150 87 132 129 135 138 86 132 129 135 141 88 135 138 147 153 89 141 135 138 144 88 144 138 147 150 90 144 138 147 153 91 156 159 -171 177 92 156 159 171 177 93 156 186 174 180 94 156 186 174 183 94 159 156 186 189 95 159 156 186 192 95 159 171 174 180 96 159 171 174 183 96 162 156 159 165 97 162 156 159 168 97 162 156 159 171 98 162 156 186 174 99 162 156 186 189 97 162 156 186 192 97 165 159 156 186 95 165 159 171 174 96 165 159 171 177 100 168 159 156 186 95 168 159 171 174 96 168 159 171 177 100 171 174 186 189 101 171 174 186 192 101 177 171 174 180 100 177 171 174 183 100 177 171 -174 186 102 177 171 174 186 103 180 174 186 189 104 180 174 186 192 104 183 174 186 189 104 183 174 186 192 104 %FLAG DIHEDRALS_WITHOUT_HYDROGEN %FORMAT(10I8) 0 3 15 18 1 0 3 93 96 2 0 195 -111 96 3 0 195 111 114 4 3 0 195 111 5 3 15 18 30 6 3 15 18 84 6 3 93 -96 111 5 15 3 0 195 2 15 3 93 96 2 15 18 30 33 7 15 18 84 69 7 18 15 3 93 1 18 30 -33 48 8 18 30 33 48 9 18 84 -69 66 8 18 84 69 66 9 30 18 84 69 10 30 33 -48 51 11 30 33 -48 51 12 30 33 -48 51 13 30 33 48 51 14 33 30 18 84 10 33 48 -51 66 11 33 48 -51 66 12 33 48 -51 66 13 33 48 51 66 14 48 51 -66 69 11 48 51 -66 69 12 48 51 -66 69 13 48 51 66 69 14 51 66 -69 84 11 51 66 -69 84 12 51 66 -69 84 13 51 66 69 84 14 93 3 0 195 2 93 96 111 114 4 93 96 -111 195 3 96 111 -114 120 15 96 111 -114 120 16 96 111 -114 120 17 96 111 114 120 18 96 111 -114 150 19 96 111 -114 150 20 96 111 -114 150 21 96 111 114 150 22 111 114 120 123 23 111 114 120 156 24 111 114 150 126 25 111 114 150 147 26 114 120 -123 126 27 114 120 156 159 28 114 120 156 186 28 114 150 -126 123 29 114 150 126 129 30 114 150 147 138 31 120 114 -111 195 15 120 114 -111 195 16 120 114 -111 195 17 120 114 111 195 18 120 114 -150 126 32 120 114 150 147 33 120 123 126 129 34 120 123 -126 150 35 120 156 159 171 36 120 156 -186 174 37 120 156 -186 174 38 120 156 186 174 39 123 120 -114 150 40 123 120 156 159 41 123 120 156 186 41 123 126 129 135 42 123 126 150 147 43 126 123 120 156 44 126 129 135 138 45 126 129 135 141 46 126 150 -147 138 47 129 126 150 147 48 129 135 -138 147 49 135 129 126 150 50 135 138 -147 150 51 141 135 138 147 52 150 114 -111 195 19 150 114 -111 195 20 150 114 -111 195 21 150 114 111 195 22 150 114 120 156 53 156 159 -171 174 54 156 186 -174 171 55 159 156 -186 174 56 159 171 -174 186 57 171 159 -156 186 58 %FLAG EXCLUDED_ATOMS_LIST %FORMAT(10I8) 2 3 4 5 6 7 8 9 32 33 34 35 38 39 40 66 67 68 3 4 5 6 7 8 9 10 11 29 32 33 34 35 36 37 38 66 67 68 4 5 6 32 38 66 67 68 5 6 32 38 66 67 68 6 7 8 9 32 33 34 35 66 7 8 9 10 11 12 13 14 24 29 30 31 32 33 34 35 66 8 9 10 11 12 13 14 15 16 17 23 24 27 28 29 30 31 32 9 10 11 29 32 10 11 29 32 11 12 13 14 24 29 30 31 12 13 14 15 16 17 18 19 20 24 29 30 31 13 14 15 16 17 18 19 20 21 22 23 29 14 15 16 17 29 15 16 17 29 16 17 18 19 20 17 18 19 20 18 19 20 21 22 23 24 25 26 19 20 21 22 23 24 25 26 27 28 29 20 21 22 23 21 22 23 22 23 24 25 26 23 24 25 26 24 25 26 27 28 29 30 31 25 26 27 28 29 30 31 26 27 28 29 27 28 29 28 29 30 31 29 30 31 30 31 31 0 33 34 35 36 37 38 39 40 66 34 35 36 37 38 39 40 41 51 66 67 68 35 36 37 38 36 37 38 37 38 39 40 66 38 39 40 66 39 40 41 42 43 50 51 53 66 67 68 40 41 42 43 44 47 50 51 52 53 54 55 63 66 67 68 41 51 66 67 68 42 43 44 50 51 53 54 55 56 57 58 59 63 64 65 66 43 44 45 46 50 51 53 54 55 63 44 45 46 47 48 50 51 52 53 45 46 47 48 49 50 51 46 47 48 51 47 48 49 50 51 52 48 49 50 51 52 49 50 50 51 52 51 52 52 53 66 0 54 55 56 57 58 59 60 61 62 63 64 65 55 56 57 58 59 60 61 62 63 64 65 56 57 58 59 63 64 65 57 58 59 60 63 58 59 60 63 59 60 61 62 63 64 65 60 61 62 63 64 65 61 62 63 62 63 64 65 63 64 65 64 65 65 0 67 68 68 0 %FLAG HBOND_ACOEF %FORMAT(5E16.8) %FLAG HBOND_BCOEF %FORMAT(5E16.8) %FLAG HBCUT %FORMAT(5E16.8) %FLAG AMBER_ATOM_TYPE %FORMAT(20a4) CG32NG3PHGA2HGA2HGP2CG32CG31HGA2HGA2HGA1CG32CG32HGA2HGA2HGA2HGA2CG32CG32HGA2HGA2 HGA2HGA2CG32CG32HGA2HGA2HGA2HGA2CG32HGA2HGA2CG32CG32HGA2HGA2HGA2HGA2CG31NG2RHGA1 CG2RNG2RCG2RCG2RHGR6CG2RCG2RFGR1HGR6CG2RCG2RHGR6CG3CCG3CHGA1HGA2HGA2NG3CCG3CHGP1 HGA2HGA2CG3CHGA2HGA2CG32HGA2HGA2 %FLAG TREE_CHAIN_CLASSIFICATION %FORMAT(20a4) BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA %FLAG JOIN_ARRAY %FORMAT(10I8) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 %FLAG IROTAT %FORMAT(10I8) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 %FLAG SOLVENT_POINTERS %FORMAT(3I8) 1 1 2 %FLAG ATOMS_PER_MOLECULE %FORMAT(10I8) 68 %FLAG BOX_DIMENSIONS %FORMAT(5E16.8) 9.00000000E+01 7.00383195E+01 7.00383195E+01 1.03965000E+02 %FLAG RADIUS_SET %FORMAT(1a80) modified Bondi radii (mbondi) %FLAG RADII %FORMAT(5E16.8) 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 %FLAG SCREEN %FORMAT(5E16.8) 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.80000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01