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*** proz_dps ***elNémo ID: 2208130311061057Job options:ID = 2208130311061057 JOBID = proz_dps USERID = unknown PRIVAT = 0 NMODES = 25 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER proz_dps REMARK GENERATED BY CHARMM-GUI (HTTP://WWW.CHARMM-GUI.ORG) V3.7 ON AUG, 11. 2022. JOB REMARK READ PDB, MANIPULATE STRUCTURE IF NEEDED, AND GENERATE TOPOLOGY FILE REMARK DATE: 8/11/22 23:15: 9 CREATED BY USER: apache ATOM 1 N ALA P 1 8.256 27.847 25.592 1.00 0.00 PROA ATOM 2 HT1 ALA P 1 8.540 26.953 26.042 1.00 0.00 PROA ATOM 3 HT2 ALA P 1 8.035 27.676 24.590 1.00 0.00 PROA ATOM 4 HT3 ALA P 1 7.415 28.225 26.073 1.00 0.00 PROA ATOM 5 CA ALA P 1 9.375 28.835 25.694 1.00 0.00 PROA ATOM 6 HA ALA P 1 10.169 28.502 25.043 1.00 0.00 PROA ATOM 7 CB ALA P 1 8.891 30.266 25.278 1.00 0.00 PROA ATOM 8 HB1 ALA P 1 8.065 30.598 25.943 1.00 0.00 PROA ATOM 9 HB2 ALA P 1 8.519 30.250 24.231 1.00 0.00 PROA ATOM 10 HB3 ALA P 1 9.730 30.989 25.366 1.00 0.00 PROA ATOM 11 C ALA P 1 9.956 28.787 27.116 1.00 0.00 PROA ATOM 12 O ALA P 1 9.578 27.921 27.888 1.00 0.00 PROA ATOM 13 N GLY P 2 10.906 29.683 27.505 1.00 0.00 PROA ATOM 14 HN GLY P 2 11.353 30.296 26.858 1.00 0.00 PROA ATOM 15 CA GLY P 2 11.333 29.802 28.914 1.00 0.00 PROA ATOM 16 HA1 GLY P 2 10.437 29.711 29.508 1.00 0.00 PROA ATOM 17 HA2 GLY P 2 11.752 30.791 29.018 1.00 0.00 PROA ATOM 18 C GLY P 2 12.358 28.808 29.476 1.00 0.00 PROA ATOM 19 O GLY P 2 12.492 28.607 30.672 1.00 0.00 PROA ATOM 20 N SER P 3 13.210 28.304 28.545 1.00 0.00 PROA ATOM 21 HN SER P 3 13.346 28.784 27.683 1.00 0.00 PROA ATOM 22 CA SER P 3 13.987 27.078 28.671 1.00 0.00 PROA ATOM 23 HA SER P 3 13.347 26.306 29.072 1.00 0.00 PROA ATOM 24 CB SER P 3 14.520 26.677 27.272 1.00 0.00 PROA ATOM 25 HB1 SER P 3 13.661 26.484 26.595 1.00 0.00 PROA ATOM 26 HB2 SER P 3 15.133 25.755 27.364 1.00 0.00 PROA ATOM 27 OG SER P 3 15.336 27.706 26.685 1.00 0.00 PROA ATOM 28 HG1 SER P 3 16.201 27.622 27.092 1.00 0.00 PROA ATOM 29 C SER P 3 15.154 27.119 29.652 1.00 0.00 PROA ATOM 30 O SER P 3 15.749 26.095 29.983 1.00 0.00 PROA ATOM 31 N TYR P 4 15.534 28.315 30.145 1.00 0.00 PROA ATOM 32 HN TYR P 4 15.101 29.158 29.837 1.00 0.00 PROA ATOM 33 CA TYR P 4 16.580 28.490 31.143 1.00 0.00 PROA ATOM 34 HA TYR P 4 16.834 27.511 31.522 1.00 0.00 PROA ATOM 35 CB TYR P 4 17.845 29.175 30.574 1.00 0.00 PROA ATOM 36 HB1 TYR P 4 18.581 29.357 31.386 1.00 0.00 PROA ATOM 37 HB2 TYR P 4 17.574 30.134 30.082 1.00 0.00 PROA ATOM 38 CG TYR P 4 18.485 28.289 29.552 1.00 0.00 PROA ATOM 39 CD1 TYR P 4 19.239 27.179 29.959 1.00 0.00 PROA ATOM 40 HD1 TYR P 4 19.316 26.938 31.009 1.00 0.00 PROA ATOM 41 CE1 TYR P 4 19.892 26.381 29.012 1.00 0.00 PROA ATOM 42 HE1 TYR P 4 20.476 25.531 29.333 1.00 0.00 PROA ATOM 43 CZ TYR P 4 19.790 26.682 27.655 1.00 0.00 PROA ATOM 44 OH TYR P 4 20.509 25.914 26.718 1.00 0.00 PROA ATOM 45 HH TYR P 4 20.202 26.153 25.840 1.00 0.00 PROA ATOM 46 CD2 TYR P 4 18.346 28.556 28.183 1.00 0.00 PROA ATOM 47 HD2 TYR P 4 17.739 29.388 27.857 1.00 0.00 PROA ATOM 48 CE2 TYR P 4 18.990 27.750 27.234 1.00 0.00 PROA ATOM 49 HE2 TYR P 4 18.869 27.953 26.180 1.00 0.00 PROA ATOM 50 C TYR P 4 16.030 29.310 32.294 1.00 0.00 PROA ATOM 51 O TYR P 4 16.742 30.095 32.920 1.00 0.00 PROA ATOM 52 N LEU P 5 14.728 29.152 32.600 1.00 0.00 PROA ATOM 53 HN LEU P 5 14.160 28.498 32.108 1.00 0.00 PROA ATOM 54 CA LEU P 5 14.051 29.891 33.638 1.00 0.00 PROA ATOM 55 HA LEU P 5 14.785 30.496 34.148 1.00 0.00 PROA ATOM 56 CB LEU P 5 12.927 30.795 33.042 1.00 0.00 PROA ATOM 57 HB1 LEU P 5 12.397 31.290 33.883 1.00 0.00 PROA ATOM 58 HB2 LEU P 5 12.211 30.145 32.498 1.00 0.00 PROA ATOM 59 CG LEU P 5 13.421 31.894 32.067 1.00 0.00 PROA ATOM 60 HG LEU P 5 14.095 31.439 31.311 1.00 0.00 PROA ATOM 61 CD1 LEU P 5 12.228 32.560 31.353 1.00 0.00 PROA ATOM 62 HD11 LEU P 5 11.648 33.177 32.073 1.00 0.00 PROA ATOM 63 HD12 LEU P 5 11.557 31.781 30.932 1.00 0.00 PROA ATOM 64 HD13 LEU P 5 12.595 33.218 30.537 1.00 0.00 PROA ATOM 65 CD2 LEU P 5 14.310 32.943 32.763 1.00 0.00 PROA ATOM 66 HD21 LEU P 5 15.207 32.454 33.200 1.00 0.00 PROA ATOM 67 HD22 LEU P 5 13.742 33.438 33.580 1.00 0.00 PROA ATOM 68 HD23 LEU P 5 14.645 33.704 32.026 1.00 0.00 PROA ATOM 69 C LEU P 5 13.501 28.898 34.662 1.00 0.00 PROA ATOM 70 O LEU P 5 13.595 27.680 34.504 1.00 0.00 PROA ATOM 71 N LEU P 6 12.843 29.381 35.757 1.00 0.00 PROA ATOM 72 HN LEU P 6 12.757 30.364 35.892 1.00 0.00 PROA ATOM 73 CA LEU P 6 12.213 28.574 36.818 1.00 0.00 PROA ATOM 74 HA LEU P 6 12.932 27.841 37.151 1.00 0.00 PROA ATOM 75 CB LEU P 6 11.770 29.473 38.007 1.00 0.00 PROA ATOM 76 HB1 LEU P 6 11.138 28.856 38.679 1.00 0.00 PROA ATOM 77 HB2 LEU P 6 11.157 30.301 37.594 1.00 0.00 PROA ATOM 78 CG LEU P 6 12.888 30.100 38.861 1.00 0.00 PROA ATOM 79 HG LEU P 6 13.601 30.647 38.207 1.00 0.00 PROA ATOM 80 CD1 LEU P 6 12.248 31.073 39.865 1.00 0.00 PROA ATOM 81 HD11 LEU P 6 11.306 30.642 40.266 1.00 0.00 PROA ATOM 82 HD12 LEU P 6 12.012 32.035 39.362 1.00 0.00 PROA ATOM 83 HD13 LEU P 6 12.944 31.255 40.712 1.00 0.00 PROA ATOM 84 CD2 LEU P 6 13.707 29.034 39.608 1.00 0.00 PROA ATOM 85 HD21 LEU P 6 14.181 28.339 38.882 1.00 0.00 PROA ATOM 86 HD22 LEU P 6 13.043 28.448 40.279 1.00 0.00 PROA ATOM 87 HD23 LEU P 6 14.506 29.522 40.206 1.00 0.00 PROA ATOM 88 C LEU P 6 10.968 27.725 36.479 1.00 0.00 PROA ATOM 89 O LEU P 6 10.572 26.842 37.230 1.00 0.00 PROA ATOM 90 N CGU P 7 10.311 27.956 35.352 1.00 0.00 PROA ATOM 91 HN CGU P 7 10.523 28.786 34.850 1.00 0.00 PROA ATOM 92 CA CGU P 7 9.279 27.163 34.689 1.00 0.00 PROA ATOM 93 HA CGU P 7 8.457 27.080 35.384 1.00 0.00 PROA ATOM 94 CB CGU P 7 8.726 27.719 33.337 1.00 0.00 PROA ATOM 95 HB1 CGU P 7 8.672 28.827 33.395 1.00 0.00 PROA ATOM 96 HB2 CGU P 7 7.703 27.318 33.171 1.00 0.00 PROA ATOM 97 CG CGU P 7 9.621 27.321 32.148 1.00 0.00 PROA ATOM 98 HG CGU P 7 9.683 26.214 32.074 1.00 0.00 PROA ATOM 99 CD1 CGU P 7 9.041 27.860 30.919 1.00 0.00 PROA ATOM 100 OE12 CGU P 7 8.827 26.975 30.064 1.00 0.00 PROA ATOM 101 OE11 CGU P 7 8.565 29.007 30.678 1.00 0.00 PROA ATOM 102 CD2 CGU P 7 10.915 27.880 32.546 1.00 0.00 PROA ATOM 103 OE22 CGU P 7 11.938 27.186 32.575 1.00 0.00 PROA ATOM 104 OE21 CGU P 7 10.788 28.982 33.135 1.00 0.00 PROA ATOM 105 C CGU P 7 9.738 25.706 34.396 1.00 0.00 PROA ATOM 106 O CGU P 7 8.909 24.819 34.265 1.00 0.00 PROA ATOM 107 N CGU P 8 11.041 25.371 34.203 1.00 0.00 PROA ATOM 108 HN CGU P 8 11.778 26.036 34.298 1.00 0.00 PROA ATOM 109 CA CGU P 8 11.447 24.003 33.841 1.00 0.00 PROA ATOM 110 HA CGU P 8 10.661 23.596 33.222 1.00 0.00 PROA ATOM 111 CB CGU P 8 12.745 23.877 33.106 1.00 0.00 PROA ATOM 112 HB1 CGU P 8 13.141 22.842 33.181 1.00 0.00 PROA ATOM 113 HB2 CGU P 8 13.500 24.581 33.516 1.00 0.00 PROA ATOM 114 CG CGU P 8 12.410 24.226 31.655 1.00 0.00 PROA ATOM 115 HG CGU P 8 11.781 25.137 31.576 1.00 0.00 PROA ATOM 116 CD1 CGU P 8 13.748 24.453 31.163 1.00 0.00 PROA ATOM 117 OE12 CGU P 8 14.121 25.556 31.574 1.00 0.00 PROA ATOM 118 OE11 CGU P 8 14.445 23.582 30.565 1.00 0.00 PROA ATOM 119 CD2 CGU P 8 11.577 23.432 30.758 1.00 0.00 PROA ATOM 120 OE22 CGU P 8 10.471 23.907 30.343 1.00 0.00 PROA ATOM 121 OE21 CGU P 8 11.952 22.293 30.328 1.00 0.00 PROA ATOM 122 C CGU P 8 11.691 23.204 34.995 1.00 0.00 PROA ATOM 123 O CGU P 8 12.116 22.049 34.968 1.00 0.00 PROA ATOM 124 N LEU P 9 11.346 23.826 36.078 1.00 0.00 PROA ATOM 125 HN LEU P 9 11.204 24.811 36.141 1.00 0.00 PROA ATOM 126 CA LEU P 9 11.156 23.021 37.275 1.00 0.00 PROA ATOM 127 HA LEU P 9 11.950 22.290 37.308 1.00 0.00 PROA ATOM 128 CB LEU P 9 11.176 23.885 38.565 1.00 0.00 PROA ATOM 129 HB1 LEU P 9 10.620 23.330 39.349 1.00 0.00 PROA ATOM 130 HB2 LEU P 9 10.641 24.831 38.343 1.00 0.00 PROA ATOM 131 CG LEU P 9 12.560 24.257 39.149 1.00 0.00 PROA ATOM 132 HG LEU P 9 13.054 23.324 39.494 1.00 0.00 PROA ATOM 133 CD1 LEU P 9 13.505 24.967 38.166 1.00 0.00 PROA ATOM 134 HD11 LEU P 9 13.047 25.917 37.815 1.00 0.00 PROA ATOM 135 HD12 LEU P 9 13.692 24.317 37.285 1.00 0.00 PROA ATOM 136 HD13 LEU P 9 14.467 25.202 38.669 1.00 0.00 PROA ATOM 137 CD2 LEU P 9 12.360 25.124 40.406 1.00 0.00 PROA ATOM 138 HD21 LEU P 9 11.778 24.563 41.168 1.00 0.00 PROA ATOM 139 HD22 LEU P 9 11.802 26.048 40.143 1.00 0.00 PROA ATOM 140 HD23 LEU P 9 13.346 25.393 40.841 1.00 0.00 PROA ATOM 141 C LEU P 9 9.798 22.341 37.237 1.00 0.00 PROA ATOM 142 O LEU P 9 9.543 21.381 37.961 1.00 0.00 PROA ATOM 143 N PHE P 10 8.889 22.843 36.380 1.00 0.00 PROA ATOM 144 HN PHE P 10 9.084 23.652 35.832 1.00 0.00 PROA ATOM 145 CA PHE P 10 7.584 22.266 36.185 1.00 0.00 PROA ATOM 146 HA PHE P 10 7.259 21.865 37.133 1.00 0.00 PROA ATOM 147 CB PHE P 10 6.551 23.309 35.667 1.00 0.00 PROA ATOM 148 HB1 PHE P 10 5.744 22.792 35.105 1.00 0.00 PROA ATOM 149 HB2 PHE P 10 7.059 24.048 35.012 1.00 0.00 PROA ATOM 150 CG PHE P 10 5.909 24.066 36.807 1.00 0.00 PROA ATOM 151 CD1 PHE P 10 6.520 24.138 38.068 1.00 0.00 PROA ATOM 152 HD1 PHE P 10 7.466 23.643 38.230 1.00 0.00 PROA ATOM 153 CE1 PHE P 10 5.920 24.844 39.122 1.00 0.00 PROA ATOM 154 HE1 PHE P 10 6.401 24.883 40.088 1.00 0.00 PROA ATOM 155 CZ PHE P 10 4.700 25.497 38.921 1.00 0.00 PROA ATOM 156 HZ PHE P 10 4.235 26.038 39.732 1.00 0.00 PROA ATOM 157 CD2 PHE P 10 4.688 24.729 36.629 1.00 0.00 PROA ATOM 158 HD2 PHE P 10 4.200 24.685 35.666 1.00 0.00 PROA ATOM 159 CE2 PHE P 10 4.084 25.447 37.668 1.00 0.00 PROA ATOM 160 HE2 PHE P 10 3.148 25.959 37.502 1.00 0.00 PROA ATOM 161 C PHE P 10 7.686 21.101 35.218 1.00 0.00 PROA ATOM 162 O PHE P 10 8.601 20.999 34.413 1.00 0.00 PROA ATOM 163 N CGU P 11 6.731 20.159 35.315 1.00 0.00 PROA ATOM 164 HN CGU P 11 6.157 20.096 36.127 1.00 0.00 PROA ATOM 165 CA CGU P 11 6.447 19.175 34.290 1.00 0.00 PROA ATOM 166 HA CGU P 11 7.338 18.587 34.127 1.00 0.00 PROA ATOM 167 CB CGU P 11 5.292 18.264 34.729 1.00 0.00 PROA ATOM 168 HB1 CGU P 11 5.037 17.583 33.890 1.00 0.00 PROA ATOM 169 HB2 CGU P 11 4.409 18.896 34.961 1.00 0.00 PROA ATOM 170 CG CGU P 11 5.630 17.416 35.967 1.00 0.00 PROA ATOM 171 HG CGU P 11 5.992 18.086 36.776 1.00 0.00 PROA ATOM 172 CD1 CGU P 11 4.454 16.650 36.477 1.00 0.00 PROA ATOM 173 OE12 CGU P 11 4.353 16.599 37.737 1.00 0.00 PROA ATOM 174 OE11 CGU P 11 3.740 16.035 35.644 1.00 0.00 PROA ATOM 175 CD2 CGU P 11 6.878 16.608 35.826 1.00 0.00 PROA ATOM 176 OE22 CGU P 11 7.676 16.663 36.817 1.00 0.00 PROA ATOM 177 OE21 CGU P 11 7.052 15.897 34.810 1.00 0.00 PROA ATOM 178 C CGU P 11 5.991 19.791 32.982 1.00 0.00 PROA ATOM 179 O CGU P 11 5.155 20.697 32.985 1.00 0.00 PROA ATOM 180 N GLY P 12 6.516 19.259 31.852 1.00 0.00 PROA ATOM 181 HN GLY P 12 7.166 18.506 31.902 1.00 0.00 PROA ATOM 182 CA GLY P 12 6.208 19.703 30.503 1.00 0.00 PROA ATOM 183 HA1 GLY P 12 6.703 19.023 29.826 1.00 0.00 PROA ATOM 184 HA2 GLY P 12 6.615 20.697 30.397 1.00 0.00 PROA ATOM 185 C GLY P 12 4.757 19.751 30.140 1.00 0.00 PROA ATOM 186 O GLY P 12 3.985 18.869 30.504 1.00 0.00 PROA ATOM 187 N ASN P 13 4.320 20.762 29.376 1.00 0.00 PROA ATOM 188 HN ASN P 13 4.913 21.480 29.021 1.00 0.00 PROA ATOM 189 CA ASN P 13 2.923 20.828 29.041 1.00 0.00 PROA ATOM 190 HA ASN P 13 2.517 19.828 29.067 1.00 0.00 PROA ATOM 191 CB ASN P 13 2.197 21.744 30.071 1.00 0.00 PROA ATOM 192 HB1 ASN P 13 2.592 22.778 29.978 1.00 0.00 PROA ATOM 193 HB2 ASN P 13 2.399 21.367 31.096 1.00 0.00 PROA ATOM 194 CG ASN P 13 0.690 21.780 29.856 1.00 0.00 PROA ATOM 195 OD1 ASN P 13 0.175 21.458 28.788 1.00 0.00 PROA ATOM 196 ND2 ASN P 13 -0.080 22.237 30.868 1.00 0.00 PROA ATOM 197 HD21 ASN P 13 -1.052 22.417 30.715 1.00 0.00 PROA ATOM 198 HD22 ASN P 13 0.322 22.396 31.770 1.00 0.00 PROA ATOM 199 C ASN P 13 2.780 21.306 27.614 1.00 0.00 PROA ATOM 200 O ASN P 13 3.182 22.410 27.266 1.00 0.00 PROA ATOM 201 N LEU P 14 2.113 20.508 26.754 1.00 0.00 PROA ATOM 202 HN LEU P 14 1.743 19.627 27.037 1.00 0.00 PROA ATOM 203 CA LEU P 14 1.887 20.867 25.374 1.00 0.00 PROA ATOM 204 HA LEU P 14 2.841 21.069 24.911 1.00 0.00 PROA ATOM 205 CB LEU P 14 1.173 19.696 24.668 1.00 0.00 PROA ATOM 206 HB1 LEU P 14 0.125 19.654 25.033 1.00 0.00 PROA ATOM 207 HB2 LEU P 14 1.689 18.753 24.946 1.00 0.00 PROA ATOM 208 CG LEU P 14 1.147 19.800 23.133 1.00 0.00 PROA ATOM 209 HG LEU P 14 0.755 20.798 22.842 1.00 0.00 PROA ATOM 210 CD1 LEU P 14 2.552 19.617 22.538 1.00 0.00 PROA ATOM 211 HD11 LEU P 14 2.956 18.619 22.812 1.00 0.00 PROA ATOM 212 HD12 LEU P 14 3.236 20.397 22.936 1.00 0.00 PROA ATOM 213 HD13 LEU P 14 2.506 19.689 21.430 1.00 0.00 PROA ATOM 214 CD2 LEU P 14 0.171 18.773 22.542 1.00 0.00 PROA ATOM 215 HD21 LEU P 14 -0.855 18.955 22.928 1.00 0.00 PROA ATOM 216 HD22 LEU P 14 0.482 17.746 22.831 1.00 0.00 PROA ATOM 217 HD23 LEU P 14 0.154 18.861 21.435 1.00 0.00 PROA ATOM 218 C LEU P 14 1.085 22.155 25.165 1.00 0.00 PROA ATOM 219 O LEU P 14 1.409 22.958 24.290 1.00 0.00 PROA ATOM 220 N CGU P 15 0.028 22.396 25.968 1.00 0.00 PROA ATOM 221 HN CGU P 15 -0.266 21.731 26.649 1.00 0.00 PROA ATOM 222 CA CGU P 15 -0.757 23.615 25.914 1.00 0.00 PROA ATOM 223 HA CGU P 15 -1.058 23.787 24.891 1.00 0.00 PROA ATOM 224 CB CGU P 15 -1.992 23.459 26.812 1.00 0.00 PROA ATOM 225 HB1 CGU P 15 -1.647 23.326 27.859 1.00 0.00 PROA ATOM 226 HB2 CGU P 15 -2.540 22.547 26.495 1.00 0.00 PROA ATOM 227 CG CGU P 15 -2.975 24.653 26.774 1.00 0.00 PROA ATOM 228 HG CGU P 15 -2.470 25.550 27.191 1.00 0.00 PROA ATOM 229 CD1 CGU P 15 -3.440 24.970 25.390 1.00 0.00 PROA ATOM 230 OE12 CGU P 15 -3.651 26.197 25.164 1.00 0.00 PROA ATOM 231 OE11 CGU P 15 -3.691 24.012 24.615 1.00 0.00 PROA ATOM 232 CD2 CGU P 15 -4.069 24.570 27.788 1.00 0.00 PROA ATOM 233 OE22 CGU P 15 -4.850 25.576 27.828 1.00 0.00 PROA ATOM 234 OE21 CGU P 15 -4.200 23.538 28.483 1.00 0.00 PROA ATOM 235 C CGU P 15 0.038 24.838 26.349 1.00 0.00 PROA ATOM 236 O CGU P 15 0.168 25.799 25.588 1.00 0.00 PROA ATOM 237 N LYS P 16 0.681 24.788 27.538 1.00 0.00 PROA ATOM 238 HN LYS P 16 0.634 23.984 28.125 1.00 0.00 PROA ATOM 239 CA LYS P 16 1.485 25.899 28.047 1.00 0.00 PROA ATOM 240 HA LYS P 16 0.877 26.789 27.979 1.00 0.00 PROA ATOM 241 CB LYS P 16 1.970 25.712 29.517 1.00 0.00 PROA ATOM 242 HB1 LYS P 16 3.015 25.338 29.496 1.00 0.00 PROA ATOM 243 HB2 LYS P 16 1.325 24.951 30.005 1.00 0.00 PROA ATOM 244 CG LYS P 16 1.930 26.997 30.364 1.00 0.00 PROA ATOM 245 HG1 LYS P 16 0.906 27.425 30.314 1.00 0.00 PROA ATOM 246 HG2 LYS P 16 2.647 27.729 29.935 1.00 0.00 PROA ATOM 247 CD LYS P 16 2.294 26.757 31.846 1.00 0.00 PROA ATOM 248 HD1 LYS P 16 1.747 27.499 32.465 1.00 0.00 PROA ATOM 249 HD2 LYS P 16 3.386 26.919 31.969 1.00 0.00 PROA ATOM 250 CE LYS P 16 1.952 25.349 32.362 1.00 0.00 PROA ATOM 251 HE1 LYS P 16 2.508 24.586 31.776 1.00 0.00 PROA ATOM 252 HE2 LYS P 16 0.858 25.172 32.279 1.00 0.00 PROA ATOM 253 NZ LYS P 16 2.334 25.195 33.792 1.00 0.00 PROA ATOM 254 HZ1 LYS P 16 1.702 25.771 34.384 1.00 0.00 PROA ATOM 255 HZ2 LYS P 16 3.316 25.511 33.924 1.00 0.00 PROA ATOM 256 HZ3 LYS P 16 2.252 24.195 34.067 1.00 0.00 PROA ATOM 257 C LYS P 16 2.703 26.207 27.185 1.00 0.00 PROA ATOM 258 O LYS P 16 2.917 27.348 26.798 1.00 0.00 PROA ATOM 259 N CGU P 17 3.513 25.201 26.808 1.00 0.00 PROA ATOM 260 HN CGU P 17 3.289 24.243 26.970 1.00 0.00 PROA ATOM 261 CA CGU P 17 4.773 25.467 26.137 1.00 0.00 PROA ATOM 262 HA CGU P 17 5.157 26.419 26.473 1.00 0.00 PROA ATOM 263 CB CGU P 17 5.735 24.345 26.499 1.00 0.00 PROA ATOM 264 HB1 CGU P 17 6.705 24.515 25.985 1.00 0.00 PROA ATOM 265 HB2 CGU P 17 5.312 23.377 26.156 1.00 0.00 PROA ATOM 266 CG CGU P 17 5.970 24.285 28.014 1.00 0.00 PROA ATOM 267 HG CGU P 17 4.988 24.231 28.530 1.00 0.00 PROA ATOM 268 CD1 CGU P 17 6.786 23.103 28.422 1.00 0.00 PROA ATOM 269 OE12 CGU P 17 7.976 23.365 28.765 1.00 0.00 PROA ATOM 270 OE11 CGU P 17 6.282 21.959 28.287 1.00 0.00 PROA ATOM 271 CD2 CGU P 17 6.418 25.579 28.609 1.00 0.00 PROA ATOM 272 OE22 CGU P 17 5.642 26.068 29.495 1.00 0.00 PROA ATOM 273 OE21 CGU P 17 7.516 26.077 28.272 1.00 0.00 PROA ATOM 274 C CGU P 17 4.688 25.599 24.621 1.00 0.00 PROA ATOM 275 O CGU P 17 5.439 26.380 24.026 1.00 0.00 PROA ATOM 276 N CYS P 18 3.799 24.832 23.947 1.00 0.00 PROA ATOM 277 HN CYS P 18 3.148 24.254 24.432 1.00 0.00 PROA ATOM 278 CA CYS P 18 3.709 24.777 22.491 1.00 0.00 PROA ATOM 279 HA CYS P 18 4.522 25.364 22.091 1.00 0.00 PROA ATOM 280 CB CYS P 18 3.790 23.321 21.948 1.00 0.00 PROA ATOM 281 HB1 CYS P 18 3.694 23.371 20.844 1.00 0.00 PROA ATOM 282 HB2 CYS P 18 2.920 22.765 22.354 1.00 0.00 PROA ATOM 283 SG CYS P 18 5.301 22.382 22.345 1.00 0.00 PROA ATOM 284 C CYS P 18 2.412 25.326 21.904 1.00 0.00 PROA ATOM 285 O CYS P 18 2.311 25.466 20.689 1.00 0.00 PROA ATOM 286 N TYR P 19 1.364 25.639 22.694 1.00 0.00 PROA ATOM 287 HN TYR P 19 1.358 25.460 23.675 1.00 0.00 PROA ATOM 288 CA TYR P 19 0.177 26.262 22.140 1.00 0.00 PROA ATOM 289 HA TYR P 19 0.292 26.321 21.068 1.00 0.00 PROA ATOM 290 CB TYR P 19 -1.067 25.416 22.509 1.00 0.00 PROA ATOM 291 HB1 TYR P 19 -1.200 25.409 23.612 1.00 0.00 PROA ATOM 292 HB2 TYR P 19 -0.938 24.379 22.133 1.00 0.00 PROA ATOM 293 CG TYR P 19 -2.320 25.964 21.905 1.00 0.00 PROA ATOM 294 CD1 TYR P 19 -3.242 26.630 22.724 1.00 0.00 PROA ATOM 295 HD1 TYR P 19 -3.055 26.714 23.784 1.00 0.00 PROA ATOM 296 CE1 TYR P 19 -4.402 27.186 22.176 1.00 0.00 PROA ATOM 297 HE1 TYR P 19 -5.106 27.700 22.813 1.00 0.00 PROA ATOM 298 CZ TYR P 19 -4.651 27.078 20.807 1.00 0.00 PROA ATOM 299 OH TYR P 19 -5.825 27.632 20.265 1.00 0.00 PROA ATOM 300 HH TYR P 19 -6.241 28.168 20.944 1.00 0.00 PROA ATOM 301 CD2 TYR P 19 -2.564 25.873 20.527 1.00 0.00 PROA ATOM 302 HD2 TYR P 19 -1.853 25.373 19.886 1.00 0.00 PROA ATOM 303 CE2 TYR P 19 -3.729 26.430 19.979 1.00 0.00 PROA ATOM 304 HE2 TYR P 19 -3.914 26.358 18.917 1.00 0.00 PROA ATOM 305 C TYR P 19 0.080 27.711 22.593 1.00 0.00 PROA ATOM 306 O TYR P 19 -0.072 28.611 21.770 1.00 0.00 PROA ATOM 307 N CGU P 20 0.218 27.992 23.902 1.00 0.00 PROA ATOM 308 HN CGU P 20 0.312 27.271 24.584 1.00 0.00 PROA ATOM 309 CA CGU P 20 0.240 29.349 24.418 1.00 0.00 PROA ATOM 310 HA CGU P 20 -0.537 29.920 23.931 1.00 0.00 PROA ATOM 311 CB CGU P 20 -0.005 29.297 25.939 1.00 0.00 PROA ATOM 312 HB1 CGU P 20 0.187 30.307 26.358 1.00 0.00 PROA ATOM 313 HB2 CGU P 20 0.716 28.579 26.384 1.00 0.00 PROA ATOM 314 CG CGU P 20 -1.437 28.865 26.349 1.00 0.00 PROA ATOM 315 HG CGU P 20 -1.682 27.904 25.848 1.00 0.00 PROA ATOM 316 CD1 CGU P 20 -1.581 28.681 27.824 1.00 0.00 PROA ATOM 317 OE12 CGU P 20 -2.675 28.165 28.195 1.00 0.00 PROA ATOM 318 OE11 CGU P 20 -0.681 29.146 28.570 1.00 0.00 PROA ATOM 319 CD2 CGU P 20 -2.519 29.680 25.720 1.00 0.00 PROA ATOM 320 OE22 CGU P 20 -3.676 29.144 25.726 1.00 0.00 PROA ATOM 321 OE21 CGU P 20 -2.267 30.827 25.286 1.00 0.00 PROA ATOM 322 C CGU P 20 1.547 30.071 24.116 1.00 0.00 PROA ATOM 323 O CGU P 20 1.611 31.306 24.040 1.00 0.00 PROA ATOM 324 N CGU P 21 2.617 29.306 23.876 1.00 0.00 PROA ATOM 325 HN CGU P 21 2.540 28.313 23.884 1.00 0.00 PROA ATOM 326 CA CGU P 21 3.931 29.797 23.594 1.00 0.00 PROA ATOM 327 HA CGU P 21 3.863 30.858 23.405 1.00 0.00 PROA ATOM 328 CB CGU P 21 4.860 29.539 24.768 1.00 0.00 PROA ATOM 329 HB1 CGU P 21 5.858 29.959 24.523 1.00 0.00 PROA ATOM 330 HB2 CGU P 21 4.955 28.441 24.903 1.00 0.00 PROA ATOM 331 CG CGU P 21 4.393 30.149 26.093 1.00 0.00 PROA ATOM 332 HG CGU P 21 3.302 29.973 26.207 1.00 0.00 PROA ATOM 333 CD1 CGU P 21 5.095 29.563 27.274 1.00 0.00 PROA ATOM 334 OE12 CGU P 21 4.679 29.966 28.399 1.00 0.00 PROA ATOM 335 OE11 CGU P 21 6.092 28.825 27.065 1.00 0.00 PROA ATOM 336 CD2 CGU P 21 4.337 31.641 26.087 1.00 0.00 PROA ATOM 337 OE22 CGU P 21 3.720 32.165 27.071 1.00 0.00 PROA ATOM 338 OE21 CGU P 21 4.922 32.286 25.187 1.00 0.00 PROA ATOM 339 C CGU P 21 4.524 29.047 22.442 1.00 0.00 PROA ATOM 340 O CGU P 21 4.017 28.016 21.996 1.00 0.00 PROA ATOM 341 N ILE P 22 5.652 29.549 21.923 1.00 0.00 PROA ATOM 342 HN ILE P 22 5.996 30.448 22.184 1.00 0.00 PROA ATOM 343 CA ILE P 22 6.446 28.828 20.954 1.00 0.00 PROA ATOM 344 HA ILE P 22 5.776 28.219 20.365 1.00 0.00 PROA ATOM 345 CB ILE P 22 7.225 29.783 20.046 1.00 0.00 PROA ATOM 346 HB ILE P 22 7.798 30.500 20.672 1.00 0.00 PROA ATOM 347 CG2 ILE P 22 8.205 28.996 19.140 1.00 0.00 PROA ATOM 348 HG21 ILE P 22 7.644 28.280 18.502 1.00 0.00 PROA ATOM 349 HG22 ILE P 22 8.924 28.425 19.766 1.00 0.00 PROA ATOM 350 HG23 ILE P 22 8.759 29.699 18.482 1.00 0.00 PROA ATOM 351 CG1 ILE P 22 6.227 30.621 19.207 1.00 0.00 PROA ATOM 352 HG11 ILE P 22 5.443 31.020 19.885 1.00 0.00 PROA ATOM 353 HG12 ILE P 22 5.750 29.956 18.456 1.00 0.00 PROA ATOM 354 CD ILE P 22 6.881 31.797 18.472 1.00 0.00 PROA ATOM 355 HD1 ILE P 22 7.661 31.425 17.774 1.00 0.00 PROA ATOM 356 HD2 ILE P 22 7.358 32.482 19.205 1.00 0.00 PROA ATOM 357 HD3 ILE P 22 6.116 32.350 17.886 1.00 0.00 PROA ATOM 358 C ILE P 22 7.376 27.883 21.719 1.00 0.00 PROA ATOM 359 O ILE P 22 8.151 28.341 22.560 1.00 0.00 PROA ATOM 360 N CYS P 23 7.327 26.553 21.468 1.00 0.00 PROA ATOM 361 HN CYS P 23 6.612 26.155 20.899 1.00 0.00 PROA ATOM 362 CA CYS P 23 8.302 25.611 22.003 1.00 0.00 PROA ATOM 363 HA CYS P 23 8.826 26.101 22.810 1.00 0.00 PROA ATOM 364 CB CYS P 23 7.618 24.308 22.521 1.00 0.00 PROA ATOM 365 HB1 CYS P 23 6.884 24.601 23.300 1.00 0.00 PROA ATOM 366 HB2 CYS P 23 8.403 23.681 22.993 1.00 0.00 PROA ATOM 367 SG CYS P 23 6.758 23.304 21.275 1.00 0.00 PROA ATOM 368 C CYS P 23 9.423 25.307 21.006 1.00 0.00 PROA ATOM 369 O CYS P 23 9.234 25.301 19.789 1.00 0.00 PROA ATOM 370 N VAL P 24 10.656 25.052 21.497 1.00 0.00 PROA ATOM 371 HN VAL P 24 10.871 25.217 22.456 1.00 0.00 PROA ATOM 372 CA VAL P 24 11.758 24.527 20.698 1.00 0.00 PROA ATOM 373 HA VAL P 24 11.684 24.964 19.713 1.00 0.00 PROA ATOM 374 CB VAL P 24 13.129 24.848 21.311 1.00 0.00 PROA ATOM 375 HB VAL P 24 13.927 24.477 20.633 1.00 0.00 PROA ATOM 376 CG1 VAL P 24 13.308 26.363 21.521 1.00 0.00 PROA ATOM 377 HG11 VAL P 24 12.523 26.749 22.206 1.00 0.00 PROA ATOM 378 HG12 VAL P 24 13.222 26.892 20.548 1.00 0.00 PROA ATOM 379 HG13 VAL P 24 14.303 26.567 21.971 1.00 0.00 PROA ATOM 380 CG2 VAL P 24 13.271 24.162 22.675 1.00 0.00 PROA ATOM 381 HG21 VAL P 24 13.179 23.061 22.560 1.00 0.00 PROA ATOM 382 HG22 VAL P 24 12.472 24.515 23.361 1.00 0.00 PROA ATOM 383 HG23 VAL P 24 14.267 24.391 23.112 1.00 0.00 PROA ATOM 384 C VAL P 24 11.569 23.013 20.530 1.00 0.00 PROA ATOM 385 O VAL P 24 10.655 22.420 21.100 1.00 0.00 PROA ATOM 386 N TYR P 25 12.426 22.328 19.728 1.00 0.00 PROA ATOM 387 HN TYR P 25 13.120 22.804 19.195 1.00 0.00 PROA ATOM 388 CA TYR P 25 12.416 20.875 19.572 1.00 0.00 PROA ATOM 389 HA TYR P 25 11.424 20.574 19.270 1.00 0.00 PROA ATOM 390 CB TYR P 25 13.469 20.452 18.497 1.00 0.00 PROA ATOM 391 HB1 TYR P 25 14.478 20.796 18.810 1.00 0.00 PROA ATOM 392 HB2 TYR P 25 13.200 20.901 17.517 1.00 0.00 PROA ATOM 393 CG TYR P 25 13.539 18.950 18.306 1.00 0.00 PROA ATOM 394 CD1 TYR P 25 14.485 18.171 18.995 1.00 0.00 PROA ATOM 395 HD1 TYR P 25 15.244 18.654 19.592 1.00 0.00 PROA ATOM 396 CE1 TYR P 25 14.450 16.770 18.913 1.00 0.00 PROA ATOM 397 HE1 TYR P 25 15.161 16.181 19.473 1.00 0.00 PROA ATOM 398 CZ TYR P 25 13.499 16.135 18.110 1.00 0.00 PROA ATOM 399 OH TYR P 25 13.454 14.722 18.004 1.00 0.00 PROA ATOM 400 HH TYR P 25 12.975 14.500 17.202 1.00 0.00 PROA ATOM 401 CD2 TYR P 25 12.594 18.297 17.508 1.00 0.00 PROA ATOM 402 HD2 TYR P 25 11.864 18.880 16.966 1.00 0.00 PROA ATOM 403 CE2 TYR P 25 12.576 16.900 17.398 1.00 0.00 PROA ATOM 404 HE2 TYR P 25 11.848 16.417 16.763 1.00 0.00 PROA ATOM 405 C TYR P 25 12.667 20.167 20.898 1.00 0.00 PROA ATOM 406 O TYR P 25 11.954 19.223 21.222 1.00 0.00 PROA ATOM 407 N CGU P 26 13.641 20.641 21.707 1.00 0.00 PROA ATOM 408 HN CGU P 26 14.217 21.397 21.409 1.00 0.00 PROA ATOM 409 CA CGU P 26 13.955 20.138 23.038 1.00 0.00 PROA ATOM 410 HA CGU P 26 14.190 19.087 22.960 1.00 0.00 PROA ATOM 411 CB CGU P 26 15.159 20.908 23.618 1.00 0.00 PROA ATOM 412 HB1 CGU P 26 14.810 21.898 23.981 1.00 0.00 PROA ATOM 413 HB2 CGU P 26 15.907 21.064 22.812 1.00 0.00 PROA ATOM 414 CG CGU P 26 15.838 20.158 24.790 1.00 0.00 PROA ATOM 415 HG CGU P 26 16.766 19.672 24.419 1.00 0.00 PROA ATOM 416 CD1 CGU P 26 16.197 21.065 25.921 1.00 0.00 PROA ATOM 417 OE12 CGU P 26 16.715 20.492 26.923 1.00 0.00 PROA ATOM 418 OE11 CGU P 26 15.863 22.274 25.840 1.00 0.00 PROA ATOM 419 CD2 CGU P 26 15.130 18.910 25.202 1.00 0.00 PROA ATOM 420 OE22 CGU P 26 14.102 18.615 24.508 1.00 0.00 PROA ATOM 421 OE21 CGU P 26 15.588 18.207 26.131 1.00 0.00 PROA ATOM 422 C CGU P 26 12.781 20.171 24.021 1.00 0.00 PROA ATOM 423 O CGU P 26 12.468 19.135 24.608 1.00 0.00 PROA ATOM 424 N CGU P 27 12.031 21.285 24.164 1.00 0.00 PROA ATOM 425 HN CGU P 27 12.274 22.127 23.691 1.00 0.00 PROA ATOM 426 CA CGU P 27 10.828 21.373 24.996 1.00 0.00 PROA ATOM 427 HA CGU P 27 11.088 21.074 26.001 1.00 0.00 PROA ATOM 428 CB CGU P 27 10.271 22.832 25.004 1.00 0.00 PROA ATOM 429 HB1 CGU P 27 9.279 22.797 25.499 1.00 0.00 PROA ATOM 430 HB2 CGU P 27 10.138 23.133 23.945 1.00 0.00 PROA ATOM 431 CG CGU P 27 11.089 23.970 25.702 1.00 0.00 PROA ATOM 432 HG CGU P 27 12.081 24.056 25.210 1.00 0.00 PROA ATOM 433 CD1 CGU P 27 10.407 25.296 25.628 1.00 0.00 PROA ATOM 434 OE12 CGU P 27 10.718 26.003 24.625 1.00 0.00 PROA ATOM 435 OE11 CGU P 27 9.686 25.647 26.597 1.00 0.00 PROA ATOM 436 CD2 CGU P 27 11.591 23.609 27.061 1.00 0.00 PROA ATOM 437 OE22 CGU P 27 12.856 23.647 27.201 1.00 0.00 PROA ATOM 438 OE21 CGU P 27 10.780 23.353 27.980 1.00 0.00 PROA ATOM 439 C CGU P 27 9.751 20.378 24.513 1.00 0.00 PROA ATOM 440 O CGU P 27 9.232 19.569 25.286 1.00 0.00 PROA ATOM 441 N ALA P 28 9.461 20.279 23.188 1.00 0.00 PROA ATOM 442 HN ALA P 28 9.868 20.894 22.517 1.00 0.00 PROA ATOM 443 CA ALA P 28 8.541 19.276 22.650 1.00 0.00 PROA ATOM 444 HA ALA P 28 7.590 19.392 23.148 1.00 0.00 PROA ATOM 445 CB ALA P 28 8.373 19.456 21.122 1.00 0.00 PROA ATOM 446 HB1 ALA P 28 9.355 19.345 20.614 1.00 0.00 PROA ATOM 447 HB2 ALA P 28 7.973 20.469 20.902 1.00 0.00 PROA ATOM 448 HB3 ALA P 28 7.679 18.685 20.725 1.00 0.00 PROA ATOM 449 C ALA P 28 8.989 17.840 22.958 1.00 0.00 PROA ATOM 450 O ALA P 28 8.202 16.962 23.305 1.00 0.00 PROA ATOM 451 N ARG P 29 10.309 17.608 22.883 1.00 0.00 PROA ATOM 452 HN ARG P 29 10.915 18.329 22.563 1.00 0.00 PROA ATOM 453 CA ARG P 29 11.002 16.379 23.226 1.00 0.00 PROA ATOM 454 HA ARG P 29 10.592 15.576 22.631 1.00 0.00 PROA ATOM 455 CB ARG P 29 12.511 16.559 22.937 1.00 0.00 PROA ATOM 456 HB1 ARG P 29 12.996 16.908 23.872 1.00 0.00 PROA ATOM 457 HB2 ARG P 29 12.616 17.345 22.161 1.00 0.00 PROA ATOM 458 CG ARG P 29 13.267 15.318 22.452 1.00 0.00 PROA ATOM 459 HG1 ARG P 29 13.140 15.231 21.352 1.00 0.00 PROA ATOM 460 HG2 ARG P 29 12.827 14.421 22.937 1.00 0.00 PROA ATOM 461 CD ARG P 29 14.769 15.364 22.773 1.00 0.00 PROA ATOM 462 HD1 ARG P 29 15.219 16.301 22.382 1.00 0.00 PROA ATOM 463 HD2 ARG P 29 15.285 14.482 22.337 1.00 0.00 PROA ATOM 464 NE ARG P 29 14.957 15.333 24.277 1.00 0.00 PROA ATOM 465 HE ARG P 29 15.321 16.160 24.702 1.00 0.00 PROA ATOM 466 CZ ARG P 29 14.681 14.300 25.095 1.00 0.00 PROA ATOM 467 NH1 ARG P 29 14.300 13.112 24.636 1.00 0.00 PROA ATOM 468 HH11 ARG P 29 14.353 12.914 23.657 1.00 0.00 PROA ATOM 469 HH12 ARG P 29 13.961 12.417 25.269 1.00 0.00 PROA ATOM 470 NH2 ARG P 29 14.717 14.489 26.416 1.00 0.00 PROA ATOM 471 HH21 ARG P 29 14.947 15.389 26.786 1.00 0.00 PROA ATOM 472 HH22 ARG P 29 14.514 13.731 27.035 1.00 0.00 PROA ATOM 473 C ARG P 29 10.851 15.926 24.679 1.00 0.00 PROA ATOM 474 O ARG P 29 10.791 14.726 24.963 1.00 0.00 PROA ATOM 475 N CGU P 30 10.829 16.872 25.630 1.00 0.00 PROA ATOM 476 HN CGU P 30 11.050 17.811 25.386 1.00 0.00 PROA ATOM 477 CA CGU P 30 10.511 16.706 27.038 1.00 0.00 PROA ATOM 478 HA CGU P 30 11.044 15.846 27.416 1.00 0.00 PROA ATOM 479 CB CGU P 30 10.939 17.968 27.786 1.00 0.00 PROA ATOM 480 HB1 CGU P 30 10.618 17.897 28.847 1.00 0.00 PROA ATOM 481 HB2 CGU P 30 10.456 18.855 27.324 1.00 0.00 PROA ATOM 482 CG CGU P 30 12.473 18.123 27.720 1.00 0.00 PROA ATOM 483 HG CGU P 30 12.849 17.610 26.810 1.00 0.00 PROA ATOM 484 CD1 CGU P 30 12.904 19.552 27.671 1.00 0.00 PROA ATOM 485 OE12 CGU P 30 14.132 19.733 27.424 1.00 0.00 PROA ATOM 486 OE11 CGU P 30 12.065 20.435 27.986 1.00 0.00 PROA ATOM 487 CD2 CGU P 30 13.209 17.290 28.716 1.00 0.00 PROA ATOM 488 OE22 CGU P 30 14.477 17.280 28.586 1.00 0.00 PROA ATOM 489 OE21 CGU P 30 12.583 16.711 29.633 1.00 0.00 PROA ATOM 490 C CGU P 30 9.059 16.365 27.321 1.00 0.00 PROA ATOM 491 O CGU P 30 8.766 15.649 28.282 1.00 0.00 PROA ATOM 492 N VAL P 31 8.116 16.849 26.489 1.00 0.00 PROA ATOM 493 HN VAL P 31 8.354 17.490 25.765 1.00 0.00 PROA ATOM 494 CA VAL P 31 6.703 16.499 26.558 1.00 0.00 PROA ATOM 495 HA VAL P 31 6.412 16.492 27.598 1.00 0.00 PROA ATOM 496 CB VAL P 31 5.856 17.501 25.778 1.00 0.00 PROA ATOM 497 HB VAL P 31 6.212 17.537 24.726 1.00 0.00 PROA ATOM 498 CG1 VAL P 31 4.359 17.112 25.793 1.00 0.00 PROA ATOM 499 HG11 VAL P 31 4.029 16.906 26.833 1.00 0.00 PROA ATOM 500 HG12 VAL P 31 4.200 16.198 25.182 1.00 0.00 PROA ATOM 501 HG13 VAL P 31 3.748 17.945 25.385 1.00 0.00 PROA ATOM 502 CG2 VAL P 31 6.057 18.894 26.404 1.00 0.00 PROA ATOM 503 HG21 VAL P 31 7.128 19.186 26.351 1.00 0.00 PROA ATOM 504 HG22 VAL P 31 5.746 18.878 27.471 1.00 0.00 PROA ATOM 505 HG23 VAL P 31 5.456 19.647 25.851 1.00 0.00 PROA ATOM 506 C VAL P 31 6.387 15.093 26.062 1.00 0.00 PROA ATOM 507 O VAL P 31 5.638 14.355 26.697 1.00 0.00 PROA ATOM 508 N PHE P 32 6.931 14.685 24.893 1.00 0.00 PROA ATOM 509 HN PHE P 32 7.616 15.223 24.409 1.00 0.00 PROA ATOM 510 CA PHE P 32 6.542 13.422 24.268 1.00 0.00 PROA ATOM 511 HA PHE P 32 5.568 13.145 24.644 1.00 0.00 PROA ATOM 512 CB PHE P 32 6.503 13.584 22.733 1.00 0.00 PROA ATOM 513 HB1 PHE P 32 6.375 12.590 22.253 1.00 0.00 PROA ATOM 514 HB2 PHE P 32 7.443 14.060 22.381 1.00 0.00 PROA ATOM 515 CG PHE P 32 5.363 14.449 22.304 1.00 0.00 PROA ATOM 516 CD1 PHE P 32 4.051 13.957 22.332 1.00 0.00 PROA ATOM 517 HD1 PHE P 32 3.856 12.975 22.737 1.00 0.00 PROA ATOM 518 CE1 PHE P 32 2.991 14.728 21.839 1.00 0.00 PROA ATOM 519 HE1 PHE P 32 1.992 14.319 21.810 1.00 0.00 PROA ATOM 520 CZ PHE P 32 3.229 16.029 21.385 1.00 0.00 PROA ATOM 521 HZ PHE P 32 2.411 16.635 21.023 1.00 0.00 PROA ATOM 522 CD2 PHE P 32 5.592 15.739 21.815 1.00 0.00 PROA ATOM 523 HD2 PHE P 32 6.602 16.117 21.757 1.00 0.00 PROA ATOM 524 CE2 PHE P 32 4.528 16.543 21.401 1.00 0.00 PROA ATOM 525 HE2 PHE P 32 4.709 17.562 21.093 1.00 0.00 PROA ATOM 526 C PHE P 32 7.488 12.254 24.516 1.00 0.00 PROA ATOM 527 O PHE P 32 7.141 11.099 24.250 1.00 0.00 PROA ATOM 528 N CGU P 33 8.716 12.542 24.984 1.00 0.00 PROA ATOM 529 HN CGU P 33 9.004 13.492 25.047 1.00 0.00 PROA ATOM 530 CA CGU P 33 9.727 11.602 25.432 1.00 0.00 PROA ATOM 531 HA CGU P 33 10.582 12.178 25.753 1.00 0.00 PROA ATOM 532 CB CGU P 33 9.279 10.691 26.583 1.00 0.00 PROA ATOM 533 HB1 CGU P 33 10.133 10.046 26.881 1.00 0.00 PROA ATOM 534 HB2 CGU P 33 8.449 10.046 26.225 1.00 0.00 PROA ATOM 535 CG CGU P 33 8.798 11.476 27.818 1.00 0.00 PROA ATOM 536 HG CGU P 33 8.019 12.203 27.503 1.00 0.00 PROA ATOM 537 CD1 CGU P 33 8.221 10.590 28.873 1.00 0.00 PROA ATOM 538 OE12 CGU P 33 7.195 11.048 29.455 1.00 0.00 PROA ATOM 539 OE11 CGU P 33 8.847 9.542 29.174 1.00 0.00 PROA ATOM 540 CD2 CGU P 33 9.786 12.474 28.324 1.00 0.00 PROA ATOM 541 OE22 CGU P 33 9.310 13.628 28.581 1.00 0.00 PROA ATOM 542 OE21 CGU P 33 10.975 12.135 28.520 1.00 0.00 PROA ATOM 543 C CGU P 33 10.410 10.833 24.318 1.00 0.00 PROA ATOM 544 O CGU P 33 11.609 10.990 24.058 1.00 0.00 PROA ATOM 545 N ASN P 34 9.616 9.976 23.648 1.00 0.00 PROA ATOM 546 HN ASN P 34 8.673 9.878 23.945 1.00 0.00 PROA ATOM 547 CA ASN P 34 9.923 9.135 22.514 1.00 0.00 PROA ATOM 548 HA ASN P 34 10.783 8.529 22.758 1.00 0.00 PROA ATOM 549 CB ASN P 34 8.683 8.239 22.209 1.00 0.00 PROA ATOM 550 HB1 ASN P 34 7.868 8.863 21.784 1.00 0.00 PROA ATOM 551 HB2 ASN P 34 8.326 7.764 23.148 1.00 0.00 PROA ATOM 552 CG ASN P 34 9.052 7.156 21.213 1.00 0.00 PROA ATOM 553 OD1 ASN P 34 9.113 7.412 20.010 1.00 0.00 PROA ATOM 554 ND2 ASN P 34 9.344 5.928 21.692 1.00 0.00 PROA ATOM 555 HD21 ASN P 34 9.591 5.191 21.062 1.00 0.00 PROA ATOM 556 HD22 ASN P 34 9.313 5.755 22.676 1.00 0.00 PROA ATOM 557 C ASN P 34 10.327 9.961 21.285 1.00 0.00 PROA ATOM 558 O ASN P 34 9.609 10.877 20.893 1.00 0.00 PROA ATOM 559 N CGU P 35 11.464 9.630 20.624 1.00 0.00 PROA ATOM 560 HN CGU P 35 12.025 8.863 20.922 1.00 0.00 PROA ATOM 561 CA CGU P 35 11.963 10.337 19.453 1.00 0.00 PROA ATOM 562 HA CGU P 35 12.114 11.376 19.706 1.00 0.00 PROA ATOM 563 CB CGU P 35 13.297 9.680 19.043 1.00 0.00 PROA ATOM 564 HB1 CGU P 35 13.085 8.631 18.748 1.00 0.00 PROA ATOM 565 HB2 CGU P 35 13.964 9.677 19.931 1.00 0.00 PROA ATOM 566 CG CGU P 35 14.057 10.358 17.879 1.00 0.00 PROA ATOM 567 HG CGU P 35 14.187 11.436 18.112 1.00 0.00 PROA ATOM 568 CD1 CGU P 35 15.404 9.757 17.646 1.00 0.00 PROA ATOM 569 OE12 CGU P 35 16.320 10.586 17.371 1.00 0.00 PROA ATOM 570 OE11 CGU P 35 15.499 8.503 17.626 1.00 0.00 PROA ATOM 571 CD2 CGU P 35 13.239 10.535 16.643 1.00 0.00 PROA ATOM 572 OE22 CGU P 35 13.307 11.689 16.107 1.00 0.00 PROA ATOM 573 OE21 CGU P 35 12.595 9.569 16.174 1.00 0.00 PROA ATOM 574 C CGU P 35 10.979 10.365 18.288 1.00 0.00 PROA ATOM 575 O CGU P 35 10.641 11.439 17.790 1.00 0.00 PROA ATOM 576 N VAL P 36 10.391 9.207 17.908 1.00 0.00 PROA ATOM 577 HN VAL P 36 10.584 8.354 18.386 1.00 0.00 PROA ATOM 578 CA VAL P 36 9.447 9.091 16.799 1.00 0.00 PROA ATOM 579 HA VAL P 36 9.909 9.518 15.921 1.00 0.00 PROA ATOM 580 CB VAL P 36 9.080 7.624 16.546 1.00 0.00 PROA ATOM 581 HB VAL P 36 8.663 7.182 17.476 1.00 0.00 PROA ATOM 582 CG1 VAL P 36 8.034 7.523 15.415 1.00 0.00 PROA ATOM 583 HG11 VAL P 36 8.273 8.248 14.608 1.00 0.00 PROA ATOM 584 HG12 VAL P 36 7.023 7.756 15.813 1.00 0.00 PROA ATOM 585 HG13 VAL P 36 8.040 6.499 14.985 1.00 0.00 PROA ATOM 586 CG2 VAL P 36 10.368 6.862 16.158 1.00 0.00 PROA ATOM 587 HG21 VAL P 36 11.112 6.927 16.980 1.00 0.00 PROA ATOM 588 HG22 VAL P 36 10.811 7.310 15.243 1.00 0.00 PROA ATOM 589 HG23 VAL P 36 10.134 5.792 15.975 1.00 0.00 PROA ATOM 590 C VAL P 36 8.204 9.941 17.024 1.00 0.00 PROA ATOM 591 O VAL P 36 7.818 10.736 16.156 1.00 0.00 PROA ATOM 592 N VAL P 37 7.604 9.865 18.230 1.00 0.00 PROA ATOM 593 HN VAL P 37 7.956 9.252 18.932 1.00 0.00 PROA ATOM 594 CA VAL P 37 6.425 10.634 18.630 1.00 0.00 PROA ATOM 595 HA VAL P 37 5.649 10.441 17.904 1.00 0.00 PROA ATOM 596 CB VAL P 37 5.928 10.266 20.033 1.00 0.00 PROA ATOM 597 HB VAL P 37 6.747 10.419 20.767 1.00 0.00 PROA ATOM 598 CG1 VAL P 37 4.721 11.147 20.419 1.00 0.00 PROA ATOM 599 HG11 VAL P 37 3.965 11.137 19.605 1.00 0.00 PROA ATOM 600 HG12 VAL P 37 5.054 12.194 20.581 1.00 0.00 PROA ATOM 601 HG13 VAL P 37 4.249 10.757 21.346 1.00 0.00 PROA ATOM 602 CG2 VAL P 37 5.497 8.784 20.077 1.00 0.00 PROA ATOM 603 HG21 VAL P 37 6.356 8.129 19.820 1.00 0.00 PROA ATOM 604 HG22 VAL P 37 4.682 8.605 19.343 1.00 0.00 PROA ATOM 605 HG23 VAL P 37 5.145 8.523 21.098 1.00 0.00 PROA ATOM 606 C VAL P 37 6.680 12.142 18.570 1.00 0.00 PROA ATOM 607 O VAL P 37 5.877 12.913 18.037 1.00 0.00 PROA ATOM 608 N THR P 38 7.849 12.591 19.087 1.00 0.00 PROA ATOM 609 HN THR P 38 8.467 11.972 19.565 1.00 0.00 PROA ATOM 610 CA THR P 38 8.314 13.983 19.002 1.00 0.00 PROA ATOM 611 HA THR P 38 7.548 14.602 19.443 1.00 0.00 PROA ATOM 612 CB THR P 38 9.644 14.239 19.707 1.00 0.00 PROA ATOM 613 HB THR P 38 10.434 13.609 19.245 1.00 0.00 PROA ATOM 614 OG1 THR P 38 9.571 13.925 21.094 1.00 0.00 PROA ATOM 615 HG1 THR P 38 9.663 12.971 21.155 1.00 0.00 PROA ATOM 616 CG2 THR P 38 10.064 15.719 19.657 1.00 0.00 PROA ATOM 617 HG21 THR P 38 9.296 16.351 20.151 1.00 0.00 PROA ATOM 618 HG22 THR P 38 10.167 16.047 18.601 1.00 0.00 PROA ATOM 619 HG23 THR P 38 11.031 15.856 20.187 1.00 0.00 PROA ATOM 620 C THR P 38 8.479 14.450 17.569 1.00 0.00 PROA ATOM 621 O THR P 38 7.999 15.523 17.205 1.00 0.00 PROA ATOM 622 N ASP P 39 9.108 13.642 16.692 1.00 0.00 PROA ATOM 623 HN ASP P 39 9.521 12.787 16.993 1.00 0.00 PROA ATOM 624 CA ASP P 39 9.246 13.918 15.275 1.00 0.00 PROA ATOM 625 HA ASP P 39 9.697 14.893 15.163 1.00 0.00 PROA ATOM 626 CB ASP P 39 10.125 12.837 14.612 1.00 0.00 PROA ATOM 627 HB1 ASP P 39 10.078 12.959 13.509 1.00 0.00 PROA ATOM 628 HB2 ASP P 39 9.733 11.834 14.885 1.00 0.00 PROA ATOM 629 CG ASP P 39 11.586 12.923 15.048 1.00 0.00 PROA ATOM 630 OD1 ASP P 39 11.971 13.847 15.817 1.00 0.00 PROA ATOM 631 OD2 ASP P 39 12.332 12.076 14.505 1.00 0.00 PROA ATOM 632 C ASP P 39 7.917 14.023 14.521 1.00 0.00 PROA ATOM 633 O ASP P 39 7.735 14.914 13.688 1.00 0.00 PROA ATOM 634 N CGU P 40 6.939 13.133 14.798 1.00 0.00 PROA ATOM 635 HN CGU P 40 7.102 12.371 15.419 1.00 0.00 PROA ATOM 636 CA CGU P 40 5.591 13.191 14.238 1.00 0.00 PROA ATOM 637 HA CGU P 40 5.674 13.207 13.161 1.00 0.00 PROA ATOM 638 CB CGU P 40 4.751 11.971 14.679 1.00 0.00 PROA ATOM 639 HB1 CGU P 40 3.693 12.139 14.385 1.00 0.00 PROA ATOM 640 HB2 CGU P 40 4.806 11.878 15.784 1.00 0.00 PROA ATOM 641 CG CGU P 40 5.243 10.652 14.042 1.00 0.00 PROA ATOM 642 HG CGU P 40 6.330 10.538 14.240 1.00 0.00 PROA ATOM 643 CD1 CGU P 40 4.534 9.454 14.583 1.00 0.00 PROA ATOM 644 OE12 CGU P 40 5.266 8.439 14.774 1.00 0.00 PROA ATOM 645 OE11 CGU P 40 3.282 9.505 14.694 1.00 0.00 PROA ATOM 646 CD2 CGU P 40 5.333 10.695 12.552 1.00 0.00 PROA ATOM 647 OE22 CGU P 40 6.413 10.231 12.059 1.00 0.00 PROA ATOM 648 OE21 CGU P 40 4.364 11.113 11.878 1.00 0.00 PROA ATOM 649 C CGU P 40 4.835 14.476 14.546 1.00 0.00 PROA ATOM 650 O CGU P 40 4.240 15.079 13.646 1.00 0.00 PROA ATOM 651 N PHE P 41 4.903 14.956 15.807 1.00 0.00 PROA ATOM 652 HN PHE P 41 5.278 14.399 16.543 1.00 0.00 PROA ATOM 653 CA PHE P 41 4.457 16.279 16.214 1.00 0.00 PROA ATOM 654 HA PHE P 41 3.419 16.394 15.939 1.00 0.00 PROA ATOM 655 CB PHE P 41 4.642 16.399 17.763 1.00 0.00 PROA ATOM 656 HB1 PHE P 41 5.675 16.094 18.034 1.00 0.00 PROA ATOM 657 HB2 PHE P 41 3.904 15.743 18.272 1.00 0.00 PROA ATOM 658 CG PHE P 41 4.435 17.802 18.292 1.00 0.00 PROA ATOM 659 CD1 PHE P 41 3.151 18.357 18.384 1.00 0.00 PROA ATOM 660 HD1 PHE P 41 2.290 17.758 18.127 1.00 0.00 PROA ATOM 661 CE1 PHE P 41 2.974 19.680 18.806 1.00 0.00 PROA ATOM 662 HE1 PHE P 41 1.980 20.097 18.868 1.00 0.00 PROA ATOM 663 CZ PHE P 41 4.080 20.462 19.147 1.00 0.00 PROA ATOM 664 HZ PHE P 41 3.941 21.477 19.489 1.00 0.00 PROA ATOM 665 CD2 PHE P 41 5.541 18.604 18.625 1.00 0.00 PROA ATOM 666 HD2 PHE P 41 6.538 18.194 18.556 1.00 0.00 PROA ATOM 667 CE2 PHE P 41 5.365 19.928 19.045 1.00 0.00 PROA ATOM 668 HE2 PHE P 41 6.224 20.536 19.290 1.00 0.00 PROA ATOM 669 C PHE P 41 5.237 17.385 15.494 1.00 0.00 PROA ATOM 670 O PHE P 41 4.658 18.275 14.862 1.00 0.00 PROA ATOM 671 N TRP P 42 6.584 17.315 15.549 1.00 0.00 PROA ATOM 672 HN TRP P 42 7.036 16.506 15.914 1.00 0.00 PROA ATOM 673 CA TRP P 42 7.486 18.362 15.103 1.00 0.00 PROA ATOM 674 HA TRP P 42 7.169 19.290 15.555 1.00 0.00 PROA ATOM 675 CB TRP P 42 8.947 18.042 15.504 1.00 0.00 PROA ATOM 676 HB1 TRP P 42 9.310 17.199 14.879 1.00 0.00 PROA ATOM 677 HB2 TRP P 42 8.964 17.738 16.572 1.00 0.00 PROA ATOM 678 CG TRP P 42 9.898 19.203 15.329 1.00 0.00 PROA ATOM 679 CD1 TRP P 42 10.845 19.427 14.372 1.00 0.00 PROA ATOM 680 HD1 TRP P 42 11.060 18.745 13.562 1.00 0.00 PROA ATOM 681 NE1 TRP P 42 11.499 20.638 14.565 1.00 0.00 PROA ATOM 682 HE1 TRP P 42 12.228 21.004 14.030 1.00 0.00 PROA ATOM 683 CE2 TRP P 42 10.900 21.224 15.681 1.00 0.00 PROA ATOM 684 CD2 TRP P 42 9.921 20.398 16.159 1.00 0.00 PROA ATOM 685 CE3 TRP P 42 9.131 20.736 17.266 1.00 0.00 PROA ATOM 686 HE3 TRP P 42 8.380 20.073 17.671 1.00 0.00 PROA ATOM 687 CZ3 TRP P 42 9.359 21.999 17.842 1.00 0.00 PROA ATOM 688 HZ3 TRP P 42 8.765 22.309 18.689 1.00 0.00 PROA ATOM 689 CZ2 TRP P 42 11.169 22.474 16.272 1.00 0.00 PROA ATOM 690 HZ2 TRP P 42 11.968 23.119 15.937 1.00 0.00 PROA ATOM 691 CH2 TRP P 42 10.334 22.857 17.343 1.00 0.00 PROA ATOM 692 HH2 TRP P 42 10.454 23.835 17.784 1.00 0.00 PROA ATOM 693 C TRP P 42 7.401 18.718 13.620 1.00 0.00 PROA ATOM 694 O TRP P 42 7.427 19.894 13.259 1.00 0.00 PROA ATOM 695 N ARG P 43 7.258 17.714 12.726 1.00 0.00 PROA ATOM 696 HN ARG P 43 7.222 16.764 13.025 1.00 0.00 PROA ATOM 697 CA ARG P 43 7.145 17.909 11.279 1.00 0.00 PROA ATOM 698 HA ARG P 43 8.022 18.447 10.952 1.00 0.00 PROA ATOM 699 CB ARG P 43 7.032 16.559 10.511 1.00 0.00 PROA ATOM 700 HB1 ARG P 43 6.763 16.773 9.455 1.00 0.00 PROA ATOM 701 HB2 ARG P 43 6.223 15.955 10.973 1.00 0.00 PROA ATOM 702 CG ARG P 43 8.336 15.734 10.530 1.00 0.00 PROA ATOM 703 HG1 ARG P 43 8.477 15.337 11.557 1.00 0.00 PROA ATOM 704 HG2 ARG P 43 9.178 16.416 10.288 1.00 0.00 PROA ATOM 705 CD ARG P 43 8.386 14.548 9.550 1.00 0.00 PROA ATOM 706 HD1 ARG P 43 9.375 14.045 9.604 1.00 0.00 PROA ATOM 707 HD2 ARG P 43 8.191 14.897 8.513 1.00 0.00 PROA ATOM 708 NE ARG P 43 7.322 13.543 9.921 1.00 0.00 PROA ATOM 709 HE ARG P 43 6.423 13.661 9.503 1.00 0.00 PROA ATOM 710 CZ ARG P 43 7.473 12.505 10.761 1.00 0.00 PROA ATOM 711 NH1 ARG P 43 6.431 11.718 11.034 1.00 0.00 PROA ATOM 712 HH11 ARG P 43 6.472 10.742 10.819 1.00 0.00 PROA ATOM 713 HH12 ARG P 43 5.609 12.104 11.454 1.00 0.00 PROA ATOM 714 NH2 ARG P 43 8.615 12.255 11.390 1.00 0.00 PROA ATOM 715 HH21 ARG P 43 9.406 12.850 11.247 1.00 0.00 PROA ATOM 716 HH22 ARG P 43 8.685 11.471 12.007 1.00 0.00 PROA ATOM 717 C ARG P 43 5.992 18.811 10.843 1.00 0.00 PROA ATOM 718 O ARG P 43 6.126 19.572 9.884 1.00 0.00 PROA ATOM 719 N ARG P 44 4.830 18.736 11.524 1.00 0.00 PROA ATOM 720 HN ARG P 44 4.661 18.012 12.188 1.00 0.00 PROA ATOM 721 CA ARG P 44 3.745 19.691 11.347 1.00 0.00 PROA ATOM 722 HA ARG P 44 3.722 19.974 10.305 1.00 0.00 PROA ATOM 723 CB ARG P 44 2.388 19.092 11.763 1.00 0.00 PROA ATOM 724 HB1 ARG P 44 1.617 19.891 11.741 1.00 0.00 PROA ATOM 725 HB2 ARG P 44 2.468 18.699 12.799 1.00 0.00 PROA ATOM 726 CG ARG P 44 1.957 17.956 10.829 1.00 0.00 PROA ATOM 727 HG1 ARG P 44 2.717 17.147 10.864 1.00 0.00 PROA ATOM 728 HG2 ARG P 44 1.892 18.343 9.790 1.00 0.00 PROA ATOM 729 CD ARG P 44 0.604 17.389 11.237 1.00 0.00 PROA ATOM 730 HD1 ARG P 44 -0.189 18.165 11.177 1.00 0.00 PROA ATOM 731 HD2 ARG P 44 0.643 16.960 12.261 1.00 0.00 PROA ATOM 732 NE ARG P 44 0.300 16.298 10.258 1.00 0.00 PROA ATOM 733 HE ARG P 44 0.926 16.166 9.490 1.00 0.00 PROA ATOM 734 CZ ARG P 44 -0.763 15.488 10.351 1.00 0.00 PROA ATOM 735 NH1 ARG P 44 -0.952 14.531 9.445 1.00 0.00 PROA ATOM 736 HH11 ARG P 44 -0.300 14.417 8.695 1.00 0.00 PROA ATOM 737 HH12 ARG P 44 -1.745 13.926 9.514 1.00 0.00 PROA ATOM 738 NH2 ARG P 44 -1.648 15.619 11.334 1.00 0.00 PROA ATOM 739 HH21 ARG P 44 -1.527 16.333 12.023 1.00 0.00 PROA ATOM 740 HH22 ARG P 44 -2.434 15.003 11.384 1.00 0.00 PROA ATOM 741 C ARG P 44 3.949 20.993 12.110 1.00 0.00 PROA ATOM 742 O ARG P 44 3.774 22.072 11.547 1.00 0.00 PROA ATOM 743 N TYR P 45 4.341 20.925 13.406 1.00 0.00 PROA ATOM 744 HN TYR P 45 4.548 20.046 13.826 1.00 0.00 PROA ATOM 745 CA TYR P 45 4.498 22.073 14.294 1.00 0.00 PROA ATOM 746 HA TYR P 45 3.575 22.633 14.294 1.00 0.00 PROA ATOM 747 CB TYR P 45 4.835 21.567 15.729 1.00 0.00 PROA ATOM 748 HB1 TYR P 45 5.835 21.084 15.732 1.00 0.00 PROA ATOM 749 HB2 TYR P 45 4.061 20.845 16.065 1.00 0.00 PROA ATOM 750 CG TYR P 45 4.868 22.697 16.717 1.00 0.00 PROA ATOM 751 CD1 TYR P 45 3.689 23.261 17.227 1.00 0.00 PROA ATOM 752 HD1 TYR P 45 2.731 22.846 16.950 1.00 0.00 PROA ATOM 753 CE1 TYR P 45 3.749 24.362 18.096 1.00 0.00 PROA ATOM 754 HE1 TYR P 45 2.839 24.797 18.482 1.00 0.00 PROA ATOM 755 CZ TYR P 45 4.991 24.894 18.461 1.00 0.00 PROA ATOM 756 OH TYR P 45 5.171 26.020 19.288 1.00 0.00 PROA ATOM 757 HH TYR P 45 4.320 26.246 19.671 1.00 0.00 PROA ATOM 758 CD2 TYR P 45 6.099 23.255 17.081 1.00 0.00 PROA ATOM 759 HD2 TYR P 45 7.013 22.835 16.688 1.00 0.00 PROA ATOM 760 CE2 TYR P 45 6.159 24.348 17.946 1.00 0.00 PROA ATOM 761 HE2 TYR P 45 7.116 24.770 18.215 1.00 0.00 PROA ATOM 762 C TYR P 45 5.519 23.108 13.811 1.00 0.00 PROA ATOM 763 O TYR P 45 5.289 24.316 13.872 1.00 0.00 PROA ATOM 764 N LYS P 46 6.669 22.657 13.289 1.00 0.00 PROA ATOM 765 HN LYS P 46 6.843 21.681 13.186 1.00 0.00 PROA ATOM 766 CA LYS P 46 7.730 23.522 12.841 1.00 0.00 PROA ATOM 767 HA LYS P 46 7.719 24.428 13.428 1.00 0.00 PROA ATOM 768 CB LYS P 46 9.052 22.738 13.040 1.00 0.00 PROA ATOM 769 HB1 LYS P 46 9.024 21.859 12.364 1.00 0.00 PROA ATOM 770 HB2 LYS P 46 9.076 22.385 14.092 1.00 0.00 PROA ATOM 771 CG LYS P 46 10.370 23.485 12.773 1.00 0.00 PROA ATOM 772 HG1 LYS P 46 10.413 23.754 11.696 1.00 0.00 PROA ATOM 773 HG2 LYS P 46 11.216 22.805 13.008 1.00 0.00 PROA ATOM 774 CD LYS P 46 10.527 24.768 13.605 1.00 0.00 PROA ATOM 775 HD1 LYS P 46 10.502 24.502 14.683 1.00 0.00 PROA ATOM 776 HD2 LYS P 46 9.676 25.446 13.383 1.00 0.00 PROA ATOM 777 CE LYS P 46 11.834 25.501 13.307 1.00 0.00 PROA ATOM 778 HE1 LYS P 46 11.831 25.877 12.262 1.00 0.00 PROA ATOM 779 HE2 LYS P 46 12.698 24.821 13.466 1.00 0.00 PROA ATOM 780 NZ LYS P 46 11.988 26.661 14.213 1.00 0.00 PROA ATOM 781 HZ1 LYS P 46 12.000 26.332 15.199 1.00 0.00 PROA ATOM 782 HZ2 LYS P 46 11.192 27.316 14.076 1.00 0.00 PROA ATOM 783 HZ3 LYS P 46 12.880 27.151 14.000 1.00 0.00 PROA ATOM 784 C LYS P 46 7.556 23.966 11.395 1.00 0.00 PROA ATOM 785 O LYS P 46 8.271 24.862 10.944 1.00 0.00 PROA ATOM 786 N GLY P 47 6.579 23.403 10.637 1.00 0.00 PROA ATOM 787 HN GLY P 47 5.895 22.803 11.043 1.00 0.00 PROA ATOM 788 CA GLY P 47 6.440 23.617 9.192 1.00 0.00 PROA ATOM 789 HA1 GLY P 47 5.602 23.022 8.861 1.00 0.00 PROA ATOM 790 HA2 GLY P 47 7.351 23.267 8.730 1.00 0.00 PROA ATOM 791 C GLY P 47 6.208 25.040 8.763 1.00 0.00 PROA ATOM 792 O GLY P 47 6.575 25.444 7.661 1.00 0.00 PROA ATOM 793 N GLY P 48 5.589 25.827 9.660 1.00 0.00 PROA ATOM 794 HN GLY P 48 5.375 25.481 10.569 1.00 0.00 PROA ATOM 795 CA GLY P 48 5.178 27.198 9.431 1.00 0.00 PROA ATOM 796 HA1 GLY P 48 5.967 27.707 8.898 1.00 0.00 PROA ATOM 797 HA2 GLY P 48 5.010 27.669 10.388 1.00 0.00 PROA ATOM 798 C GLY P 48 3.916 27.240 8.621 1.00 0.00 PROA ATOM 799 O GLY P 48 3.462 26.251 8.056 1.00 0.00 PROA ATOM 800 N SER P 49 3.293 28.423 8.543 1.00 0.00 PROA ATOM 801 HN SER P 49 3.613 29.222 9.046 1.00 0.00 PROA ATOM 802 CA SER P 49 2.120 28.618 7.727 1.00 0.00 PROA ATOM 803 HA SER P 49 1.675 27.652 7.537 1.00 0.00 PROA ATOM 804 CB SER P 49 1.119 29.541 8.462 1.00 0.00 PROA ATOM 805 HB1 SER P 49 1.541 30.568 8.502 1.00 0.00 PROA ATOM 806 HB2 SER P 49 0.973 29.160 9.495 1.00 0.00 PROA ATOM 807 OG SER P 49 -0.172 29.619 7.834 1.00 0.00 PROA ATOM 808 HG1 SER P 49 -0.640 30.329 8.279 1.00 0.00 PROA ATOM 809 C SER P 49 2.663 29.289 6.453 1.00 0.00 PROA ATOM 810 O SER P 49 3.350 30.287 6.611 1.00 0.00 PROA ATOM 811 N PRO P 50 2.466 28.773 5.222 1.00 0.00 PROA ATOM 812 CD PRO P 50 2.193 27.350 5.035 1.00 0.00 PROA ATOM 813 HD1 PRO P 50 1.130 27.145 5.282 1.00 0.00 PROA ATOM 814 HD2 PRO P 50 2.856 26.759 5.702 1.00 0.00 PROA ATOM 815 CA PRO P 50 3.023 29.392 4.007 1.00 0.00 PROA ATOM 816 HA PRO P 50 3.872 30.006 4.261 1.00 0.00 PROA ATOM 817 CB PRO P 50 3.352 28.200 3.079 1.00 0.00 PROA ATOM 818 HB1 PRO P 50 4.429 27.936 3.150 1.00 0.00 PROA ATOM 819 HB2 PRO P 50 3.113 28.451 2.023 1.00 0.00 PROA ATOM 820 CG PRO P 50 2.480 27.036 3.566 1.00 0.00 PROA ATOM 821 HG1 PRO P 50 1.536 26.980 2.983 1.00 0.00 PROA ATOM 822 HG2 PRO P 50 3.021 26.070 3.468 1.00 0.00 PROA ATOM 823 C PRO P 50 2.003 30.318 3.376 1.00 0.00 PROA ATOM 824 O PRO P 50 2.284 30.889 2.318 1.00 0.00 PROA ATOM 825 N CYS P 51 0.845 30.467 4.028 1.00 0.00 PROA ATOM 826 HN CYS P 51 0.650 29.903 4.824 1.00 0.00 PROA ATOM 827 CA CYS P 51 -0.217 31.399 3.699 1.00 0.00 PROA ATOM 828 HA CYS P 51 -0.173 31.594 2.638 1.00 0.00 PROA ATOM 829 CB CYS P 51 -1.609 30.814 4.082 1.00 0.00 PROA ATOM 830 HB1 CYS P 51 -2.363 31.615 3.937 1.00 0.00 PROA ATOM 831 HB2 CYS P 51 -1.579 30.552 5.160 1.00 0.00 PROA ATOM 832 SG CYS P 51 -2.133 29.344 3.140 1.00 0.00 PROA ATOM 833 HG1 CYS P 51 -1.241 28.532 3.688 1.00 0.00 PROA ATOM 834 C CYS P 51 -0.074 32.715 4.513 1.00 0.00 PROA ATOM 835 O CYS P 51 0.812 32.795 5.403 1.00 0.00 PROA ATOM 836 NT CYS P 51 -0.938 33.718 4.201 1.00 0.00 PROA ATOM 837 HT1 CYS P 51 -0.893 34.588 4.692 1.00 0.00 PROA ATOM 838 HT2 CYS P 51 -1.619 33.586 3.481 1.00 0.00 PROA ATOM 839 CAL CAL H 202 13.802 22.215 29.051 1.00 0.00 HETA ATOM 840 CAL CAL H 203 9.977 21.848 29.449 1.00 0.00 HETB ATOM 841 CAL CAL H 204 9.504 25.414 28.618 1.00 0.00 HETC ATOM 842 CAL CAL H 205 7.076 28.315 29.169 1.00 0.00 HETD ATOM 843 CAL CAL H 206 -4.792 27.583 26.744 1.00 0.00 HETE ATOM 844 CAL CAL H 207 3.273 31.283 29.277 1.00 0.00 HETF ATOM 845 CAL CAL H 208 16.216 18.571 28.150 1.00 0.00 HETG ATOM 846 O1 DPS H 451 4.340 28.898 30.754 1.00 0.00 HETH ATOM 847 C1 DPS H 451 3.686 29.902 31.134 1.00 0.00 HETH ATOM 848 O2 DPS H 451 2.428 29.999 31.073 1.00 0.00 HETH ATOM 849 C2 DPS H 451 4.555 31.039 31.715 1.00 0.00 HETH ATOM 850 H1 DPS H 451 5.387 31.263 31.013 1.00 0.00 HETH ATOM 851 N1 DPS H 451 3.770 32.296 31.912 1.00 0.00 HETH ATOM 852 H2 DPS H 451 2.758 32.098 31.775 1.00 0.00 HETH ATOM 853 H3 DPS H 451 4.080 33.010 31.222 1.00 0.00 HETH ATOM 854 H4 DPS H 451 3.926 32.655 32.876 1.00 0.00 HETH ATOM 855 C3 DPS H 451 5.360 30.675 33.005 1.00 0.00 HETH ATOM 856 H5 DPS H 451 4.732 30.925 33.886 1.00 0.00 HETH ATOM 857 H6 DPS H 451 6.281 31.295 33.024 1.00 0.00 HETH ATOM 858 O3 DPS H 451 5.764 29.277 33.131 1.00 0.00 HETH ATOM 859 P1 DPS H 451 5.103 28.060 34.010 1.00 0.00 HETH ATOM 860 O4 DPS H 451 3.702 28.397 34.367 1.00 0.00 HETH ATOM 861 O5 DPS H 451 5.331 26.780 33.317 1.00 0.00 HETH ATOM 862 O6 DPS H 451 6.029 28.068 35.327 1.00 0.00 HETH ATOM 863 C4 DPS H 451 5.995 28.816 36.543 1.00 0.00 HETH ATOM 864 H7 DPS H 451 5.186 28.422 37.195 1.00 0.00 HETH ATOM 865 H8 DPS H 451 5.790 29.883 36.313 1.00 0.00 HETH ATOM 866 C5 DPS H 451 7.350 28.689 37.259 1.00 0.00 HETH ATOM 867 H9 DPS H 451 8.158 28.578 36.504 1.00 0.00 HETH ATOM 868 O7 DPS H 451 7.364 27.557 38.121 1.00 0.00 HETH ATOM 869 C6 DPS H 451 7.778 29.926 38.046 1.00 0.00 HETH ATOM 870 H10 DPS H 451 8.526 29.643 38.817 1.00 0.00 HETH ATOM 871 H11 DPS H 451 6.895 30.380 38.545 1.00 0.00 HETH ATOM 872 O8 DPS H 451 8.357 30.876 37.149 1.00 0.00 HETH ATOM 873 C7 DPS H 451 9.371 31.620 37.613 1.00 0.00 HETH ATOM 874 O9 DPS H 451 10.323 31.190 38.240 1.00 0.00 HETH ATOM 875 C8 DPS H 451 9.158 33.116 37.165 1.00 0.00 HETH ATOM 876 H12 DPS H 451 8.198 33.493 37.577 1.00 0.00 HETH ATOM 877 H13 DPS H 451 9.122 33.174 36.056 1.00 0.00 HETH ATOM 878 H14 DPS H 451 9.988 33.745 37.551 1.00 0.00 HETH ATOM 879 C9 DPS H 451 6.441 27.772 39.097 1.00 0.00 HETH ATOM 880 C10 DPS H 451 5.756 29.024 39.031 1.00 0.00 HETH ATOM 881 H15 DPS H 451 5.989 29.524 38.067 1.00 0.00 HETH ATOM 882 H16 DPS H 451 6.088 29.678 39.866 1.00 0.00 HETH ATOM 883 H17 DPS H 451 4.660 28.856 39.093 1.00 0.00 HETH ATOM 884 O10 DPS H 451 6.211 26.947 39.971 1.00 0.00 HETH TER 885 DPS 451 END If you find results from this site helpful for your research, please cite one of our papers:
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