EXPDTA T0298TS550_4_1-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0298TS550_4_1-scwrl ATOM 1 C PRO 4 -10.328 -2.986 -6.174 1.00 0.00 ATOM 2 N LEU A 5 -9.200 -2.780 -5.160 1.00 0.00 ATOM 3 CA LEU A 5 -9.690 -2.260 -3.890 1.00 0.00 ATOM 4 CB LEU A 5 -9.665 -3.352 -2.818 1.00 0.00 ATOM 5 CG LEU A 5 -10.638 -4.516 -3.014 1.00 0.00 ATOM 6 CD1 LEU A 5 -10.342 -5.636 -2.028 1.00 0.00 ATOM 7 CD2 LEU A 5 -12.073 -4.059 -2.797 1.00 0.00 ATOM 8 O LEU A 5 -7.620 -1.130 -3.950 1.00 0.00 ATOM 9 C LEU A 5 -8.770 -1.140 -3.530 1.00 0.00 ATOM 10 N ASN A 6 -9.290 -0.210 -2.740 1.00 0.00 ATOM 11 CA ASN A 6 -8.470 0.780 -2.130 1.00 0.00 ATOM 12 CB ASN A 6 -8.724 2.150 -2.762 1.00 0.00 ATOM 13 CG ASN A 6 -7.807 3.224 -2.212 1.00 0.00 ATOM 14 ND2 ASN A 6 -6.839 3.644 -3.019 1.00 0.00 ATOM 15 OD1 ASN A 6 -7.968 3.670 -1.076 1.00 0.00 ATOM 16 O ASN A 6 -9.930 0.750 -0.250 1.00 0.00 ATOM 17 C ASN A 6 -8.770 0.870 -0.650 1.00 0.00 ATOM 18 N VAL A 7 -7.710 0.990 0.130 1.00 0.00 ATOM 19 CA VAL A 7 -7.770 1.040 1.580 1.00 0.00 ATOM 20 CB VAL A 7 -6.903 -0.060 2.219 1.00 0.00 ATOM 21 CG1 VAL A 7 -7.419 -1.438 1.832 1.00 0.00 ATOM 22 CG2 VAL A 7 -5.460 0.061 1.753 1.00 0.00 ATOM 23 O VAL A 7 -6.460 3.020 1.260 1.00 0.00 ATOM 24 C VAL A 7 -7.250 2.420 1.990 1.00 0.00 ATOM 25 N ALA A 8 -7.710 2.950 3.120 1.00 0.00 ATOM 26 CA ALA A 8 -7.310 4.290 3.570 1.00 0.00 ATOM 27 CB ALA A 8 -8.405 4.911 4.424 1.00 0.00 ATOM 28 O ALA A 8 -6.020 3.270 5.260 1.00 0.00 ATOM 29 C ALA A 8 -6.030 4.130 4.390 1.00 0.00 ATOM 30 N VAL A 9 -4.990 4.930 4.140 1.00 0.00 ATOM 31 CA VAL A 9 -3.730 4.840 4.890 1.00 0.00 ATOM 32 CB VAL A 9 -2.568 4.385 3.988 1.00 0.00 ATOM 33 CG1 VAL A 9 -2.332 5.393 2.873 1.00 0.00 ATOM 34 CG2 VAL A 9 -1.286 4.255 4.796 1.00 0.00 ATOM 35 O VAL A 9 -3.690 7.220 4.850 1.00 0.00 ATOM 36 C VAL A 9 -3.380 6.200 5.470 1.00 0.00 ATOM 37 N VAL A 10 -2.720 6.210 6.640 1.00 0.00 ATOM 38 CA VAL A 10 -2.320 7.450 7.300 1.00 0.00 ATOM 39 CB VAL A 10 -3.315 7.846 8.407 1.00 0.00 ATOM 40 CG1 VAL A 10 -4.623 8.329 7.800 1.00 0.00 ATOM 41 CG2 VAL A 10 -3.612 6.657 9.307 1.00 0.00 ATOM 42 O VAL A 10 -0.610 6.130 8.310 1.00 0.00 ATOM 43 C VAL A 10 -0.950 7.250 7.920 1.00 0.00 ATOM 44 N GLY A 11 0.030 7.499 6.429 1.00 0.00 ATOM 45 CA GLY A 11 1.195 8.302 6.102 1.00 0.00 ATOM 46 O GLY A 11 1.533 6.655 4.447 1.00 0.00 ATOM 47 C GLY A 11 1.760 7.814 4.781 1.00 0.00 ATOM 48 N ALA A 12 2.494 8.646 4.031 1.00 0.00 ATOM 49 CA ALA A 12 3.163 8.137 2.806 1.00 0.00 ATOM 50 CB ALA A 12 2.172 8.057 1.655 1.00 0.00 ATOM 51 O ALA A 12 4.306 10.186 2.650 1.00 0.00 ATOM 52 C ALA A 12 4.305 9.031 2.367 1.00 0.00 ATOM 53 N THR A 13 5.291 8.492 1.694 1.00 0.00 ATOM 54 CA THR A 13 6.343 9.330 1.141 1.00 0.00 ATOM 55 CB THR A 13 7.659 8.548 0.976 1.00 0.00 ATOM 56 CG2 THR A 13 8.791 9.487 0.587 1.00 0.00 ATOM 57 OG1 THR A 13 7.994 7.904 2.211 1.00 0.00 ATOM 58 O THR A 13 4.599 9.709 -0.545 1.00 0.00 ATOM 59 C THR A 13 5.804 9.797 -0.239 1.00 0.00 ATOM 60 N GLY A 14 6.600 10.930 -1.290 1.00 0.00 ATOM 61 CA GLY A 14 6.500 10.250 -2.570 1.00 0.00 ATOM 62 O GLY A 14 7.160 8.030 -3.210 1.00 0.00 ATOM 63 C GLY A 14 7.500 9.090 -2.700 1.00 0.00 ATOM 64 N SER A 15 8.730 9.280 -2.230 1.00 0.00 ATOM 65 CA SER A 15 9.760 8.250 -2.280 1.00 0.00 ATOM 66 CB SER A 15 11.072 8.776 -1.694 1.00 0.00 ATOM 67 OG SER A 15 11.609 9.814 -2.496 1.00 0.00 ATOM 68 O SER A 15 9.460 5.880 -1.910 1.00 0.00 ATOM 69 C SER A 15 9.320 7.020 -1.470 1.00 0.00 ATOM 70 N VAL A 16 8.740 7.240 -0.290 1.00 0.00 ATOM 71 CA VAL A 16 8.230 6.150 0.530 1.00 0.00 ATOM 72 CB VAL A 16 7.793 6.647 1.921 1.00 0.00 ATOM 73 CG1 VAL A 16 7.092 5.535 2.687 1.00 0.00 ATOM 74 CG2 VAL A 16 8.999 7.101 2.728 1.00 0.00 ATOM 75 O VAL A 16 6.900 4.280 -0.140 1.00 0.00 ATOM 76 C VAL A 16 7.020 5.500 -0.140 1.00 0.00 ATOM 77 N GLY A 17 6.140 6.310 -0.740 1.00 0.00 ATOM 78 CA GLY A 17 5.060 5.780 -1.560 1.00 0.00 ATOM 79 O GLY A 17 5.120 3.750 -2.840 1.00 0.00 ATOM 80 C GLY A 17 5.620 4.860 -2.650 1.00 0.00 ATOM 81 N GLU A 18 6.670 5.300 -3.340 1.00 0.00 ATOM 82 CA GLU A 18 7.340 4.530 -4.380 1.00 0.00 ATOM 83 CB GLU A 18 8.502 5.329 -4.974 1.00 0.00 ATOM 84 CG GLU A 18 8.070 6.511 -5.827 1.00 0.00 ATOM 85 CD GLU A 18 9.242 7.350 -6.296 1.00 0.00 ATOM 86 OE1 GLU A 18 10.386 7.050 -5.894 1.00 0.00 ATOM 87 OE2 GLU A 18 9.017 8.307 -7.066 1.00 0.00 ATOM 88 O GLU A 18 7.760 2.160 -4.420 1.00 0.00 ATOM 89 C GLU A 18 7.900 3.220 -3.820 1.00 0.00 ATOM 90 N ALA A 19 8.540 3.270 -2.640 1.00 0.00 ATOM 91 CA ALA A 19 8.980 2.070 -1.950 1.00 0.00 ATOM 92 CB ALA A 19 9.553 2.423 -0.586 1.00 0.00 ATOM 93 O ALA A 19 7.860 -0.050 -2.110 1.00 0.00 ATOM 94 C ALA A 19 7.790 1.120 -1.760 1.00 0.00 ATOM 95 N LEU A 20 6.690 1.640 -1.210 1.00 0.00 ATOM 96 CA LEU A 20 5.470 0.880 -0.990 1.00 0.00 ATOM 97 CB LEU A 20 4.364 1.787 -0.448 1.00 0.00 ATOM 98 CG LEU A 20 4.530 2.272 0.994 1.00 0.00 ATOM 99 CD1 LEU A 20 3.484 3.324 1.332 1.00 0.00 ATOM 100 CD2 LEU A 20 4.375 1.116 1.970 1.00 0.00 ATOM 101 O LEU A 20 4.800 -0.980 -2.310 1.00 0.00 ATOM 102 C LEU A 20 4.940 0.230 -2.280 1.00 0.00 ATOM 103 N VAL A 21 4.610 1.000 -3.320 1.00 0.00 ATOM 104 CA VAL A 21 3.970 0.420 -4.500 1.00 0.00 ATOM 105 CB VAL A 21 3.744 1.477 -5.597 1.00 0.00 ATOM 106 CG1 VAL A 21 3.264 0.819 -6.881 1.00 0.00 ATOM 107 CG2 VAL A 21 2.696 2.488 -5.154 1.00 0.00 ATOM 108 O VAL A 21 4.340 -1.740 -5.490 1.00 0.00 ATOM 109 C VAL A 21 4.840 -0.690 -5.090 1.00 0.00 ATOM 110 N GLY A 22 6.160 -0.490 -5.080 1.00 0.00 ATOM 111 CA GLY A 22 7.110 -1.510 -5.530 1.00 0.00 ATOM 112 O GLY A 22 7.000 -3.870 -5.100 1.00 0.00 ATOM 113 C GLY A 22 7.070 -2.740 -4.610 1.00 0.00 ATOM 114 N LEU A 23 7.080 -2.530 -3.290 1.00 0.00 ATOM 115 CA LEU A 23 6.890 -3.620 -2.330 1.00 0.00 ATOM 116 CB LEU A 23 6.766 -3.067 -0.909 1.00 0.00 ATOM 117 CG LEU A 23 8.038 -2.478 -0.297 1.00 0.00 ATOM 118 CD1 LEU A 23 7.737 -1.819 1.040 1.00 0.00 ATOM 119 CD2 LEU A 23 9.077 -3.565 -0.067 1.00 0.00 ATOM 120 O LEU A 23 5.620 -5.630 -2.570 1.00 0.00 ATOM 121 C LEU A 23 5.620 -4.410 -2.650 1.00 0.00 ATOM 122 N LEU A 24 4.530 -3.720 -3.000 1.00 0.00 ATOM 123 CA LEU A 24 3.310 -4.390 -3.450 1.00 0.00 ATOM 124 CB LEU A 24 2.209 -3.366 -3.732 1.00 0.00 ATOM 125 CG LEU A 24 0.874 -3.925 -4.229 1.00 0.00 ATOM 126 CD1 LEU A 24 0.258 -4.848 -3.189 1.00 0.00 ATOM 127 CD2 LEU A 24 -0.110 -2.799 -4.507 1.00 0.00 ATOM 128 O LEU A 24 3.350 -6.390 -4.750 1.00 0.00 ATOM 129 C LEU A 24 3.570 -5.180 -4.730 1.00 0.00 ATOM 130 N ASP A 25 4.090 -4.550 -5.780 1.00 0.00 ATOM 131 CA ASP A 25 4.450 -5.220 -7.030 1.00 0.00 ATOM 132 CB ASP A 25 5.262 -4.283 -7.926 1.00 0.00 ATOM 133 CG ASP A 25 4.417 -3.182 -8.536 1.00 0.00 ATOM 134 OD1 ASP A 25 3.174 -3.272 -8.453 1.00 0.00 ATOM 135 OD2 ASP A 25 4.997 -2.230 -9.099 1.00 0.00 ATOM 136 O ASP A 25 5.100 -7.460 -7.560 1.00 0.00 ATOM 137 C ASP A 25 5.300 -6.490 -6.830 1.00 0.00 ATOM 138 N GLU A 26 6.220 -6.510 -5.870 1.00 0.00 ATOM 139 CA GLU A 26 6.980 -7.720 -5.510 1.00 0.00 ATOM 140 CB GLU A 26 7.846 -7.461 -4.275 1.00 0.00 ATOM 141 CG GLU A 26 8.985 -6.482 -4.510 1.00 0.00 ATOM 142 CD GLU A 26 9.957 -6.963 -5.569 1.00 0.00 ATOM 143 OE1 GLU A 26 10.444 -8.108 -5.453 1.00 0.00 ATOM 144 OE2 GLU A 26 10.233 -6.195 -6.514 1.00 0.00 ATOM 145 O GLU A 26 6.430 -10.060 -5.460 1.00 0.00 ATOM 146 C GLU A 26 6.060 -8.910 -5.190 1.00 0.00 ATOM 147 N ARG A 27 7.289 -8.329 -4.435 1.00 0.00 ATOM 148 CA ARG A 27 8.291 -9.085 -3.696 1.00 0.00 ATOM 149 CB ARG A 27 9.437 -8.170 -3.258 1.00 0.00 ATOM 150 CG ARG A 27 10.571 -8.893 -2.548 1.00 0.00 ATOM 151 CD ARG A 27 11.744 -7.961 -2.292 1.00 0.00 ATOM 152 NE ARG A 27 12.807 -8.615 -1.532 1.00 0.00 ATOM 153 CZ ARG A 27 13.893 -7.996 -1.082 1.00 0.00 ATOM 154 NH1 ARG A 27 14.807 -8.672 -0.399 1.00 0.00 ATOM 155 NH2 ARG A 27 14.062 -6.701 -1.315 1.00 0.00 ATOM 156 O ARG A 27 8.118 -10.745 -1.983 1.00 0.00 ATOM 157 C ARG A 27 7.678 -9.714 -2.455 1.00 0.00 ATOM 158 N ASP A 28 6.672 -9.059 -1.922 1.00 0.00 ATOM 159 CA ASP A 28 6.003 -9.570 -0.765 1.00 0.00 ATOM 160 CB ASP A 28 5.296 -8.441 -0.013 1.00 0.00 ATOM 161 CG ASP A 28 6.263 -7.409 0.534 1.00 0.00 ATOM 162 OD1 ASP A 28 7.287 -7.810 1.125 1.00 0.00 ATOM 163 OD2 ASP A 28 5.996 -6.200 0.371 1.00 0.00 ATOM 164 O ASP A 28 4.638 -10.669 -2.337 1.00 0.00 ATOM 165 C ASP A 28 4.981 -10.593 -1.194 1.00 0.00 ATOM 166 N PHE A 29 4.534 -11.439 -0.282 1.00 0.00 ATOM 167 CA PHE A 29 3.616 -12.516 -0.666 1.00 0.00 ATOM 168 CB PHE A 29 3.826 -13.742 0.224 1.00 0.00 ATOM 169 CG PHE A 29 5.165 -14.400 0.043 1.00 0.00 ATOM 170 CD1 PHE A 29 6.229 -14.075 0.867 1.00 0.00 ATOM 171 CD2 PHE A 29 5.359 -15.344 -0.950 1.00 0.00 ATOM 172 CE1 PHE A 29 7.460 -14.681 0.700 1.00 0.00 ATOM 173 CE2 PHE A 29 6.591 -15.949 -1.116 1.00 0.00 ATOM 174 CZ PHE A 29 7.638 -15.621 -0.296 1.00 0.00 ATOM 175 O PHE A 29 1.589 -12.171 0.520 1.00 0.00 ATOM 176 C PHE A 29 2.205 -12.011 -0.506 1.00 0.00 ATOM 177 N PRO A 30 1.712 -11.376 -1.547 1.00 0.00 ATOM 178 CA PRO A 30 0.389 -10.811 -1.551 1.00 0.00 ATOM 179 CB PRO A 30 0.598 -9.383 -2.059 1.00 0.00 ATOM 180 CG PRO A 30 1.658 -9.508 -3.101 1.00 0.00 ATOM 181 CD PRO A 30 2.633 -10.529 -2.583 1.00 0.00 ATOM 182 O PRO A 30 0.177 -12.422 -3.226 1.00 0.00 ATOM 183 C PRO A 30 -0.408 -11.669 -2.478 1.00 0.00 ATOM 184 N LEU A 31 -1.723 -11.526 -2.481 1.00 0.00 ATOM 185 CA LEU A 31 -2.514 -12.445 -3.247 1.00 0.00 ATOM 186 CB LEU A 31 -4.001 -12.105 -3.123 1.00 0.00 ATOM 187 CG LEU A 31 -4.606 -12.215 -1.722 1.00 0.00 ATOM 188 CD1 LEU A 31 -6.060 -11.768 -1.729 1.00 0.00 ATOM 189 CD2 LEU A 31 -4.552 -13.651 -1.224 1.00 0.00 ATOM 190 O LEU A 31 -2.178 -11.336 -5.274 1.00 0.00 ATOM 191 C LEU A 31 -2.136 -12.381 -4.669 1.00 0.00 ATOM 192 N HIS A 32 -1.712 -13.510 -5.204 1.00 0.00 ATOM 193 CA HIS A 32 -1.079 -13.614 -6.526 1.00 0.00 ATOM 194 CB HIS A 32 -2.127 -13.485 -7.633 1.00 0.00 ATOM 195 CG HIS A 32 -2.788 -12.142 -7.686 1.00 0.00 ATOM 196 CD2 HIS A 32 -2.640 -10.943 -8.497 1.00 0.00 ATOM 197 ND1 HIS A 32 -3.806 -11.780 -6.831 1.00 0.00 ATOM 198 CE1 HIS A 32 -4.193 -10.525 -7.118 1.00 0.00 ATOM 199 NE2 HIS A 32 -3.498 -10.016 -8.117 1.00 0.00 ATOM 200 O HIS A 32 0.137 -12.299 -8.004 1.00 0.00 ATOM 201 C HIS A 32 -0.060 -12.608 -6.833 1.00 0.00 ATOM 202 N ARG A 33 0.605 -12.087 -5.805 1.00 0.00 ATOM 203 CA ARG A 33 1.711 -11.198 -6.069 1.00 0.00 ATOM 204 CB ARG A 33 2.687 -11.837 -7.059 1.00 0.00 ATOM 205 CG ARG A 33 3.372 -13.089 -6.535 1.00 0.00 ATOM 206 CD ARG A 33 4.378 -13.629 -7.539 1.00 0.00 ATOM 207 NE ARG A 33 4.941 -14.909 -7.115 1.00 0.00 ATOM 208 CZ ARG A 33 5.861 -15.582 -7.797 1.00 0.00 ATOM 209 NH1 ARG A 33 6.315 -16.739 -7.333 1.00 0.00 ATOM 210 NH2 ARG A 33 6.326 -15.098 -8.940 1.00 0.00 ATOM 211 O ARG A 33 2.047 -9.214 -7.388 1.00 0.00 ATOM 212 C ARG A 33 1.282 -9.871 -6.663 1.00 0.00 ATOM 213 N LEU A 34 -0.660 -9.590 -6.460 1.00 0.00 ATOM 214 CA LEU A 34 -1.170 -8.330 -6.970 1.00 0.00 ATOM 215 CB LEU A 34 -0.757 -7.175 -6.055 1.00 0.00 ATOM 216 CG LEU A 34 -1.370 -5.809 -6.370 1.00 0.00 ATOM 217 CD1 LEU A 34 -2.871 -5.823 -6.124 1.00 0.00 ATOM 218 CD2 LEU A 34 -0.755 -4.729 -5.493 1.00 0.00 ATOM 219 O LEU A 34 0.470 -8.580 -8.700 1.00 0.00 ATOM 220 C LEU A 34 -0.600 -8.090 -8.370 1.00 0.00 ATOM 221 N HIS A 35 -1.340 -7.340 -9.180 1.00 0.00 ATOM 222 CA HIS A 35 -0.970 -6.960 -10.540 1.00 0.00 ATOM 223 CB HIS A 35 -2.144 -7.181 -11.496 1.00 0.00 ATOM 224 CG HIS A 35 -1.815 -6.906 -12.930 1.00 0.00 ATOM 225 CD2 HIS A 35 -2.119 -5.847 -13.881 1.00 0.00 ATOM 226 ND1 HIS A 35 -1.045 -7.757 -13.694 1.00 0.00 ATOM 227 CE1 HIS A 35 -0.924 -7.246 -14.932 1.00 0.00 ATOM 228 NE2 HIS A 35 -1.566 -6.100 -15.051 1.00 0.00 ATOM 229 O HIS A 35 0.520 -5.150 -10.910 1.00 0.00 ATOM 230 C HIS A 35 -0.590 -5.490 -10.520 1.00 0.00 ATOM 231 N LEU A 36 -1.500 -4.620 -10.060 1.00 0.00 ATOM 232 CA LEU A 36 -1.180 -3.200 -9.940 1.00 0.00 ATOM 233 CB LEU A 36 -2.037 -2.374 -10.902 1.00 0.00 ATOM 234 CG LEU A 36 -1.870 -2.681 -12.392 1.00 0.00 ATOM 235 CD1 LEU A 36 -2.897 -1.919 -13.215 1.00 0.00 ATOM 236 CD2 LEU A 36 -0.484 -2.279 -12.871 1.00 0.00 ATOM 237 O LEU A 36 -2.160 -3.260 -7.750 1.00 0.00 ATOM 238 C LEU A 36 -1.430 -2.670 -8.530 1.00 0.00 ATOM 239 N LEU A 37 -0.830 -1.520 -8.220 1.00 0.00 ATOM 240 CA LEU A 37 -1.070 -0.800 -6.980 1.00 0.00 ATOM 241 CB LEU A 37 -0.115 -1.283 -5.886 1.00 0.00 ATOM 242 CG LEU A 37 -0.301 -0.661 -4.501 1.00 0.00 ATOM 243 CD1 LEU A 37 0.293 -1.558 -3.425 1.00 0.00 ATOM 244 CD2 LEU A 37 0.386 0.694 -4.423 1.00 0.00 ATOM 245 O LEU A 37 0.070 1.000 -8.000 1.00 0.00 ATOM 246 C LEU A 37 -0.840 0.670 -7.250 1.00 0.00 ATOM 247 N ALA 38 -1.670 1.540 -6.690 1.00 0.00 ATOM 248 CA ALA 38 -1.560 2.990 -6.880 1.00 0.00 ATOM 249 C SER 65 -3.579 12.276 3.359 1.00 0.00 ATOM 250 N SER A 66 -3.211 12.613 2.114 1.00 0.00 ATOM 251 CA SER A 66 -2.263 11.773 1.357 1.00 0.00 ATOM 252 CB SER A 66 -0.870 11.836 1.987 1.00 0.00 ATOM 253 OG SER A 66 -0.355 13.156 1.955 1.00 0.00 ATOM 254 O SER A 66 -1.815 9.410 1.258 1.00 0.00 ATOM 255 C SER A 66 -2.660 10.309 1.310 1.00 0.00 ATOM 256 N VAL A 67 -4.220 10.220 2.310 1.00 0.00 ATOM 257 CA VAL A 67 -4.990 9.620 1.240 1.00 0.00 ATOM 258 CB VAL A 67 -4.317 9.834 -0.128 1.00 0.00 ATOM 259 CG1 VAL A 67 -5.091 9.113 -1.221 1.00 0.00 ATOM 260 CG2 VAL A 67 -4.268 11.315 -0.472 1.00 0.00 ATOM 261 O VAL A 67 -5.700 7.660 2.450 1.00 0.00 ATOM 262 C VAL A 67 -5.150 8.100 1.440 1.00 0.00 ATOM 263 N GLY A 68 -4.760 7.300 0.450 1.00 0.00 ATOM 264 CA GLY A 68 -5.240 5.940 0.310 1.00 0.00 ATOM 265 O GLY A 68 -3.370 5.710 -1.180 1.00 0.00 ATOM 266 C GLY A 68 -4.260 5.140 -0.540 1.00 0.00 ATOM 267 N LEU A 69 -4.430 3.810 -0.500 1.00 0.00 ATOM 268 CA LEU A 69 -3.560 2.820 -1.140 1.00 0.00 ATOM 269 CB LEU A 69 -2.781 2.030 -0.086 1.00 0.00 ATOM 270 CG LEU A 69 -1.820 2.835 0.791 1.00 0.00 ATOM 271 CD1 LEU A 69 -1.262 1.969 1.910 1.00 0.00 ATOM 272 CD2 LEU A 69 -0.653 3.359 -0.032 1.00 0.00 ATOM 273 O LEU A 69 -5.190 1.070 -1.390 1.00 0.00 ATOM 274 C LEU A 69 -4.450 1.870 -1.950 1.00 0.00 ATOM 275 N ALA A 70 -4.430 2.030 -3.280 1.00 0.00 ATOM 276 CA ALA A 70 -5.130 1.140 -4.200 1.00 0.00 ATOM 277 CB ALA A 70 -5.448 1.864 -5.499 1.00 0.00 ATOM 278 O ALA A 70 -3.030 0.100 -4.660 1.00 0.00 ATOM 279 C ALA A 70 -4.240 -0.050 -4.490 1.00 0.00 ATOM 280 N PHE A 71 -4.860 -1.220 -4.540 1.00 0.00 ATOM 281 CA PHE A 71 -4.260 -2.510 -4.780 1.00 0.00 ATOM 282 CB PHE A 71 -4.192 -3.319 -3.483 1.00 0.00 ATOM 283 CG PHE A 71 -3.343 -2.686 -2.418 1.00 0.00 ATOM 284 CD1 PHE A 71 -3.906 -1.850 -1.470 1.00 0.00 ATOM 285 CD2 PHE A 71 -1.981 -2.927 -2.364 1.00 0.00 ATOM 286 CE1 PHE A 71 -3.125 -1.267 -0.490 1.00 0.00 ATOM 287 CE2 PHE A 71 -1.200 -2.345 -1.383 1.00 0.00 ATOM 288 CZ PHE A 71 -1.767 -1.518 -0.449 1.00 0.00 ATOM 289 O PHE A 71 -6.400 -3.020 -5.740 1.00 0.00 ATOM 290 C PHE A 71 -5.180 -3.180 -5.810 1.00 0.00 ATOM 291 N PHE A 72 -4.630 -3.870 -6.800 1.00 0.00 ATOM 292 CA PHE A 72 -5.390 -4.480 -7.870 1.00 0.00 ATOM 293 CB PHE A 72 -5.515 -3.519 -9.054 1.00 0.00 ATOM 294 CG PHE A 72 -6.410 -4.021 -10.150 1.00 0.00 ATOM 295 CD1 PHE A 72 -7.307 -5.048 -9.915 1.00 0.00 ATOM 296 CD2 PHE A 72 -6.355 -3.467 -11.417 1.00 0.00 ATOM 297 CE1 PHE A 72 -8.131 -5.510 -10.924 1.00 0.00 ATOM 298 CE2 PHE A 72 -7.179 -3.929 -12.426 1.00 0.00 ATOM 299 CZ PHE A 72 -8.064 -4.946 -12.184 1.00 0.00 ATOM 300 O PHE A 72 -3.470 -5.710 -8.500 1.00 0.00 ATOM 301 C PHE A 72 -4.670 -5.720 -8.300 1.00 0.00 ATOM 302 N ALA A 73 -5.410 -6.810 -8.450 1.00 0.00 ATOM 303 CA ALA A 73 -4.810 -8.020 -8.950 1.00 0.00 ATOM 304 CB ALA A 73 -3.358 -8.113 -8.508 1.00 0.00 ATOM 305 O ALA A 73 -6.640 -9.550 -8.920 1.00 0.00 ATOM 306 C ALA A 73 -5.610 -9.190 -8.380 1.00 0.00 ATOM 307 N ALA A 74 -5.612 -9.910 -9.643 1.00 0.00 ATOM 308 CA ALA A 74 -6.652 -10.874 -9.954 1.00 0.00 ATOM 309 CB ALA A 74 -6.976 -10.843 -11.440 1.00 0.00 ATOM 310 O ALA A 74 -7.062 -13.077 -9.082 1.00 0.00 ATOM 311 C ALA A 74 -6.253 -12.296 -9.607 1.00 0.00 ATOM 312 N ALA A 75 -5.018 -12.659 -9.946 1.00 0.00 ATOM 313 CA ALA A 75 -4.547 -14.022 -9.723 1.00 0.00 ATOM 314 CB ALA A 75 -3.349 -14.321 -10.611 1.00 0.00 ATOM 315 O ALA A 75 -4.638 -15.216 -7.619 1.00 0.00 ATOM 316 C ALA A 75 -4.106 -14.305 -8.286 1.00 0.00 ATOM 317 N ALA A 76 -3.138 -13.538 -7.812 1.00 0.00 ATOM 318 CA ALA A 76 -2.698 -13.700 -6.425 1.00 0.00 ATOM 319 CB ALA A 76 -1.384 -12.969 -6.197 1.00 0.00 ATOM 320 O ALA A 76 -3.926 -13.623 -4.349 1.00 0.00 ATOM 321 C ALA A 76 -3.779 -13.113 -5.455 1.00 0.00 ATOM 322 N GLU A 77 -4.486 -12.064 -5.877 1.00 0.00 ATOM 323 CA GLU A 77 -5.453 -11.338 -4.994 1.00 0.00 ATOM 324 CB GLU A 77 -6.558 -12.283 -4.519 1.00 0.00 ATOM 325 CG GLU A 77 -7.407 -12.860 -5.640 1.00 0.00 ATOM 326 CD GLU A 77 -8.489 -13.792 -5.132 1.00 0.00 ATOM 327 OE1 GLU A 77 -8.615 -13.939 -3.898 1.00 0.00 ATOM 328 OE2 GLU A 77 -9.210 -14.376 -5.967 1.00 0.00 ATOM 329 O GLU A 77 -5.072 -11.072 -2.629 1.00 0.00 ATOM 330 C GLU A 77 -4.708 -10.791 -3.783 1.00 0.00 ATOM 331 N VAL A 78 -3.644 -10.059 -4.055 1.00 0.00 ATOM 332 CA VAL A 78 -2.819 -9.468 -2.996 1.00 0.00 ATOM 333 CB VAL A 78 -1.754 -8.517 -3.574 1.00 0.00 ATOM 334 CG1 VAL A 78 -2.413 -7.299 -4.203 1.00 0.00 ATOM 335 CG2 VAL A 78 -0.812 -8.043 -2.478 1.00 0.00 ATOM 336 O VAL A 78 -4.633 -7.895 -2.470 1.00 0.00 ATOM 337 C VAL A 78 -3.735 -8.663 -2.031 1.00 0.00 ATOM 338 N SER A 79 -3.520 -8.849 -0.739 1.00 0.00 ATOM 339 CA SER A 79 -4.339 -8.167 0.280 1.00 0.00 ATOM 340 CB SER A 79 -4.654 -9.116 1.438 1.00 0.00 ATOM 341 OG SER A 79 -5.390 -10.241 0.989 1.00 0.00 ATOM 342 O SER A 79 -2.443 -6.744 0.889 1.00 0.00 ATOM 343 C SER A 79 -3.680 -6.934 0.902 1.00 0.00 ATOM 344 N ARG A 80 -4.740 -5.870 1.620 1.00 0.00 ATOM 345 CA ARG A 80 -3.820 -5.020 2.370 1.00 0.00 ATOM 346 CB ARG A 80 -4.591 -4.119 3.338 1.00 0.00 ATOM 347 CG ARG A 80 -3.715 -3.150 4.114 1.00 0.00 ATOM 348 CD ARG A 80 -4.530 -2.354 5.120 1.00 0.00 ATOM 349 NE ARG A 80 -5.076 -3.203 6.176 1.00 0.00 ATOM 350 CZ ARG A 80 -4.373 -3.657 7.209 1.00 0.00 ATOM 351 NH1 ARG A 80 -4.954 -4.424 8.121 1.00 0.00 ATOM 352 NH2 ARG A 80 -3.090 -3.344 7.326 1.00 0.00 ATOM 353 O ARG A 80 -1.670 -5.610 3.060 1.00 0.00 ATOM 354 C ARG A 80 -2.840 -5.870 3.180 1.00 0.00 ATOM 355 N ALA A 81 -3.290 -6.890 3.910 1.00 0.00 ATOM 356 CA ALA A 81 -2.470 -7.780 4.750 1.00 0.00 ATOM 357 CB ALA A 81 -3.082 -9.171 4.803 1.00 0.00 ATOM 358 O ALA A 81 -0.060 -7.770 5.000 1.00 0.00 ATOM 359 C ALA A 81 -1.030 -7.950 4.250 1.00 0.00 ATOM 360 N HIS A 82 -0.870 -8.290 2.980 1.00 0.00 ATOM 361 CA HIS A 82 0.440 -8.490 2.390 1.00 0.00 ATOM 362 CB HIS A 82 0.308 -8.993 0.951 1.00 0.00 ATOM 363 CG HIS A 82 -0.142 -10.417 0.847 1.00 0.00 ATOM 364 CD2 HIS A 82 -1.310 -11.100 0.312 1.00 0.00 ATOM 365 ND1 HIS A 82 0.608 -11.471 1.322 1.00 0.00 ATOM 366 CE1 HIS A 82 -0.052 -12.619 1.087 1.00 0.00 ATOM 367 NE2 HIS A 82 -1.204 -12.404 0.481 1.00 0.00 ATOM 368 O HIS A 82 2.400 -7.100 2.790 1.00 0.00 ATOM 369 C HIS A 82 1.240 -7.170 2.370 1.00 0.00 ATOM 370 N ALA A 83 0.590 -6.110 1.900 1.00 0.00 ATOM 371 CA ALA A 83 1.070 -4.740 1.890 1.00 0.00 ATOM 372 CB ALA A 83 0.047 -3.825 1.235 1.00 0.00 ATOM 373 O ALA A 83 2.230 -3.440 3.550 1.00 0.00 ATOM 374 C ALA A 83 1.320 -4.240 3.320 1.00 0.00 ATOM 375 N GLU A 84 0.520 -4.710 4.270 1.00 0.00 ATOM 376 CA GLU A 84 0.590 -4.400 5.690 1.00 0.00 ATOM 377 CB GLU A 84 -0.518 -5.129 6.453 1.00 0.00 ATOM 378 CG GLU A 84 -0.549 -4.826 7.942 1.00 0.00 ATOM 379 CD GLU A 84 -1.680 -5.538 8.658 1.00 0.00 ATOM 380 OE1 GLU A 84 -2.448 -6.259 7.986 1.00 0.00 ATOM 381 OE2 GLU A 84 -1.798 -5.376 9.891 1.00 0.00 ATOM 382 O GLU A 84 2.730 -4.070 6.740 1.00 0.00 ATOM 383 C GLU A 84 1.960 -4.860 6.190 1.00 0.00 ATOM 384 N ARG A 85 2.270 -6.130 5.920 1.00 0.00 ATOM 385 CA ARG A 85 3.560 -6.730 6.240 1.00 0.00 ATOM 386 CB ARG A 85 3.668 -8.127 5.626 1.00 0.00 ATOM 387 CG ARG A 85 4.967 -8.848 5.948 1.00 0.00 ATOM 388 CD ARG A 85 5.007 -10.227 5.310 1.00 0.00 ATOM 389 NE ARG A 85 6.238 -10.944 5.631 1.00 0.00 ATOM 390 CZ ARG A 85 6.603 -12.091 5.069 1.00 0.00 ATOM 391 NH1 ARG A 85 7.741 -12.671 5.424 1.00 0.00 ATOM 392 NH2 ARG A 85 5.828 -12.657 4.153 1.00 0.00 ATOM 393 O ARG A 85 5.540 -5.400 6.450 1.00 0.00 ATOM 394 C ARG A 85 4.680 -5.850 5.680 1.00 0.00 ATOM 395 N ALA A 86 4.670 -5.580 4.370 1.00 0.00 ATOM 396 CA ALA A 86 5.620 -4.680 3.740 1.00 0.00 ATOM 397 CB ALA A 86 5.184 -4.359 2.319 1.00 0.00 ATOM 398 O ALA A 86 6.830 -2.950 4.880 1.00 0.00 ATOM 399 C ALA A 86 5.730 -3.370 4.510 1.00 0.00 ATOM 400 N ARG A 87 4.600 -2.730 4.800 1.00 0.00 ATOM 401 CA ARG A 87 4.530 -1.450 5.460 1.00 0.00 ATOM 402 CB ARG A 87 3.073 -1.025 5.651 1.00 0.00 ATOM 403 CG ARG A 87 2.349 -0.691 4.357 1.00 0.00 ATOM 404 CD ARG A 87 0.993 -0.061 4.630 1.00 0.00 ATOM 405 NE ARG A 87 0.085 -0.986 5.304 1.00 0.00 ATOM 406 CZ ARG A 87 -0.677 -1.876 4.676 1.00 0.00 ATOM 407 NH1 ARG A 87 -1.472 -2.677 5.372 1.00 0.00 ATOM 408 NH2 ARG A 87 -0.641 -1.963 3.353 1.00 0.00 ATOM 409 O ARG A 87 5.500 -0.380 7.350 1.00 0.00 ATOM 410 C ARG A 87 5.180 -1.450 6.840 1.00 0.00 ATOM 411 N ALA A 88 3.085 -1.517 6.230 1.00 0.00 ATOM 412 CA ALA A 88 1.889 -0.806 6.699 1.00 0.00 ATOM 413 CB ALA A 88 0.631 -1.559 6.293 1.00 0.00 ATOM 414 O ALA A 88 1.200 0.357 8.644 1.00 0.00 ATOM 415 C ALA A 88 1.796 -0.617 8.201 1.00 0.00 ATOM 416 N ALA A 89 2.364 -1.523 8.998 1.00 0.00 ATOM 417 CA ALA A 89 2.233 -1.391 10.457 1.00 0.00 ATOM 418 CB ALA A 89 2.991 -2.507 11.160 1.00 0.00 ATOM 419 O ALA A 89 3.876 0.332 10.554 1.00 0.00 ATOM 420 C ALA A 89 2.787 -0.071 10.943 1.00 0.00 ATOM 421 N GLY A 90 2.042 0.612 11.804 1.00 0.00 ATOM 422 CA GLY A 90 2.509 1.899 12.282 1.00 0.00 ATOM 423 O GLY A 90 1.365 3.953 11.901 1.00 0.00 ATOM 424 C GLY A 90 1.899 2.976 11.395 1.00 0.00 ATOM 425 N CYS A 91 2.049 2.854 10.076 1.00 0.00 ATOM 426 CA CYS A 91 1.401 3.819 9.176 1.00 0.00 ATOM 427 CB CYS A 91 1.783 3.536 7.722 1.00 0.00 ATOM 428 SG CYS A 91 3.511 3.887 7.322 1.00 0.00 ATOM 429 O CYS A 91 -0.881 4.600 9.315 1.00 0.00 ATOM 430 C CYS A 91 -0.104 3.647 9.381 1.00 0.00 ATOM 431 N SER A 92 -0.520 2.430 9.350 1.00 0.00 ATOM 432 CA SER A 92 -1.830 1.950 9.760 1.00 0.00 ATOM 433 CB SER A 92 -2.321 2.716 10.990 1.00 0.00 ATOM 434 OG SER A 92 -3.622 2.300 11.365 1.00 0.00 ATOM 435 O SER A 92 -2.970 3.340 8.170 1.00 0.00 ATOM 436 C SER A 92 -2.750 2.190 8.570 1.00 0.00 ATOM 437 N VAL A 93 -3.220 1.100 7.960 1.00 0.00 ATOM 438 CA VAL A 93 -4.110 1.120 6.810 1.00 0.00 ATOM 439 CB VAL A 93 -3.542 0.293 5.642 1.00 0.00 ATOM 440 CG1 VAL A 93 -4.518 0.276 4.476 1.00 0.00 ATOM 441 CG2 VAL A 93 -2.227 0.886 5.159 1.00 0.00 ATOM 442 O VAL A 93 -5.430 -0.370 8.120 1.00 0.00 ATOM 443 C VAL A 93 -5.440 0.520 7.280 1.00 0.00 ATOM 444 N ILE 94 -6.560 1.040 6.790 1.00 0.00 ATOM 445 CA ILE 94 -7.890 0.680 7.240 1.00 0.00 ENDMDL