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*** ptn_chat_gpt ***elNémo ID: 2308251635432472527Job options:ID = 2308251635432472527 JOBID = ptn_chat_gpt USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER ptn_chat_gpt MODEL 1 ATOM 1 N THR A 1 -12.086 3.984 -15.180 1.00 52.44 N ATOM 2 CA THR A 1 -11.523 5.094 -14.422 1.00 52.44 C ATOM 3 C THR A 1 -10.414 4.605 -13.492 1.00 52.44 C ATOM 4 CB THR A 1 -12.602 5.816 -13.594 1.00 52.44 C ATOM 5 O THR A 1 -9.500 5.363 -13.156 1.00 52.44 O ATOM 6 CG2 THR A 1 -13.141 7.035 -14.344 1.00 52.44 C ATOM 7 OG1 THR A 1 -13.688 4.910 -13.344 1.00 52.44 O ATOM 8 N TYR A 2 -10.070 3.242 -13.570 1.00 35.91 N ATOM 9 CA TYR A 2 -9.055 2.412 -12.930 1.00 35.91 C ATOM 10 C TYR A 2 -8.008 1.958 -13.938 1.00 35.91 C ATOM 11 CB TYR A 2 -9.703 1.195 -12.266 1.00 35.91 C ATOM 12 O TYR A 2 -6.824 1.831 -13.602 1.00 35.91 O ATOM 13 CG TYR A 2 -10.414 1.517 -10.977 1.00 35.91 C ATOM 14 CD1 TYR A 2 -9.719 1.607 -9.773 1.00 35.91 C ATOM 15 CD2 TYR A 2 -11.789 1.729 -10.953 1.00 35.91 C ATOM 16 CE1 TYR A 2 -10.367 1.902 -8.578 1.00 35.91 C ATOM 17 CE2 TYR A 2 -12.453 2.025 -9.766 1.00 35.91 C ATOM 18 OH TYR A 2 -12.391 2.400 -7.410 1.00 35.91 O ATOM 19 CZ TYR A 2 -11.734 2.109 -8.586 1.00 35.91 C ATOM 20 N TRP A 3 -8.352 2.096 -15.336 1.00 39.66 N ATOM 21 CA TRP A 3 -7.492 1.658 -16.438 1.00 39.66 C ATOM 22 C TRP A 3 -6.656 2.816 -16.969 1.00 39.66 C ATOM 23 CB TRP A 3 -8.328 1.050 -17.562 1.00 39.66 C ATOM 24 O TRP A 3 -5.473 2.652 -17.266 1.00 39.66 O ATOM 25 CG TRP A 3 -7.527 0.279 -18.562 1.00 39.66 C ATOM 26 CD1 TRP A 3 -6.559 -0.649 -18.312 1.00 39.66 C ATOM 27 CD2 TRP A 3 -7.625 0.374 -19.984 1.00 39.66 C ATOM 28 CE2 TRP A 3 -6.684 -0.527 -20.531 1.00 39.66 C ATOM 29 CE3 TRP A 3 -8.422 1.135 -20.859 1.00 39.66 C ATOM 30 NE1 TRP A 3 -6.047 -1.138 -19.484 1.00 39.66 N ATOM 31 CH2 TRP A 3 -7.301 0.068 -22.734 1.00 39.66 C ATOM 32 CZ2 TRP A 3 -6.512 -0.688 -21.906 1.00 39.66 C ATOM 33 CZ3 TRP A 3 -8.250 0.972 -22.234 1.00 39.66 C ATOM 34 N ARG A 4 -7.117 4.031 -16.859 1.00 42.56 N ATOM 35 CA ARG A 4 -6.445 5.277 -17.219 1.00 42.56 C ATOM 36 C ARG A 4 -5.512 5.730 -16.094 1.00 42.56 C ATOM 37 CB ARG A 4 -7.469 6.375 -17.516 1.00 42.56 C ATOM 38 O ARG A 4 -4.449 6.293 -16.359 1.00 42.56 O ATOM 39 CG ARG A 4 -7.602 6.703 -19.000 1.00 42.56 C ATOM 40 CD ARG A 4 -8.797 7.602 -19.266 1.00 42.56 C ATOM 41 NE ARG A 4 -8.445 8.719 -20.141 1.00 42.56 N ATOM 42 NH1 ARG A 4 -10.516 8.836 -21.172 1.00 42.56 N ATOM 43 NH2 ARG A 4 -8.844 10.289 -21.766 1.00 42.56 N ATOM 44 CZ ARG A 4 -9.266 9.273 -21.031 1.00 42.56 C ATOM 45 N LEU A 5 -5.637 5.242 -14.852 1.00 38.41 N ATOM 46 CA LEU A 5 -4.867 5.562 -13.656 1.00 38.41 C ATOM 47 C LEU A 5 -3.656 4.645 -13.523 1.00 38.41 C ATOM 48 CB LEU A 5 -5.742 5.449 -12.406 1.00 38.41 C ATOM 49 O LEU A 5 -2.590 5.074 -13.078 1.00 38.41 O ATOM 50 CG LEU A 5 -6.164 6.766 -11.750 1.00 38.41 C ATOM 51 CD1 LEU A 5 -7.594 6.672 -11.234 1.00 38.41 C ATOM 52 CD2 LEU A 5 -5.207 7.129 -10.617 1.00 38.41 C ATOM 53 N ASN A 6 -3.758 3.561 -14.227 1.00 41.47 N ATOM 54 CA ASN A 6 -2.736 2.521 -14.281 1.00 41.47 C ATOM 55 C ASN A 6 -1.729 2.779 -15.398 1.00 41.47 C ATOM 56 CB ASN A 6 -3.379 1.144 -14.453 1.00 41.47 C ATOM 57 O ASN A 6 -0.572 2.369 -15.305 1.00 41.47 O ATOM 58 CG ASN A 6 -3.148 0.239 -13.258 1.00 41.47 C ATOM 59 ND2 ASN A 6 -3.877 -0.871 -13.203 1.00 41.47 N ATOM 60 OD1 ASN A 6 -2.324 0.536 -12.391 1.00 41.47 O ATOM 61 N GLN A 7 -2.035 3.705 -16.344 1.00 37.69 N ATOM 62 CA GLN A 7 -1.188 4.156 -17.453 1.00 37.69 C ATOM 63 C GLN A 7 -0.418 5.418 -17.062 1.00 37.69 C ATOM 64 CB GLN A 7 -2.025 4.410 -18.703 1.00 37.69 C ATOM 65 O GLN A 7 0.690 5.645 -17.562 1.00 37.69 O ATOM 66 CG GLN A 7 -2.520 3.141 -19.375 1.00 37.69 C ATOM 67 CD GLN A 7 -1.533 2.594 -20.391 1.00 37.69 C ATOM 68 NE2 GLN A 7 -2.025 1.779 -21.328 1.00 37.69 N ATOM 69 OE1 GLN A 7 -0.338 2.900 -20.344 1.00 37.69 O ATOM 70 N GLU A 8 -0.865 6.051 -16.031 1.00 38.16 N ATOM 71 CA GLU A 8 -0.228 7.258 -15.516 1.00 38.16 C ATOM 72 C GLU A 8 0.806 6.922 -14.445 1.00 38.16 C ATOM 73 CB GLU A 8 -1.277 8.219 -14.953 1.00 38.16 C ATOM 74 O GLU A 8 1.808 7.625 -14.297 1.00 38.16 O ATOM 75 CG GLU A 8 -1.412 9.516 -15.734 1.00 38.16 C ATOM 76 CD GLU A 8 -2.553 10.398 -15.250 1.00 38.16 C ATOM 77 OE1 GLU A 8 -2.379 11.633 -15.188 1.00 38.16 O ATOM 78 OE2 GLU A 8 -3.629 9.844 -14.930 1.00 38.16 O ATOM 79 N VAL A 9 0.892 5.688 -13.969 1.00 44.97 N ATOM 80 CA VAL A 9 1.771 5.137 -12.938 1.00 44.97 C ATOM 81 C VAL A 9 2.803 4.211 -13.586 1.00 44.97 C ATOM 82 CB VAL A 9 0.973 4.375 -11.859 1.00 44.97 C ATOM 83 O VAL A 9 3.877 3.984 -13.023 1.00 44.97 O ATOM 84 CG1 VAL A 9 1.892 3.936 -10.719 1.00 44.97 C ATOM 85 CG2 VAL A 9 -0.166 5.242 -11.328 1.00 44.97 C ATOM 86 N GLY A 11 4.523 5.121 -16.844 1.00 36.56 N ATOM 87 CA GLY A 11 5.383 5.770 -17.828 1.00 36.56 C ATOM 88 C GLY A 11 6.602 6.430 -17.203 1.00 36.56 C ATOM 89 O GLY A 11 6.711 6.523 -15.984 1.00 36.56 O ATOM 90 N PRO A 12 7.855 6.551 -17.938 1.00 35.81 N ATOM 91 CA PRO A 12 9.195 6.922 -17.484 1.00 35.81 C ATOM 92 C PRO A 12 9.242 8.305 -16.844 1.00 35.81 C ATOM 93 CB PRO A 12 10.023 6.883 -18.766 1.00 35.81 C ATOM 94 O PRO A 12 8.906 9.305 -17.500 1.00 35.81 O ATOM 95 CG PRO A 12 9.070 7.270 -19.859 1.00 35.81 C ATOM 96 CD PRO A 12 7.695 7.383 -19.266 1.00 35.81 C ATOM 97 N HIS A 13 8.562 8.562 -15.742 1.00 40.22 N ATOM 98 CA HIS A 13 8.727 9.891 -15.164 1.00 40.22 C ATOM 99 C HIS A 13 9.180 9.812 -13.711 1.00 40.22 C ATOM 100 CB HIS A 13 7.422 10.688 -15.266 1.00 40.22 C ATOM 101 O HIS A 13 8.477 9.250 -12.867 1.00 40.22 O ATOM 102 CG HIS A 13 7.414 11.688 -16.375 1.00 40.22 C ATOM 103 CD2 HIS A 13 6.930 11.602 -17.641 1.00 40.22 C ATOM 104 ND1 HIS A 13 7.953 12.945 -16.250 1.00 40.22 N ATOM 105 CE1 HIS A 13 7.801 13.602 -17.391 1.00 40.22 C ATOM 106 NE2 HIS A 13 7.180 12.812 -18.250 1.00 40.22 N ATOM 107 N LYS A 16 7.859 12.430 -10.641 1.00 34.06 N ATOM 108 CA LYS A 16 6.453 12.828 -10.586 1.00 34.06 C ATOM 109 C LYS A 16 5.578 11.680 -10.086 1.00 34.06 C ATOM 110 CB LYS A 16 5.977 13.289 -11.961 1.00 34.06 C ATOM 111 O LYS A 16 4.543 11.906 -9.461 1.00 34.06 O ATOM 112 CG LYS A 16 4.816 14.273 -11.906 1.00 34.06 C ATOM 113 CD LYS A 16 4.715 15.086 -13.195 1.00 34.06 C ATOM 114 CE LYS A 16 3.504 16.016 -13.188 1.00 34.06 C ATOM 115 NZ LYS A 16 3.412 16.812 -14.438 1.00 34.06 N ATOM 116 N SER A 17 6.059 10.477 -10.016 1.00 40.88 N ATOM 117 CA SER A 17 5.480 9.211 -9.578 1.00 40.88 C ATOM 118 C SER A 17 5.691 8.992 -8.086 1.00 40.88 C ATOM 119 CB SER A 17 6.086 8.047 -10.367 1.00 40.88 C ATOM 120 O SER A 17 4.836 8.414 -7.414 1.00 40.88 O ATOM 121 OG SER A 17 5.777 6.812 -9.758 1.00 40.88 O ATOM 122 N MET A 18 6.617 9.781 -7.621 1.00 43.66 N ATOM 123 CA MET A 18 6.863 9.805 -6.184 1.00 43.66 C ATOM 124 C MET A 18 6.004 10.867 -5.504 1.00 43.66 C ATOM 125 CB MET A 18 8.344 10.070 -5.895 1.00 43.66 C ATOM 126 O MET A 18 5.590 10.688 -4.355 1.00 43.66 O ATOM 127 CG MET A 18 9.141 8.812 -5.582 1.00 43.66 C ATOM 128 SD MET A 18 10.914 9.172 -5.250 1.00 43.66 S ATOM 129 CE MET A 18 11.562 9.188 -6.945 1.00 43.66 C ATOM 130 N PHE A 19 5.648 11.898 -6.109 1.00 37.25 N ATOM 131 CA PHE A 19 4.844 13.016 -5.641 1.00 37.25 C ATOM 132 C PHE A 19 3.357 12.719 -5.789 1.00 37.25 C ATOM 133 CB PHE A 19 5.203 14.297 -6.410 1.00 37.25 C ATOM 134 O PHE A 19 2.562 13.039 -4.906 1.00 37.25 O ATOM 135 CG PHE A 19 4.871 15.562 -5.668 1.00 37.25 C ATOM 136 CD1 PHE A 19 3.684 16.234 -5.918 1.00 37.25 C ATOM 137 CD2 PHE A 19 5.750 16.078 -4.727 1.00 37.25 C ATOM 138 CE1 PHE A 19 3.373 17.406 -5.234 1.00 37.25 C ATOM 139 CE2 PHE A 19 5.449 17.250 -4.039 1.00 37.25 C ATOM 140 CZ PHE A 19 4.262 17.922 -4.293 1.00 37.25 C ATOM 141 N ASP A 20 2.891 11.938 -6.746 1.00 42.03 N ATOM 142 CA ASP A 20 1.521 11.508 -7.012 1.00 42.03 C ATOM 143 C ASP A 20 1.120 10.352 -6.102 1.00 42.03 C ATOM 144 CB ASP A 20 1.361 11.102 -8.477 1.00 42.03 C ATOM 145 O ASP A 20 -0.035 10.250 -5.684 1.00 42.03 O ATOM 146 CG ASP A 20 1.140 12.289 -9.398 1.00 42.03 C ATOM 147 OD1 ASP A 20 0.198 13.078 -9.164 1.00 42.03 O ATOM 148 OD2 ASP A 20 1.911 12.438 -10.375 1.00 42.03 O ATOM 149 N ALA A 21 2.080 9.586 -5.570 1.00 43.38 N ATOM 150 CA ALA A 21 1.974 8.508 -4.590 1.00 43.38 C ATOM 151 C ALA A 21 1.893 9.070 -3.172 1.00 43.38 C ATOM 152 CB ALA A 21 3.160 7.555 -4.711 1.00 43.38 C ATOM 153 O ALA A 21 1.165 8.539 -2.328 1.00 43.38 O ATOM 154 N CYS A 23 0.495 12.289 -2.820 1.00 43.38 N ATOM 155 CA CYS A 23 -0.732 13.062 -2.982 1.00 43.38 C ATOM 156 C CYS A 23 -1.955 12.148 -2.969 1.00 43.38 C ATOM 157 CB CYS A 23 -0.695 13.867 -4.281 1.00 43.38 C ATOM 158 O CYS A 23 -2.984 12.492 -2.385 1.00 43.38 O ATOM 159 SG CYS A 23 -2.078 15.008 -4.473 1.00 43.38 S ATOM 160 N VAL A 24 -1.844 10.852 -3.369 1.00 43.78 N ATOM 161 CA VAL A 24 -2.838 9.781 -3.299 1.00 43.78 C ATOM 162 C VAL A 24 -2.828 9.164 -1.903 1.00 43.78 C ATOM 163 CB VAL A 24 -2.584 8.695 -4.367 1.00 43.78 C ATOM 164 O VAL A 24 -3.883 8.828 -1.358 1.00 43.78 O ATOM 165 CG1 VAL A 24 -3.574 7.547 -4.215 1.00 43.78 C ATOM 166 CG2 VAL A 24 -2.670 9.305 -5.770 1.00 43.78 C ATOM 167 N ILE A 25 -1.695 9.227 -1.212 1.00 43.47 N ATOM 168 CA ILE A 25 -1.423 8.859 0.173 1.00 43.47 C ATOM 169 C ILE A 25 -1.917 9.961 1.106 1.00 43.47 C ATOM 170 CB ILE A 25 0.083 8.594 0.403 1.00 43.47 C ATOM 171 O ILE A 25 -2.463 9.680 2.176 1.00 43.47 O ATOM 172 CG1 ILE A 25 0.555 7.414 -0.448 1.00 43.47 C ATOM 173 CG2 ILE A 25 0.368 8.352 1.888 1.00 43.47 C ATOM 174 CD1 ILE A 25 2.066 7.230 -0.470 1.00 43.47 C ATOM 175 N LYS A 27 -4.473 12.031 0.154 1.00 39.59 N ATOM 176 CA LYS A 27 -5.891 12.008 -0.198 1.00 39.59 C ATOM 177 C LYS A 27 -6.574 10.766 0.369 1.00 39.59 C ATOM 178 CB LYS A 27 -6.066 12.055 -1.716 1.00 39.59 C ATOM 179 O LYS A 27 -7.742 10.812 0.758 1.00 39.59 O ATOM 180 CG LYS A 27 -6.602 13.383 -2.234 1.00 39.59 C ATOM 181 CD LYS A 27 -7.000 13.289 -3.701 1.00 39.59 C ATOM 182 CE LYS A 27 -7.543 14.617 -4.219 1.00 39.59 C ATOM 183 NZ LYS A 27 -7.758 14.586 -5.695 1.00 39.59 N ATOM 184 N ASN A 30 -7.133 11.602 4.301 1.00 42.59 N ATOM 185 CA ASN A 30 -8.211 12.547 4.586 1.00 42.59 C ATOM 186 C ASN A 30 -9.578 11.898 4.410 1.00 42.59 C ATOM 187 CB ASN A 30 -8.086 13.781 3.697 1.00 42.59 C ATOM 188 O ASN A 30 -10.539 12.273 5.090 1.00 42.59 O ATOM 189 CG ASN A 30 -8.523 15.055 4.402 1.00 42.59 C ATOM 190 ND2 ASN A 30 -9.289 15.883 3.705 1.00 42.59 N ATOM 191 OD1 ASN A 30 -8.180 15.281 5.562 1.00 42.59 O ATOM 192 N GLU A 31 -9.547 10.523 3.945 1.00 39.59 N ATOM 193 CA GLU A 31 -10.836 9.914 3.637 1.00 39.59 C ATOM 194 C GLU A 31 -10.891 8.469 4.141 1.00 39.59 C ATOM 195 CB GLU A 31 -11.102 9.953 2.131 1.00 39.59 C ATOM 196 O GLU A 31 -11.969 7.957 4.445 1.00 39.59 O ATOM 197 CG GLU A 31 -11.844 11.203 1.672 1.00 39.59 C ATOM 198 CD GLU A 31 -12.297 11.133 0.222 1.00 39.59 C ATOM 199 OE1 GLU A 31 -13.508 10.938 -0.029 1.00 39.59 O ATOM 200 OE2 GLU A 31 -11.430 11.273 -0.671 1.00 39.59 O ATOM 201 N ILE A 32 -9.867 7.953 5.051 1.00 41.66 N ATOM 202 CA ILE A 32 -9.820 6.543 5.418 1.00 41.66 C ATOM 203 C ILE A 32 -9.367 6.402 6.871 1.00 41.66 C ATOM 204 CB ILE A 32 -8.883 5.746 4.484 1.00 41.66 C ATOM 205 O ILE A 32 -8.328 6.934 7.258 1.00 41.66 O ATOM 206 CG1 ILE A 32 -9.305 5.930 3.023 1.00 41.66 C ATOM 207 CG2 ILE A 32 -8.867 4.262 4.871 1.00 41.66 C ATOM 208 CD1 ILE A 32 -8.305 5.371 2.018 1.00 41.66 C ATOM 209 N PRO A 34 -8.086 7.172 10.898 1.00 43.25 N ATOM 210 CA PRO A 34 -6.926 7.301 11.789 1.00 43.25 C ATOM 211 C PRO A 34 -6.309 5.953 12.156 1.00 43.25 C ATOM 212 CB PRO A 34 -7.512 7.988 13.023 1.00 43.25 C ATOM 213 O PRO A 34 -5.129 5.891 12.508 1.00 43.25 O ATOM 214 CG PRO A 34 -8.992 7.949 12.820 1.00 43.25 C ATOM 215 CD PRO A 34 -9.273 7.340 11.477 1.00 43.25 C ATOM 216 N LEU A 35 -6.676 4.789 11.664 1.00 42.12 N ATOM 217 CA LEU A 35 -6.188 3.488 12.109 1.00 42.12 C ATOM 218 C LEU A 35 -5.469 2.760 10.977 1.00 42.12 C ATOM 219 CB LEU A 35 -7.344 2.631 12.633 1.00 42.12 C ATOM 220 O LEU A 35 -4.547 1.981 11.227 1.00 42.12 O ATOM 221 CG LEU A 35 -7.773 2.885 14.078 1.00 42.12 C ATOM 222 CD1 LEU A 35 -9.188 2.361 14.312 1.00 42.12 C ATOM 223 CD2 LEU A 35 -6.793 2.240 15.055 1.00 42.12 C ATOM 224 N MET A 36 -5.613 3.168 9.734 1.00 45.59 N ATOM 225 CA MET A 36 -4.969 2.674 8.523 1.00 45.59 C ATOM 226 C MET A 36 -3.799 3.570 8.125 1.00 45.59 C ATOM 227 CB MET A 36 -5.973 2.586 7.375 1.00 45.59 C ATOM 228 O MET A 36 -2.967 3.184 7.301 1.00 45.59 O ATOM 229 CG MET A 36 -6.770 1.290 7.355 1.00 45.59 C ATOM 230 SD MET A 36 -6.352 0.231 5.914 1.00 45.59 S ATOM 231 CE MET A 36 -7.258 1.100 4.605 1.00 45.59 C ATOM 232 N ARG A 38 -1.381 4.625 10.578 1.00 50.28 N ATOM 233 CA ARG A 38 -0.199 4.309 11.375 1.00 50.28 C ATOM 234 C ARG A 38 0.540 3.105 10.805 1.00 50.28 C ATOM 235 CB ARG A 38 -0.587 4.047 12.836 1.00 50.28 C ATOM 236 O ARG A 38 1.771 3.094 10.750 1.00 50.28 O ATOM 237 CG ARG A 38 0.578 4.137 13.805 1.00 50.28 C ATOM 238 CD ARG A 38 0.103 4.148 15.250 1.00 50.28 C ATOM 239 NE ARG A 38 1.218 4.305 16.188 1.00 50.28 N ATOM 240 NH1 ARG A 38 -0.099 4.910 17.984 1.00 50.28 N ATOM 241 NH2 ARG A 38 2.178 4.770 18.219 1.00 50.28 N ATOM 242 CZ ARG A 38 1.096 4.660 17.453 1.00 50.28 C ATOM 243 N GLN A 39 -0.160 2.143 10.414 1.00 48.69 N ATOM 244 CA GLN A 39 0.388 0.918 9.836 1.00 48.69 C ATOM 245 C GLN A 39 0.923 1.161 8.430 1.00 48.69 C ATOM 246 CB GLN A 39 -0.672 -0.185 9.812 1.00 48.69 C ATOM 247 O GLN A 39 1.948 0.596 8.039 1.00 48.69 O ATOM 248 CG GLN A 39 -1.088 -0.668 11.195 1.00 48.69 C ATOM 249 CD GLN A 39 -1.996 -1.883 11.141 1.00 48.69 C ATOM 250 NE2 GLN A 39 -1.841 -2.781 12.109 1.00 48.69 N ATOM 251 OE1 GLN A 39 -2.832 -2.012 10.242 1.00 48.69 O ATOM 252 N TYR A 40 0.257 2.031 7.762 1.00 52.22 N ATOM 253 CA TYR A 40 0.671 2.518 6.449 1.00 52.22 C ATOM 254 C TYR A 40 1.868 3.453 6.566 1.00 52.22 C ATOM 255 CB TYR A 40 -0.488 3.236 5.754 1.00 52.22 C ATOM 256 O TYR A 40 2.836 3.332 5.812 1.00 52.22 O ATOM 257 CG TYR A 40 -0.139 3.760 4.379 1.00 52.22 C ATOM 258 CD1 TYR A 40 0.189 5.102 4.188 1.00 52.22 C ATOM 259 CD2 TYR A 40 -0.139 2.918 3.273 1.00 52.22 C ATOM 260 CE1 TYR A 40 0.509 5.590 2.924 1.00 52.22 C ATOM 261 CE2 TYR A 40 0.179 3.395 2.008 1.00 52.22 C ATOM 262 OH TYR A 40 0.818 5.207 0.590 1.00 52.22 O ATOM 263 CZ TYR A 40 0.502 4.730 1.843 1.00 52.22 C ATOM 264 N TRP A 41 1.851 4.309 7.539 1.00 53.66 N ATOM 265 CA TRP A 41 2.953 5.215 7.836 1.00 53.66 C ATOM 266 C TRP A 41 4.148 4.453 8.398 1.00 53.66 C ATOM 267 CB TRP A 41 2.508 6.297 8.820 1.00 53.66 C ATOM 268 O TRP A 41 5.297 4.762 8.078 1.00 53.66 O ATOM 269 CG TRP A 41 1.925 7.516 8.172 1.00 53.66 C ATOM 270 CD1 TRP A 41 0.603 7.855 8.094 1.00 53.66 C ATOM 271 CD2 TRP A 41 2.646 8.555 7.500 1.00 53.66 C ATOM 272 CE2 TRP A 41 1.696 9.492 7.039 1.00 53.66 C ATOM 273 CE3 TRP A 41 4.004 8.781 7.242 1.00 53.66 C ATOM 274 NE1 TRP A 41 0.459 9.047 7.414 1.00 53.66 N ATOM 275 CH2 TRP A 41 3.400 10.836 6.098 1.00 53.66 C ATOM 276 CZ2 TRP A 41 2.064 10.641 6.336 1.00 53.66 C ATOM 277 CZ3 TRP A 41 4.367 9.922 6.543 1.00 53.66 C ATOM 278 N ASN A 42 3.961 3.379 9.195 1.00 56.44 N ATOM 279 CA ASN A 42 4.988 2.469 9.695 1.00 56.44 C ATOM 280 C ASN A 42 5.578 1.622 8.570 1.00 56.44 C ATOM 281 CB ASN A 42 4.422 1.567 10.789 1.00 56.44 C ATOM 282 O ASN A 42 6.773 1.333 8.562 1.00 56.44 O ATOM 283 CG ASN A 42 4.484 2.209 12.164 1.00 56.44 C ATOM 284 ND2 ASN A 42 3.396 2.113 12.914 1.00 56.44 N ATOM 285 OD1 ASN A 42 5.508 2.789 12.547 1.00 56.44 O ATOM 286 N CYS A 43 4.766 1.334 7.551 1.00 57.66 N ATOM 287 CA CYS A 43 5.156 0.599 6.355 1.00 57.66 C ATOM 288 C CYS A 43 5.957 1.483 5.406 1.00 57.66 C ATOM 289 CB CYS A 43 3.924 0.052 5.633 1.00 57.66 C ATOM 290 O CYS A 43 6.980 1.055 4.867 1.00 57.66 O ATOM 291 SG CYS A 43 4.309 -0.914 4.156 1.00 57.66 S ATOM 292 N VAL A 44 5.539 2.654 5.289 1.00 54.16 N ATOM 293 CA VAL A 44 6.207 3.676 4.492 1.00 54.16 C ATOM 294 C VAL A 44 7.527 4.070 5.156 1.00 54.16 C ATOM 295 CB VAL A 44 5.316 4.922 4.301 1.00 54.16 C ATOM 296 O VAL A 44 8.555 4.203 4.484 1.00 54.16 O ATOM 297 CG1 VAL A 44 6.082 6.031 3.578 1.00 54.16 C ATOM 298 CG2 VAL A 44 4.047 4.559 3.531 1.00 54.16 C ATOM 299 N LEU A 45 7.598 4.188 6.484 1.00 56.09 N ATOM 300 CA LEU A 45 8.789 4.488 7.273 1.00 56.09 C ATOM 301 C LEU A 45 9.750 3.305 7.281 1.00 56.09 C ATOM 302 CB LEU A 45 8.406 4.855 8.711 1.00 56.09 C ATOM 303 O LEU A 45 10.969 3.490 7.234 1.00 56.09 O ATOM 304 CG LEU A 45 7.750 6.223 8.906 1.00 56.09 C ATOM 305 CD1 LEU A 45 7.289 6.387 10.352 1.00 56.09 C ATOM 306 CD2 LEU A 45 8.711 7.340 8.516 1.00 56.09 C ATOM 307 N HIS A 47 9.914 1.160 4.891 1.00 59.59 N ATOM 308 CA HIS A 47 10.320 1.110 3.494 1.00 59.59 C ATOM 309 C HIS A 47 11.391 2.158 3.195 1.00 59.59 C ATOM 310 CB HIS A 47 9.117 1.312 2.574 1.00 59.59 C ATOM 311 O HIS A 47 12.359 1.878 2.488 1.00 59.59 O ATOM 312 CG HIS A 47 9.422 1.099 1.125 1.00 59.59 C ATOM 313 CD2 HIS A 47 9.531 -0.038 0.397 1.00 59.59 C ATOM 314 ND1 HIS A 47 9.672 2.139 0.255 1.00 59.59 N ATOM 315 CE1 HIS A 47 9.914 1.649 -0.949 1.00 59.59 C ATOM 316 NE2 HIS A 47 9.836 0.331 -0.890 1.00 59.59 N ATOM 317 N ALA A 49 13.484 3.404 5.453 1.00 56.31 N ATOM 318 CA ALA A 49 14.609 2.969 6.281 1.00 56.31 C ATOM 319 C ALA A 49 15.344 1.796 5.641 1.00 56.31 C ATOM 320 CB ALA A 49 14.125 2.588 7.680 1.00 56.31 C ATOM 321 O ALA A 49 16.578 1.702 5.727 1.00 56.31 O ATOM 322 N ASP A 50 14.656 0.914 4.977 1.00 56.75 N ATOM 323 CA ASP A 50 15.148 -0.239 4.227 1.00 56.75 C ATOM 324 C ASP A 50 15.844 0.200 2.939 1.00 56.75 C ATOM 325 CB ASP A 50 13.992 -1.193 3.902 1.00 56.75 C ATOM 326 O ASP A 50 16.875 -0.355 2.568 1.00 56.75 O ATOM 327 CG ASP A 50 14.469 -2.527 3.350 1.00 56.75 C ATOM 328 OD1 ASP A 50 14.414 -2.730 2.117 1.00 56.75 O ATOM 329 OD2 ASP A 50 14.898 -3.381 4.152 1.00 56.75 O ATOM 330 N LYS A 51 15.281 1.267 2.314 1.00 57.12 N ATOM 331 CA LYS A 51 15.875 1.887 1.136 1.00 57.12 C ATOM 332 C LYS A 51 17.141 2.660 1.501 1.00 57.12 C ATOM 333 CB LYS A 51 14.875 2.816 0.451 1.00 57.12 C ATOM 334 O LYS A 51 18.109 2.660 0.746 1.00 57.12 O ATOM 335 CG LYS A 51 13.945 2.111 -0.526 1.00 57.12 C ATOM 336 CD LYS A 51 13.133 3.109 -1.347 1.00 57.12 C ATOM 337 CE LYS A 51 12.180 2.404 -2.299 1.00 57.12 C ATOM 338 NZ LYS A 51 11.367 3.379 -3.090 1.00 57.12 N ATOM 339 N GLU A 52 17.156 3.314 2.674 1.00 51.50 N ATOM 340 CA GLU A 52 18.297 4.047 3.207 1.00 51.50 C ATOM 341 C GLU A 52 19.391 3.096 3.684 1.00 51.50 C ATOM 342 CB GLU A 52 17.859 4.965 4.355 1.00 51.50 C ATOM 343 O GLU A 52 20.578 3.361 3.494 1.00 51.50 O ATOM 344 CG GLU A 52 18.875 6.043 4.699 1.00 51.50 C ATOM 345 CD GLU A 52 18.406 6.988 5.789 1.00 51.50 C ATOM 346 OE1 GLU A 52 18.844 6.852 6.953 1.00 51.50 O ATOM 347 OE2 GLU A 52 17.578 7.875 5.480 1.00 51.50 O ATOM 348 N ILE A 53 19.109 1.938 4.207 1.00 50.25 N ATOM 349 CA ILE A 53 20.016 0.888 4.660 1.00 50.25 C ATOM 350 C ILE A 53 20.562 0.119 3.459 1.00 50.25 C ATOM 351 CB ILE A 53 19.312 -0.077 5.645 1.00 50.25 C ATOM 352 O ILE A 53 21.734 -0.268 3.438 1.00 50.25 O ATOM 353 CG1 ILE A 53 18.875 0.674 6.902 1.00 50.25 C ATOM 354 CG2 ILE A 53 20.234 -1.247 6.000 1.00 50.25 C ATOM 355 CD1 ILE A 53 17.922 -0.113 7.785 1.00 50.25 C ATOM 356 N ARG A 54 19.781 0.070 2.406 1.00 53.59 N ATOM 357 CA ARG A 54 20.078 -0.631 1.163 1.00 53.59 C ATOM 358 C ARG A 54 20.906 0.247 0.225 1.00 53.59 C ATOM 359 CB ARG A 54 18.797 -1.078 0.468 1.00 53.59 C ATOM 360 O ARG A 54 21.719 -0.257 -0.553 1.00 53.59 O ATOM 361 CG ARG A 54 18.094 -2.246 1.149 1.00 53.59 C ATOM 362 CD ARG A 54 16.875 -2.713 0.365 1.00 53.59 C ATOM 363 NE ARG A 54 16.172 -3.785 1.060 1.00 53.59 N ATOM 364 NH1 ARG A 54 14.102 -3.283 0.157 1.00 53.59 N ATOM 365 NH2 ARG A 54 14.328 -5.031 1.622 1.00 53.59 N ATOM 366 CZ ARG A 54 14.867 -4.031 0.944 1.00 53.59 C ATOM 367 N THR A 56 23.047 2.574 1.692 1.00 53.31 N ATOM 368 CA THR A 56 24.219 2.736 2.531 1.00 53.31 C ATOM 369 C THR A 56 25.047 1.456 2.547 1.00 53.31 C ATOM 370 CB THR A 56 23.828 3.117 3.973 1.00 53.31 C ATOM 371 O THR A 56 26.281 1.507 2.670 1.00 53.31 O ATOM 372 CG2 THR A 56 23.922 4.625 4.184 1.00 53.31 C ATOM 373 OG1 THR A 56 22.500 2.689 4.230 1.00 53.31 O ATOM 374 N ASN A 57 24.594 0.220 2.227 1.00 53.06 N ATOM 375 CA ASN A 57 25.266 -1.076 2.283 1.00 53.06 C ATOM 376 C ASN A 57 25.547 -1.626 0.887 1.00 53.06 C ATOM 377 CB ASN A 57 24.438 -2.074 3.092 1.00 53.06 C ATOM 378 O ASN A 57 26.094 -2.723 0.743 1.00 53.06 O ATOM 379 CG ASN A 57 24.953 -2.250 4.508 1.00 53.06 C ATOM 380 ND2 ASN A 57 24.094 -2.725 5.398 1.00 53.06 N ATOM 381 OD1 ASN A 57 26.109 -1.960 4.797 1.00 53.06 O ATOM 382 N GLN A 59 24.719 -3.041 -1.377 1.00 40.88 N ATOM 383 CA GLN A 59 24.281 -4.379 -1.750 1.00 40.88 C ATOM 384 C GLN A 59 23.422 -4.340 -3.016 1.00 40.88 C ATOM 385 CB GLN A 59 23.484 -5.020 -0.606 1.00 40.88 C ATOM 386 O GLN A 59 22.469 -3.566 -3.104 1.00 40.88 O ATOM 387 CG GLN A 59 24.328 -5.344 0.617 1.00 40.88 C ATOM 388 CD GLN A 59 23.875 -6.602 1.333 1.00 40.88 C ATOM 389 NE2 GLN A 59 24.672 -7.660 1.244 1.00 40.88 N ATOM 390 OE1 GLN A 59 22.812 -6.621 1.961 1.00 40.88 O ATOM 391 N PRO A 60 23.969 -4.656 -4.207 1.00 39.47 N ATOM 392 CA PRO A 60 23.359 -4.723 -5.539 1.00 39.47 C ATOM 393 C PRO A 60 22.250 -5.770 -5.629 1.00 39.47 C ATOM 394 CB PRO A 60 24.547 -5.098 -6.445 1.00 39.47 C ATOM 395 O PRO A 60 21.578 -5.871 -6.656 1.00 39.47 O ATOM 396 CG PRO A 60 25.484 -5.840 -5.559 1.00 39.47 C ATOM 397 CD PRO A 60 24.938 -5.820 -4.160 1.00 39.47 C ATOM 398 N TRP A 61 21.422 -6.020 -4.660 1.00 41.00 N ATOM 399 CA TRP A 61 20.375 -7.027 -4.832 1.00 41.00 C ATOM 400 C TRP A 61 19.000 -6.383 -4.957 1.00 41.00 C ATOM 401 CB TRP A 61 20.391 -8.016 -3.664 1.00 41.00 C ATOM 402 O TRP A 61 18.656 -5.484 -4.184 1.00 41.00 O ATOM 403 CG TRP A 61 21.734 -8.211 -3.045 1.00 41.00 C ATOM 404 CD1 TRP A 61 22.375 -7.375 -2.174 1.00 41.00 C ATOM 405 CD2 TRP A 61 22.625 -9.320 -3.254 1.00 41.00 C ATOM 406 CE2 TRP A 61 23.781 -9.086 -2.477 1.00 41.00 C ATOM 407 CE3 TRP A 61 22.547 -10.492 -4.023 1.00 41.00 C ATOM 408 NE1 TRP A 61 23.609 -7.895 -1.828 1.00 41.00 N ATOM 409 CH2 TRP A 61 24.750 -11.117 -3.211 1.00 41.00 C ATOM 410 CZ2 TRP A 61 24.859 -9.984 -2.449 1.00 41.00 C ATOM 411 CZ3 TRP A 61 23.609 -11.375 -3.994 1.00 41.00 C ATOM 412 N MET A 63 16.734 -4.129 -7.895 1.00 39.56 N ATOM 413 CA MET A 63 15.844 -3.215 -8.617 1.00 39.56 C ATOM 414 C MET A 63 14.539 -3.904 -8.984 1.00 39.56 C ATOM 415 CB MET A 63 16.531 -2.682 -9.875 1.00 39.56 C ATOM 416 O MET A 63 14.281 -4.168 -10.164 1.00 39.56 O ATOM 417 CG MET A 63 16.766 -1.181 -9.852 1.00 39.56 C ATOM 418 SD MET A 63 18.141 -0.672 -10.953 1.00 39.56 S ATOM 419 CE MET A 63 19.188 0.216 -9.766 1.00 39.56 C ATOM 420 N GLU A 65 11.680 -2.992 -8.000 1.00 41.31 N ATOM 421 CA GLU A 65 10.547 -2.092 -7.812 1.00 41.31 C ATOM 422 C GLU A 65 9.578 -2.635 -6.766 1.00 41.31 C ATOM 423 CB GLU A 65 9.812 -1.864 -9.141 1.00 41.31 C ATOM 424 O GLU A 65 8.914 -3.650 -6.992 1.00 41.31 O ATOM 425 CG GLU A 65 10.156 -0.542 -9.812 1.00 41.31 C ATOM 426 CD GLU A 65 9.477 -0.363 -11.164 1.00 41.31 C ATOM 427 OE1 GLU A 65 8.484 0.396 -11.242 1.00 41.31 O ATOM 428 OE2 GLU A 65 9.938 -0.988 -12.141 1.00 41.31 O ATOM 429 N PHE A 66 10.070 -3.223 -5.668 1.00 43.75 N ATOM 430 CA PHE A 66 9.125 -3.523 -4.598 1.00 43.75 C ATOM 431 C PHE A 66 8.125 -2.389 -4.426 1.00 43.75 C ATOM 432 CB PHE A 66 9.867 -3.771 -3.279 1.00 43.75 C ATOM 433 O PHE A 66 8.508 -1.239 -4.207 1.00 43.75 O ATOM 434 CG PHE A 66 9.656 -5.148 -2.713 1.00 43.75 C ATOM 435 CD1 PHE A 66 8.625 -5.395 -1.812 1.00 43.75 C ATOM 436 CD2 PHE A 66 10.484 -6.199 -3.082 1.00 43.75 C ATOM 437 CE1 PHE A 66 8.430 -6.672 -1.288 1.00 43.75 C ATOM 438 CE2 PHE A 66 10.297 -7.477 -2.562 1.00 43.75 C ATOM 439 CZ PHE A 66 9.266 -7.711 -1.664 1.00 43.75 C ATOM 440 N SER A 67 7.160 -2.164 -5.305 1.00 50.88 N ATOM 441 CA SER A 67 6.051 -1.220 -5.320 1.00 50.88 C ATOM 442 C SER A 67 5.473 -1.024 -3.922 1.00 50.88 C ATOM 443 CB SER A 67 4.953 -1.696 -6.273 1.00 50.88 C ATOM 444 O SER A 67 5.293 -1.991 -3.180 1.00 50.88 O ATOM 445 OG SER A 67 5.348 -1.521 -7.621 1.00 50.88 O ATOM 446 N LEU A 68 5.949 -0.143 -3.232 1.00 48.59 N ATOM 447 CA LEU A 68 5.316 0.361 -2.020 1.00 48.59 C ATOM 448 C LEU A 68 3.908 -0.207 -1.866 1.00 48.59 C ATOM 449 CB LEU A 68 5.262 1.892 -2.039 1.00 48.59 C ATOM 450 O LEU A 68 3.498 -0.568 -0.761 1.00 48.59 O ATOM 451 CG LEU A 68 4.812 2.570 -0.745 1.00 48.59 C ATOM 452 CD1 LEU A 68 5.879 2.412 0.334 1.00 48.59 C ATOM 453 CD2 LEU A 68 4.508 4.043 -0.991 1.00 48.59 C ATOM 454 N ALA A 69 3.396 -0.511 -2.990 1.00 45.38 N ATOM 455 CA ALA A 69 2.053 -1.080 -3.051 1.00 45.38 C ATOM 456 C ALA A 69 2.076 -2.574 -2.744 1.00 45.38 C ATOM 457 CB ALA A 69 1.433 -0.833 -4.426 1.00 45.38 C ATOM 458 O ALA A 69 1.185 -3.088 -2.062 1.00 45.38 O ATOM 459 N GLY A 70 3.055 -3.355 -3.105 1.00 48.12 N ATOM 460 CA GLY A 70 3.338 -4.742 -2.766 1.00 48.12 C ATOM 461 C GLY A 70 3.850 -4.914 -1.348 1.00 48.12 C ATOM 462 O GLY A 70 3.553 -5.918 -0.694 1.00 48.12 O ATOM 463 N TYR A 71 4.562 -4.000 -0.781 1.00 51.66 N ATOM 464 CA TYR A 71 5.062 -3.924 0.586 1.00 51.66 C ATOM 465 C TYR A 71 3.943 -3.576 1.560 1.00 51.66 C ATOM 466 CB TYR A 71 6.188 -2.887 0.689 1.00 51.66 C ATOM 467 O TYR A 71 3.820 -4.191 2.619 1.00 51.66 O ATOM 468 CG TYR A 71 6.836 -2.830 2.051 1.00 51.66 C ATOM 469 CD1 TYR A 71 6.453 -1.876 2.988 1.00 51.66 C ATOM 470 CD2 TYR A 71 7.840 -3.729 2.398 1.00 51.66 C ATOM 471 CE1 TYR A 71 7.051 -1.819 4.242 1.00 51.66 C ATOM 472 CE2 TYR A 71 8.445 -3.682 3.650 1.00 51.66 C ATOM 473 OH TYR A 71 8.641 -2.672 5.805 1.00 51.66 O ATOM 474 CZ TYR A 71 8.047 -2.725 4.566 1.00 51.66 C ATOM 475 N CYS A 72 3.072 -2.650 1.136 1.00 52.06 N ATOM 476 CA CYS A 72 1.923 -2.197 1.911 1.00 52.06 C ATOM 477 C CYS A 72 0.767 -3.184 1.797 1.00 52.06 C ATOM 478 CB CYS A 72 1.473 -0.814 1.444 1.00 52.06 C ATOM 479 O CYS A 72 -0.026 -3.328 2.729 1.00 52.06 O ATOM 480 SG CYS A 72 2.547 0.527 2.000 1.00 52.06 S ATOM 481 N HIS A 73 0.740 -4.012 0.721 1.00 53.31 N ATOM 482 CA HIS A 73 -0.142 -5.148 0.482 1.00 53.31 C ATOM 483 C HIS A 73 0.256 -6.344 1.340 1.00 53.31 C ATOM 484 CB HIS A 73 -0.128 -5.535 -0.998 1.00 53.31 C ATOM 485 O HIS A 73 -0.607 -7.043 1.881 1.00 53.31 O ATOM 486 CG HIS A 73 -1.178 -6.535 -1.366 1.00 53.31 C ATOM 487 CD2 HIS A 73 -2.463 -6.371 -1.762 1.00 53.31 C ATOM 488 ND1 HIS A 73 -0.951 -7.895 -1.347 1.00 53.31 N ATOM 489 CE1 HIS A 73 -2.053 -8.523 -1.716 1.00 53.31 C ATOM 490 NE2 HIS A 73 -2.986 -7.625 -1.973 1.00 53.31 N ATOM 491 N VAL A 75 1.921 -6.090 4.254 1.00 50.06 N ATOM 492 CA VAL A 75 1.792 -5.539 5.598 1.00 50.06 C ATOM 493 C VAL A 75 0.318 -5.477 5.992 1.00 50.06 C ATOM 494 CB VAL A 75 2.430 -4.133 5.699 1.00 50.06 C ATOM 495 O VAL A 75 -0.037 -5.758 7.141 1.00 50.06 O ATOM 496 CG1 VAL A 75 2.662 -3.748 7.156 1.00 50.06 C ATOM 497 CG2 VAL A 75 3.740 -4.086 4.914 1.00 50.06 C ATOM 498 N ASN A 76 -0.514 -5.180 5.016 1.00 47.22 N ATOM 499 CA ASN A 76 -1.965 -5.188 5.172 1.00 47.22 C ATOM 500 C ASN A 76 -2.523 -6.609 5.137 1.00 47.22 C ATOM 501 CB ASN A 76 -2.625 -4.332 4.086 1.00 47.22 C ATOM 502 O ASN A 76 -3.551 -6.891 5.758 1.00 47.22 O ATOM 503 CG ASN A 76 -2.678 -2.863 4.453 1.00 47.22 C ATOM 504 ND2 ASN A 76 -2.605 -1.998 3.449 1.00 47.22 N ATOM 505 OD1 ASN A 76 -2.781 -2.510 5.633 1.00 47.22 O ATOM 506 N LYS A 77 -1.939 -7.613 4.465 1.00 48.78 N ATOM 507 CA LYS A 77 -2.221 -9.047 4.469 1.00 48.78 C ATOM 508 C LYS A 77 -1.777 -9.688 5.781 1.00 48.78 C ATOM 509 CB LYS A 77 -1.532 -9.734 3.289 1.00 48.78 C ATOM 510 O LYS A 77 -2.432 -10.602 6.281 1.00 48.78 O ATOM 511 CG LYS A 77 -2.383 -10.797 2.609 1.00 48.78 C ATOM 512 CD LYS A 77 -1.631 -11.469 1.469 1.00 48.78 C ATOM 513 CE LYS A 77 -2.465 -12.562 0.816 1.00 48.78 C ATOM 514 NZ LYS A 77 -1.760 -13.180 -0.347 1.00 48.78 N ATOM 515 N ALA A 79 -1.579 -7.875 8.617 1.00 43.97 N ATOM 516 CA ALA A 79 -2.482 -7.195 9.539 1.00 43.97 C ATOM 517 C ALA A 79 -3.910 -7.711 9.391 1.00 43.97 C ATOM 518 CB ALA A 79 -2.441 -5.688 9.305 1.00 43.97 C ATOM 519 O ALA A 79 -4.664 -7.754 10.367 1.00 43.97 O ATOM 520 N ASP A 80 -4.344 -8.055 8.180 1.00 44.59 N ATOM 521 CA ASP A 80 -5.574 -8.758 7.824 1.00 44.59 C ATOM 522 C ASP A 80 -5.516 -10.219 8.266 1.00 44.59 C ATOM 523 CB ASP A 80 -5.828 -8.672 6.316 1.00 44.59 C ATOM 524 O ASP A 80 -6.527 -10.781 8.688 1.00 44.59 O ATOM 525 CG ASP A 80 -7.289 -8.859 5.953 1.00 44.59 C ATOM 526 OD1 ASP A 80 -7.660 -9.945 5.461 1.00 44.59 O ATOM 527 OD2 ASP A 80 -8.078 -7.910 6.152 1.00 44.59 O ATOM 528 N ILE A 81 -4.266 -10.898 8.195 1.00 42.56 N ATOM 529 CA ILE A 81 -4.012 -12.242 8.719 1.00 42.56 C ATOM 530 C ILE A 81 -3.934 -12.188 10.242 1.00 42.56 C ATOM 531 CB ILE A 81 -2.715 -12.836 8.141 1.00 42.56 C ATOM 532 O ILE A 81 -4.430 -13.086 10.930 1.00 42.56 O ATOM 533 CG1 ILE A 81 -2.867 -13.078 6.629 1.00 42.56 C ATOM 534 CG2 ILE A 81 -2.346 -14.141 8.859 1.00 42.56 C ATOM 535 CD1 ILE A 81 -1.552 -13.336 5.906 1.00 42.56 C ATOM 536 N GLU A 82 -3.447 -11.125 10.828 1.00 42.00 N ATOM 537 CA GLU A 82 -3.395 -10.859 12.266 1.00 42.00 C ATOM 538 C GLU A 82 -4.738 -10.359 12.781 1.00 42.00 C ATOM 539 CB GLU A 82 -2.295 -9.836 12.578 1.00 42.00 C ATOM 540 O GLU A 82 -5.125 -10.656 13.914 1.00 42.00 O ATOM 541 CG GLU A 82 -0.992 -10.469 13.047 1.00 42.00 C ATOM 542 CD GLU A 82 -0.322 -9.695 14.172 1.00 42.00 C ATOM 543 OE1 GLU A 82 -0.140 -10.258 15.273 1.00 42.00 O ATOM 544 OE2 GLU A 82 0.022 -8.508 13.945 1.00 42.00 O ATOM 545 N ARG A 84 -7.695 -11.273 11.117 1.00 43.47 N ATOM 546 CA ARG A 84 -8.469 -12.477 10.844 1.00 43.47 C ATOM 547 C ARG A 84 -8.031 -13.625 11.750 1.00 43.47 C ATOM 548 CB ARG A 84 -8.328 -12.883 9.375 1.00 43.47 C ATOM 549 O ARG A 84 -8.836 -14.500 12.078 1.00 43.47 O ATOM 550 CG ARG A 84 -9.289 -12.164 8.445 1.00 43.47 C ATOM 551 CD ARG A 84 -9.281 -12.773 7.047 1.00 43.47 C ATOM 552 NE ARG A 84 -9.500 -11.758 6.016 1.00 43.47 N ATOM 553 NH1 ARG A 84 -10.070 -13.266 4.363 1.00 43.47 N ATOM 554 NH2 ARG A 84 -10.031 -11.023 3.908 1.00 43.47 N ATOM 555 CZ ARG A 84 -9.867 -12.016 4.766 1.00 43.47 C ATOM 556 N THR A 85 -6.656 -13.656 12.094 1.00 44.12 N ATOM 557 CA THR A 85 -6.074 -14.602 13.039 1.00 44.12 C ATOM 558 C THR A 85 -6.340 -14.148 14.477 1.00 44.12 C ATOM 559 CB THR A 85 -4.559 -14.750 12.820 1.00 44.12 C ATOM 560 O THR A 85 -6.469 -14.984 15.375 1.00 44.12 O ATOM 561 CG2 THR A 85 -4.207 -16.172 12.406 1.00 44.12 C ATOM 562 OG1 THR A 85 -4.137 -13.852 11.797 1.00 44.12 O ATOM 563 N TYR A 86 -6.621 -12.773 14.727 1.00 41.78 N ATOM 564 CA TYR A 86 -7.027 -12.266 16.031 1.00 41.78 C ATOM 565 C TYR A 86 -8.531 -12.016 16.078 1.00 41.78 C ATOM 566 CB TYR A 86 -6.270 -10.977 16.359 1.00 41.78 C ATOM 567 O TYR A 86 -9.078 -11.695 17.141 1.00 41.78 O ATOM 568 CG TYR A 86 -4.789 -11.180 16.578 1.00 41.78 C ATOM 569 CD1 TYR A 86 -4.305 -11.742 17.750 1.00 41.78 C ATOM 570 CD2 TYR A 86 -3.871 -10.797 15.602 1.00 41.78 C ATOM 571 CE1 TYR A 86 -2.939 -11.930 17.953 1.00 41.78 C ATOM 572 CE2 TYR A 86 -2.506 -10.984 15.789 1.00 41.78 C ATOM 573 OH TYR A 86 -0.699 -11.727 17.156 1.00 41.78 O ATOM 574 CZ TYR A 86 -2.051 -11.547 16.969 1.00 41.78 C ATOM 575 N TRP A 88 -10.516 -14.523 14.469 1.00 41.56 N ATOM 576 CA TRP A 88 -10.875 -15.938 14.469 1.00 41.56 C ATOM 577 C TRP A 88 -10.117 -16.688 15.562 1.00 41.56 C ATOM 578 CB TRP A 88 -10.586 -16.562 13.102 1.00 41.56 C ATOM 579 O TRP A 88 -10.211 -17.906 15.664 1.00 41.56 O ATOM 580 CG TRP A 88 -11.727 -16.469 12.141 1.00 41.56 C ATOM 581 CD1 TRP A 88 -12.406 -15.336 11.773 1.00 41.56 C ATOM 582 CD2 TRP A 88 -12.328 -17.547 11.414 1.00 41.56 C ATOM 583 CE2 TRP A 88 -13.367 -16.984 10.625 1.00 41.56 C ATOM 584 CE3 TRP A 88 -12.094 -18.922 11.352 1.00 41.56 C ATOM 585 NE1 TRP A 88 -13.391 -15.641 10.867 1.00 41.56 N ATOM 586 CH2 TRP A 88 -13.906 -19.125 9.742 1.00 41.56 C ATOM 587 CZ2 TRP A 88 -14.164 -17.766 9.789 1.00 41.56 C ATOM 588 CZ3 TRP A 88 -12.883 -19.703 10.516 1.00 41.56 C ATOM 589 N ALA A 89 -9.453 -16.047 16.516 1.00 30.75 N ATOM 590 CA ALA A 89 -9.016 -16.672 17.750 1.00 30.75 C ATOM 591 C ALA A 89 -10.062 -16.500 18.844 1.00 30.75 C ATOM 592 CB ALA A 89 -7.680 -16.094 18.203 1.00 30.75 C ATOM 593 O ALA A 89 -10.609 -15.414 19.031 1.00 30.75 O ATOM 594 N PRO A 90 -11.047 -17.531 18.938 1.00 30.00 N ATOM 595 CA PRO A 90 -11.805 -17.516 20.188 1.00 30.00 C ATOM 596 C PRO A 90 -11.023 -16.875 21.344 1.00 30.00 C ATOM 597 CB PRO A 90 -12.055 -19.000 20.469 1.00 30.00 C ATOM 598 O PRO A 90 -9.789 -16.906 21.359 1.00 30.00 O ATOM 599 CG PRO A 90 -11.047 -19.719 19.641 1.00 30.00 C ATOM 600 CD PRO A 90 -10.227 -18.703 18.891 1.00 30.00 C ATOM 601 N GLN A 91 -11.070 -15.555 21.500 1.00 29.56 N ATOM 602 CA GLN A 91 -10.742 -15.281 22.891 1.00 29.56 C ATOM 603 C GLN A 91 -10.203 -16.531 23.594 1.00 29.56 C ATOM 604 CB GLN A 91 -11.969 -14.750 23.641 1.00 29.56 C ATOM 605 O GLN A 91 -10.945 -17.500 23.797 1.00 29.56 O ATOM 606 CG GLN A 91 -12.398 -13.359 23.203 1.00 29.56 C ATOM 607 CD GLN A 91 -13.305 -12.680 24.203 1.00 29.56 C ATOM 608 NE2 GLN A 91 -13.305 -11.352 24.203 1.00 29.56 N ATOM 609 OE1 GLN A 91 -13.992 -13.344 24.984 1.00 29.56 O ATOM 610 N LEU A 93 -6.863 -16.875 25.438 1.00 29.66 N ATOM 611 CA LEU A 93 -6.129 -16.844 26.688 1.00 29.66 C ATOM 612 C LEU A 93 -5.719 -15.422 27.047 1.00 29.66 C ATOM 613 CB LEU A 93 -4.887 -17.734 26.609 1.00 29.66 C ATOM 614 O LEU A 93 -5.160 -14.703 26.203 1.00 29.66 O ATOM 615 CG LEU A 93 -5.141 -19.250 26.609 1.00 29.66 C ATOM 616 CD1 LEU A 93 -3.869 -20.000 26.203 1.00 29.66 C ATOM 617 CD2 LEU A 93 -5.641 -19.719 27.969 1.00 29.66 C TER 618 LEU A 93 ENDMDL END If you find results from this site helpful for your research, please cite one of our papers:
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