USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 757 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 70 MET CE :methyl 169:sc= -1.69 (180deg=-2.12!) USER MOD Set 1.2: A 73 ASN : amide:sc= -3.93! C(o=-5.6!,f=-15!) USER MOD Set 2.1: A 56 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.58) USER MOD Set 2.2: A 61 CYS SG : rot -150:sc= 0 USER MOD Set 3.1: A 24 THR OG1 : rot 177:sc=-0.00787 USER MOD Set 3.2: A 64 GLN : amide:sc= -2.07 K(o=-2.8,f=-6.3!) USER MOD Set 3.3: A 66 HIS :FLIP no HD1:sc= -0.688 F(o=-4,f=-2.8) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.0605 X(o=-0.061,f=-0.049) USER MOD Single : A 20 MET CE :methyl -174:sc= -2.46! (180deg=-2.67!) USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0452 USER MOD Single : A 28 GLN : amide:sc= 0.197 X(o=0.2,f=0) USER MOD Single : A 29 CYS SG : rot -107:sc= -0.499 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -168:sc= 0.706 (180deg=0.621) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 30:sc= -0.398 USER MOD Single : A 77 SER OG : rot -53:sc=-0.000319 USER MOD Single : A 78 CYS SG : rot 104:sc= 1.69 USER MOD Single : A 80 CYS SG : rot -87:sc= 1.2 USER MOD Single : A 82 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.4!) USER MOD Single : A 85 THR OG1 : rot 100:sc= 0.00921 USER MOD Single : A 86 SER OG : rot -17:sc= 0.475 USER MOD Single : A 88 THR OG1 : rot 180:sc=-0.00596 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.0147 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.303 23.310 -17.449 1.00 0.00 N ATOM 2 CA GLY A 1 3.697 23.651 -16.176 1.00 0.00 C ATOM 3 C GLY A 1 4.722 23.822 -15.073 1.00 0.00 C ATOM 4 O GLY A 1 4.699 24.813 -14.343 1.00 0.00 O ATOM 0 H1 GLY A 1 3.561 23.204 -18.170 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.958 24.065 -17.735 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.825 22.416 -17.356 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.127 24.574 -16.284 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.990 22.871 -15.893 1.00 0.00 H new ATOM 8 N SER A 2 5.623 22.852 -14.949 1.00 0.00 N ATOM 9 CA SER A 2 6.658 22.897 -13.923 1.00 0.00 C ATOM 10 C SER A 2 8.037 22.662 -14.531 1.00 0.00 C ATOM 11 O SER A 2 8.169 21.999 -15.560 1.00 0.00 O ATOM 12 CB SER A 2 6.380 21.850 -12.842 1.00 0.00 C ATOM 13 OG SER A 2 6.472 20.538 -13.368 1.00 0.00 O ATOM 0 H SER A 2 5.657 22.026 -15.546 1.00 0.00 H new ATOM 0 HA SER A 2 6.644 23.889 -13.471 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.092 21.968 -12.025 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.386 22.009 -12.424 1.00 0.00 H new ATOM 0 HG SER A 2 6.292 19.887 -12.658 1.00 0.00 H new ATOM 19 N SER A 3 9.063 23.211 -13.888 1.00 0.00 N ATOM 20 CA SER A 3 10.432 23.065 -14.366 1.00 0.00 C ATOM 21 C SER A 3 11.426 23.196 -13.217 1.00 0.00 C ATOM 22 O SER A 3 11.349 24.127 -12.417 1.00 0.00 O ATOM 23 CB SER A 3 10.734 24.113 -15.439 1.00 0.00 C ATOM 24 OG SER A 3 10.848 25.406 -14.870 1.00 0.00 O ATOM 0 H SER A 3 8.971 23.761 -13.034 1.00 0.00 H new ATOM 0 HA SER A 3 10.535 22.070 -14.800 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.660 23.855 -15.953 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.942 24.110 -16.188 1.00 0.00 H new ATOM 0 HG SER A 3 11.043 26.058 -15.575 1.00 0.00 H new ATOM 30 N GLY A 4 12.362 22.254 -13.141 1.00 0.00 N ATOM 31 CA GLY A 4 13.359 22.281 -12.087 1.00 0.00 C ATOM 32 C GLY A 4 13.347 21.020 -11.245 1.00 0.00 C ATOM 33 O GLY A 4 12.981 19.948 -11.726 1.00 0.00 O ATOM 0 H GLY A 4 12.447 21.473 -13.791 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.347 22.410 -12.529 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.182 23.144 -11.446 1.00 0.00 H new ATOM 37 N SER A 5 13.749 21.149 -9.985 1.00 0.00 N ATOM 38 CA SER A 5 13.788 20.009 -9.075 1.00 0.00 C ATOM 39 C SER A 5 12.451 19.837 -8.362 1.00 0.00 C ATOM 40 O SER A 5 12.180 20.496 -7.359 1.00 0.00 O ATOM 41 CB SER A 5 14.908 20.188 -8.048 1.00 0.00 C ATOM 42 OG SER A 5 15.197 18.967 -7.391 1.00 0.00 O ATOM 0 H SER A 5 14.052 22.030 -9.571 1.00 0.00 H new ATOM 0 HA SER A 5 13.984 19.112 -9.663 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.805 20.559 -8.544 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.616 20.939 -7.314 1.00 0.00 H new ATOM 0 HG SER A 5 15.917 19.108 -6.741 1.00 0.00 H new ATOM 48 N SER A 6 11.617 18.945 -8.889 1.00 0.00 N ATOM 49 CA SER A 6 10.306 18.688 -8.306 1.00 0.00 C ATOM 50 C SER A 6 10.330 17.424 -7.452 1.00 0.00 C ATOM 51 O SER A 6 11.344 16.732 -7.375 1.00 0.00 O ATOM 52 CB SER A 6 9.253 18.552 -9.408 1.00 0.00 C ATOM 53 OG SER A 6 8.963 19.809 -9.995 1.00 0.00 O ATOM 0 H SER A 6 11.826 18.389 -9.718 1.00 0.00 H new ATOM 0 HA SER A 6 10.047 19.533 -7.667 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.610 17.863 -10.174 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.341 18.122 -8.993 1.00 0.00 H new ATOM 0 HG SER A 6 8.289 19.694 -10.697 1.00 0.00 H new ATOM 59 N GLY A 7 9.203 17.130 -6.810 1.00 0.00 N ATOM 60 CA GLY A 7 9.115 15.950 -5.968 1.00 0.00 C ATOM 61 C GLY A 7 8.228 16.167 -4.758 1.00 0.00 C ATOM 62 O GLY A 7 7.732 17.270 -4.533 1.00 0.00 O ATOM 0 H GLY A 7 8.350 17.687 -6.858 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.727 15.117 -6.554 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.114 15.668 -5.636 1.00 0.00 H new ATOM 66 N ALA A 8 8.028 15.110 -3.977 1.00 0.00 N ATOM 67 CA ALA A 8 7.196 15.190 -2.783 1.00 0.00 C ATOM 68 C ALA A 8 7.807 14.395 -1.634 1.00 0.00 C ATOM 69 O ALA A 8 8.724 13.600 -1.836 1.00 0.00 O ATOM 70 CB ALA A 8 5.791 14.690 -3.085 1.00 0.00 C ATOM 0 H ALA A 8 8.431 14.189 -4.150 1.00 0.00 H new ATOM 0 HA ALA A 8 7.140 16.235 -2.478 1.00 0.00 H new ATOM 0 HB1 ALA A 8 5.180 14.755 -2.185 1.00 0.00 H new ATOM 0 HB2 ALA A 8 5.347 15.303 -3.870 1.00 0.00 H new ATOM 0 HB3 ALA A 8 5.837 13.653 -3.418 1.00 0.00 H new ATOM 76 N ARG A 9 7.292 14.616 -0.429 1.00 0.00 N ATOM 77 CA ARG A 9 7.788 13.921 0.753 1.00 0.00 C ATOM 78 C ARG A 9 6.652 13.212 1.484 1.00 0.00 C ATOM 79 O ARG A 9 5.552 13.749 1.612 1.00 0.00 O ATOM 80 CB ARG A 9 8.481 14.906 1.697 1.00 0.00 C ATOM 81 CG ARG A 9 7.522 15.854 2.398 1.00 0.00 C ATOM 82 CD ARG A 9 8.186 16.546 3.578 1.00 0.00 C ATOM 83 NE ARG A 9 9.219 17.485 3.151 1.00 0.00 N ATOM 84 CZ ARG A 9 9.954 18.202 3.994 1.00 0.00 C ATOM 85 NH1 ARG A 9 9.770 18.088 5.302 1.00 0.00 N ATOM 86 NH2 ARG A 9 10.876 19.035 3.528 1.00 0.00 N ATOM 0 H ARG A 9 6.532 15.271 -0.245 1.00 0.00 H new ATOM 0 HA ARG A 9 8.510 13.172 0.427 1.00 0.00 H new ATOM 0 HB2 ARG A 9 9.039 14.346 2.448 1.00 0.00 H new ATOM 0 HB3 ARG A 9 9.207 15.490 1.131 1.00 0.00 H new ATOM 0 HG2 ARG A 9 7.165 16.602 1.690 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.649 15.300 2.744 1.00 0.00 H new ATOM 0 HD2 ARG A 9 7.431 17.077 4.159 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.626 15.797 4.236 1.00 0.00 H new ATOM 0 HE ARG A 9 9.386 17.597 2.151 1.00 0.00 H new ATOM 0 HH11 ARG A 9 9.063 17.448 5.664 1.00 0.00 H new ATOM 0 HH12 ARG A 9 10.336 18.640 5.947 1.00 0.00 H new ATOM 0 HH21 ARG A 9 11.021 19.125 2.522 1.00 0.00 H new ATOM 0 HH22 ARG A 9 11.440 19.585 4.176 1.00 0.00 H new ATOM 100 N PHE A 10 6.927 12.003 1.962 1.00 0.00 N ATOM 101 CA PHE A 10 5.928 11.219 2.679 1.00 0.00 C ATOM 102 C PHE A 10 5.687 11.790 4.074 1.00 0.00 C ATOM 103 O PHE A 10 6.325 11.381 5.044 1.00 0.00 O ATOM 104 CB PHE A 10 6.372 9.759 2.784 1.00 0.00 C ATOM 105 CG PHE A 10 6.162 8.976 1.519 1.00 0.00 C ATOM 106 CD1 PHE A 10 4.884 8.666 1.085 1.00 0.00 C ATOM 107 CD2 PHE A 10 7.244 8.551 0.765 1.00 0.00 C ATOM 108 CE1 PHE A 10 4.688 7.946 -0.078 1.00 0.00 C ATOM 109 CE2 PHE A 10 7.054 7.830 -0.399 1.00 0.00 C ATOM 110 CZ PHE A 10 5.774 7.528 -0.822 1.00 0.00 C ATOM 0 H PHE A 10 7.833 11.545 1.866 1.00 0.00 H new ATOM 0 HA PHE A 10 4.994 11.268 2.118 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.428 9.727 3.050 1.00 0.00 H new ATOM 0 HB3 PHE A 10 5.824 9.278 3.595 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.031 8.991 1.662 1.00 0.00 H new ATOM 0 HD2 PHE A 10 8.247 8.786 1.090 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.686 7.710 -0.405 1.00 0.00 H new ATOM 0 HE2 PHE A 10 7.906 7.503 -0.977 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.623 6.967 -1.732 1.00 0.00 H new ATOM 120 N THR A 11 4.761 12.740 4.166 1.00 0.00 N ATOM 121 CA THR A 11 4.436 13.370 5.440 1.00 0.00 C ATOM 122 C THR A 11 3.581 12.451 6.305 1.00 0.00 C ATOM 123 O THR A 11 3.572 12.568 7.529 1.00 0.00 O ATOM 124 CB THR A 11 3.692 14.702 5.234 1.00 0.00 C ATOM 125 OG1 THR A 11 3.364 15.281 6.502 1.00 0.00 O ATOM 126 CG2 THR A 11 2.423 14.494 4.422 1.00 0.00 C ATOM 0 H THR A 11 4.223 13.090 3.373 1.00 0.00 H new ATOM 0 HA THR A 11 5.381 13.565 5.947 1.00 0.00 H new ATOM 0 HB THR A 11 4.348 15.378 4.685 1.00 0.00 H new ATOM 0 HG1 THR A 11 2.892 16.129 6.362 1.00 0.00 H new ATOM 0 HG21 THR A 11 1.915 15.449 4.290 1.00 0.00 H new ATOM 0 HG22 THR A 11 2.679 14.081 3.446 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.764 13.802 4.947 1.00 0.00 H new ATOM 134 N GLU A 12 2.863 11.537 5.659 1.00 0.00 N ATOM 135 CA GLU A 12 2.004 10.599 6.371 1.00 0.00 C ATOM 136 C GLU A 12 2.678 9.236 6.503 1.00 0.00 C ATOM 137 O GLU A 12 2.596 8.589 7.546 1.00 0.00 O ATOM 138 CB GLU A 12 0.664 10.449 5.648 1.00 0.00 C ATOM 139 CG GLU A 12 -0.454 9.933 6.537 1.00 0.00 C ATOM 140 CD GLU A 12 -1.829 10.335 6.039 1.00 0.00 C ATOM 141 OE1 GLU A 12 -2.119 11.550 6.015 1.00 0.00 O ATOM 142 OE2 GLU A 12 -2.615 9.436 5.674 1.00 0.00 O ATOM 0 H GLU A 12 2.859 11.427 4.645 1.00 0.00 H new ATOM 0 HA GLU A 12 1.827 10.996 7.370 1.00 0.00 H new ATOM 0 HB2 GLU A 12 0.373 11.416 5.237 1.00 0.00 H new ATOM 0 HB3 GLU A 12 0.790 9.769 4.805 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -0.396 8.846 6.593 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -0.313 10.313 7.549 1.00 0.00 H new ATOM 149 N GLY A 13 3.345 8.806 5.436 1.00 0.00 N ATOM 150 CA GLY A 13 4.023 7.523 5.452 1.00 0.00 C ATOM 151 C GLY A 13 3.059 6.357 5.362 1.00 0.00 C ATOM 152 O GLY A 13 1.843 6.540 5.428 1.00 0.00 O ATOM 0 H GLY A 13 3.428 9.323 4.561 1.00 0.00 H new ATOM 0 HA2 GLY A 13 4.724 7.476 4.619 1.00 0.00 H new ATOM 0 HA3 GLY A 13 4.609 7.436 6.367 1.00 0.00 H new ATOM 156 N LEU A 14 3.601 5.154 5.210 1.00 0.00 N ATOM 157 CA LEU A 14 2.780 3.952 5.109 1.00 0.00 C ATOM 158 C LEU A 14 2.636 3.276 6.469 1.00 0.00 C ATOM 159 O LEU A 14 3.595 3.191 7.236 1.00 0.00 O ATOM 160 CB LEU A 14 3.393 2.975 4.104 1.00 0.00 C ATOM 161 CG LEU A 14 2.945 3.139 2.651 1.00 0.00 C ATOM 162 CD1 LEU A 14 3.890 2.402 1.715 1.00 0.00 C ATOM 163 CD2 LEU A 14 1.519 2.641 2.473 1.00 0.00 C ATOM 0 H LEU A 14 4.605 4.985 5.154 1.00 0.00 H new ATOM 0 HA LEU A 14 1.789 4.246 4.763 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.477 3.078 4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.157 1.960 4.424 1.00 0.00 H new ATOM 0 HG LEU A 14 2.972 4.199 2.400 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.555 2.530 0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.897 2.806 1.822 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.896 1.341 1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.217 2.766 1.433 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.466 1.586 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.851 3.214 3.116 1.00 0.00 H new ATOM 175 N ARG A 15 1.432 2.794 6.760 1.00 0.00 N ATOM 176 CA ARG A 15 1.162 2.125 8.026 1.00 0.00 C ATOM 177 C ARG A 15 1.020 0.619 7.825 1.00 0.00 C ATOM 178 O ARG A 15 0.566 0.163 6.777 1.00 0.00 O ATOM 179 CB ARG A 15 -0.109 2.687 8.665 1.00 0.00 C ATOM 180 CG ARG A 15 -0.047 4.183 8.929 1.00 0.00 C ATOM 181 CD ARG A 15 -1.399 4.728 9.364 1.00 0.00 C ATOM 182 NE ARG A 15 -2.360 4.748 8.265 1.00 0.00 N ATOM 183 CZ ARG A 15 -2.273 5.573 7.227 1.00 0.00 C ATOM 184 NH1 ARG A 15 -1.272 6.440 7.147 1.00 0.00 N ATOM 185 NH2 ARG A 15 -3.187 5.532 6.266 1.00 0.00 N ATOM 0 H ARG A 15 0.628 2.855 6.135 1.00 0.00 H new ATOM 0 HA ARG A 15 2.006 2.308 8.692 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -0.957 2.476 8.013 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.293 2.168 9.606 1.00 0.00 H new ATOM 0 HG2 ARG A 15 0.694 4.387 9.701 1.00 0.00 H new ATOM 0 HG3 ARG A 15 0.282 4.700 8.027 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -1.791 4.118 10.177 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -1.274 5.738 9.755 1.00 0.00 H new ATOM 0 HE ARG A 15 -3.141 4.093 8.296 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -0.567 6.474 7.883 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -1.207 7.072 6.349 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.958 4.867 6.323 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.119 6.166 5.470 1.00 0.00 H new ATOM 199 N ASN A 16 1.411 -0.148 8.838 1.00 0.00 N ATOM 200 CA ASN A 16 1.328 -1.602 8.772 1.00 0.00 C ATOM 201 C ASN A 16 -0.057 -2.048 8.313 1.00 0.00 C ATOM 202 O ASN A 16 -1.045 -1.342 8.514 1.00 0.00 O ATOM 203 CB ASN A 16 1.646 -2.215 10.138 1.00 0.00 C ATOM 204 CG ASN A 16 0.692 -1.743 11.219 1.00 0.00 C ATOM 205 OD1 ASN A 16 -0.361 -2.341 11.437 1.00 0.00 O ATOM 206 ND2 ASN A 16 1.059 -0.665 11.902 1.00 0.00 N ATOM 0 H ASN A 16 1.788 0.214 9.714 1.00 0.00 H new ATOM 0 HA ASN A 16 2.062 -1.950 8.045 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.600 -3.302 10.065 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.667 -1.958 10.420 1.00 0.00 H new ATOM 0 HD21 ASN A 16 0.458 -0.301 12.642 1.00 0.00 H new ATOM 0 HD22 ASN A 16 1.942 -0.201 11.687 1.00 0.00 H new ATOM 213 N GLU A 17 -0.120 -3.224 7.695 1.00 0.00 N ATOM 214 CA GLU A 17 -1.384 -3.763 7.207 1.00 0.00 C ATOM 215 C GLU A 17 -1.508 -5.246 7.542 1.00 0.00 C ATOM 216 O GLU A 17 -0.507 -5.948 7.678 1.00 0.00 O ATOM 217 CB GLU A 17 -1.501 -3.559 5.695 1.00 0.00 C ATOM 218 CG GLU A 17 -2.883 -3.866 5.145 1.00 0.00 C ATOM 219 CD GLU A 17 -3.975 -3.070 5.832 1.00 0.00 C ATOM 220 OE1 GLU A 17 -4.448 -3.512 6.900 1.00 0.00 O ATOM 221 OE2 GLU A 17 -4.357 -2.006 5.302 1.00 0.00 O ATOM 0 H GLU A 17 0.689 -3.821 7.521 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.194 -3.227 7.702 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.245 -2.527 5.455 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -0.770 -4.194 5.194 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.900 -3.652 4.076 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.087 -4.930 5.260 1.00 0.00 H new ATOM 228 N GLU A 18 -2.745 -5.715 7.675 1.00 0.00 N ATOM 229 CA GLU A 18 -3.000 -7.115 7.995 1.00 0.00 C ATOM 230 C GLU A 18 -4.231 -7.627 7.253 1.00 0.00 C ATOM 231 O GLU A 18 -5.291 -7.004 7.282 1.00 0.00 O ATOM 232 CB GLU A 18 -3.192 -7.288 9.504 1.00 0.00 C ATOM 233 CG GLU A 18 -1.898 -7.547 10.256 1.00 0.00 C ATOM 234 CD GLU A 18 -1.934 -7.018 11.677 1.00 0.00 C ATOM 235 OE1 GLU A 18 -1.585 -5.836 11.879 1.00 0.00 O ATOM 236 OE2 GLU A 18 -2.311 -7.786 12.587 1.00 0.00 O ATOM 0 H GLU A 18 -3.585 -5.147 7.566 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.136 -7.698 7.676 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.663 -6.392 9.907 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.878 -8.116 9.682 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.702 -8.619 10.276 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.071 -7.082 9.720 1.00 0.00 H new ATOM 243 N ALA A 19 -4.080 -8.768 6.587 1.00 0.00 N ATOM 244 CA ALA A 19 -5.178 -9.366 5.838 1.00 0.00 C ATOM 245 C ALA A 19 -5.082 -10.887 5.843 1.00 0.00 C ATOM 246 O ALA A 19 -4.076 -11.453 6.271 1.00 0.00 O ATOM 247 CB ALA A 19 -5.190 -8.840 4.410 1.00 0.00 C ATOM 0 H ALA A 19 -3.208 -9.296 6.551 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.112 -9.086 6.325 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.015 -9.295 3.862 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -5.315 -7.757 4.422 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.248 -9.091 3.922 1.00 0.00 H new ATOM 253 N MET A 20 -6.134 -11.544 5.365 1.00 0.00 N ATOM 254 CA MET A 20 -6.166 -13.001 5.314 1.00 0.00 C ATOM 255 C MET A 20 -5.706 -13.508 3.952 1.00 0.00 C ATOM 256 O MET A 20 -5.830 -12.811 2.946 1.00 0.00 O ATOM 257 CB MET A 20 -7.578 -13.512 5.611 1.00 0.00 C ATOM 258 CG MET A 20 -8.053 -13.199 7.021 1.00 0.00 C ATOM 259 SD MET A 20 -9.215 -14.426 7.650 1.00 0.00 S ATOM 260 CE MET A 20 -8.099 -15.755 8.091 1.00 0.00 C ATOM 0 H MET A 20 -6.975 -11.091 5.008 1.00 0.00 H new ATOM 0 HA MET A 20 -5.482 -13.381 6.073 1.00 0.00 H new ATOM 0 HB2 MET A 20 -8.273 -13.072 4.896 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.605 -14.591 5.458 1.00 0.00 H new ATOM 0 HG2 MET A 20 -7.192 -13.145 7.687 1.00 0.00 H new ATOM 0 HG3 MET A 20 -8.526 -12.217 7.031 1.00 0.00 H new ATOM 0 HE1 MET A 20 -8.676 -16.628 8.396 1.00 0.00 H new ATOM 0 HE2 MET A 20 -7.480 -16.011 7.231 1.00 0.00 H new ATOM 0 HE3 MET A 20 -7.461 -15.436 8.915 1.00 0.00 H new ATOM 270 N GLU A 21 -5.173 -14.726 3.927 1.00 0.00 N ATOM 271 CA GLU A 21 -4.694 -15.325 2.687 1.00 0.00 C ATOM 272 C GLU A 21 -5.794 -15.344 1.631 1.00 0.00 C ATOM 273 O GLU A 21 -6.923 -15.752 1.901 1.00 0.00 O ATOM 274 CB GLU A 21 -4.192 -16.748 2.942 1.00 0.00 C ATOM 275 CG GLU A 21 -3.979 -17.555 1.673 1.00 0.00 C ATOM 276 CD GLU A 21 -2.992 -18.690 1.861 1.00 0.00 C ATOM 277 OE1 GLU A 21 -3.068 -19.374 2.904 1.00 0.00 O ATOM 278 OE2 GLU A 21 -2.144 -18.895 0.968 1.00 0.00 O ATOM 0 H GLU A 21 -5.062 -15.317 4.751 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.869 -14.717 2.316 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.253 -16.700 3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.908 -17.269 3.577 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.934 -17.961 1.341 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.621 -16.895 0.883 1.00 0.00 H new ATOM 285 N GLY A 22 -5.457 -14.898 0.424 1.00 0.00 N ATOM 286 CA GLY A 22 -6.427 -14.871 -0.655 1.00 0.00 C ATOM 287 C GLY A 22 -7.221 -13.580 -0.689 1.00 0.00 C ATOM 288 O GLY A 22 -7.752 -13.198 -1.731 1.00 0.00 O ATOM 0 H GLY A 22 -4.529 -14.555 0.175 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -5.911 -15.002 -1.606 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.112 -15.712 -0.545 1.00 0.00 H new ATOM 292 N ALA A 23 -7.303 -12.907 0.454 1.00 0.00 N ATOM 293 CA ALA A 23 -8.037 -11.652 0.551 1.00 0.00 C ATOM 294 C ALA A 23 -7.341 -10.547 -0.237 1.00 0.00 C ATOM 295 O ALA A 23 -6.247 -10.742 -0.767 1.00 0.00 O ATOM 296 CB ALA A 23 -8.196 -11.244 2.008 1.00 0.00 C ATOM 0 H ALA A 23 -6.870 -13.210 1.326 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.026 -11.804 0.118 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.746 -10.305 2.065 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -8.744 -12.018 2.545 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -7.212 -11.116 2.459 1.00 0.00 H new ATOM 302 N THR A 24 -7.983 -9.385 -0.311 1.00 0.00 N ATOM 303 CA THR A 24 -7.427 -8.249 -1.035 1.00 0.00 C ATOM 304 C THR A 24 -6.829 -7.225 -0.076 1.00 0.00 C ATOM 305 O THR A 24 -7.542 -6.618 0.722 1.00 0.00 O ATOM 306 CB THR A 24 -8.495 -7.559 -1.904 1.00 0.00 C ATOM 307 OG1 THR A 24 -9.103 -8.513 -2.782 1.00 0.00 O ATOM 308 CG2 THR A 24 -7.882 -6.431 -2.720 1.00 0.00 C ATOM 0 H THR A 24 -8.889 -9.206 0.122 1.00 0.00 H new ATOM 0 HA THR A 24 -6.641 -8.640 -1.681 1.00 0.00 H new ATOM 0 HB THR A 24 -9.253 -7.138 -1.243 1.00 0.00 H new ATOM 0 HG1 THR A 24 -9.815 -8.077 -3.296 1.00 0.00 H new ATOM 0 HG21 THR A 24 -8.655 -5.958 -3.326 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.445 -5.692 -2.048 1.00 0.00 H new ATOM 0 HG23 THR A 24 -7.106 -6.833 -3.371 1.00 0.00 H new ATOM 316 N ALA A 25 -5.516 -7.038 -0.161 1.00 0.00 N ATOM 317 CA ALA A 25 -4.823 -6.085 0.697 1.00 0.00 C ATOM 318 C ALA A 25 -5.023 -4.656 0.204 1.00 0.00 C ATOM 319 O ALA A 25 -5.250 -4.423 -0.984 1.00 0.00 O ATOM 320 CB ALA A 25 -3.340 -6.419 0.767 1.00 0.00 C ATOM 0 H ALA A 25 -4.911 -7.534 -0.815 1.00 0.00 H new ATOM 0 HA ALA A 25 -5.248 -6.159 1.698 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.835 -5.699 1.411 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -3.212 -7.422 1.174 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -2.910 -6.375 -0.233 1.00 0.00 H new ATOM 326 N THR A 26 -4.938 -3.700 1.124 1.00 0.00 N ATOM 327 CA THR A 26 -5.111 -2.294 0.783 1.00 0.00 C ATOM 328 C THR A 26 -4.236 -1.404 1.658 1.00 0.00 C ATOM 329 O THR A 26 -4.302 -1.465 2.886 1.00 0.00 O ATOM 330 CB THR A 26 -6.581 -1.856 0.935 1.00 0.00 C ATOM 331 OG1 THR A 26 -7.447 -2.843 0.364 1.00 0.00 O ATOM 332 CG2 THR A 26 -6.818 -0.514 0.258 1.00 0.00 C ATOM 0 H THR A 26 -4.750 -3.874 2.111 1.00 0.00 H new ATOM 0 HA THR A 26 -4.811 -2.183 -0.259 1.00 0.00 H new ATOM 0 HB THR A 26 -6.799 -1.753 1.998 1.00 0.00 H new ATOM 0 HG1 THR A 26 -8.379 -2.558 0.466 1.00 0.00 H new ATOM 0 HG21 THR A 26 -7.862 -0.225 0.378 1.00 0.00 H new ATOM 0 HG22 THR A 26 -6.178 0.241 0.714 1.00 0.00 H new ATOM 0 HG23 THR A 26 -6.584 -0.596 -0.803 1.00 0.00 H new ATOM 340 N LEU A 27 -3.415 -0.577 1.018 1.00 0.00 N ATOM 341 CA LEU A 27 -2.526 0.327 1.739 1.00 0.00 C ATOM 342 C LEU A 27 -2.941 1.780 1.531 1.00 0.00 C ATOM 343 O LEU A 27 -3.746 2.085 0.652 1.00 0.00 O ATOM 344 CB LEU A 27 -1.081 0.127 1.278 1.00 0.00 C ATOM 345 CG LEU A 27 -0.413 -1.179 1.712 1.00 0.00 C ATOM 346 CD1 LEU A 27 0.706 -1.551 0.752 1.00 0.00 C ATOM 347 CD2 LEU A 27 0.119 -1.059 3.133 1.00 0.00 C ATOM 0 H LEU A 27 -3.347 -0.514 0.002 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.598 0.097 2.802 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.057 0.180 0.190 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.483 0.959 1.651 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.161 -1.972 1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.169 -2.483 1.077 1.00 0.00 H new ATOM 0 HD12 LEU A 27 0.298 -1.679 -0.251 1.00 0.00 H new ATOM 0 HD13 LEU A 27 1.454 -0.758 0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.591 -1.997 3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.852 -0.254 3.180 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.705 -0.840 3.813 1.00 0.00 H new ATOM 359 N GLN A 28 -2.384 2.671 2.344 1.00 0.00 N ATOM 360 CA GLN A 28 -2.696 4.092 2.248 1.00 0.00 C ATOM 361 C GLN A 28 -1.472 4.942 2.576 1.00 0.00 C ATOM 362 O GLN A 28 -0.652 4.568 3.416 1.00 0.00 O ATOM 363 CB GLN A 28 -3.847 4.449 3.190 1.00 0.00 C ATOM 364 CG GLN A 28 -4.513 5.775 2.863 1.00 0.00 C ATOM 365 CD GLN A 28 -5.901 5.895 3.462 1.00 0.00 C ATOM 366 OE1 GLN A 28 -6.065 6.363 4.588 1.00 0.00 O ATOM 367 NE2 GLN A 28 -6.909 5.471 2.709 1.00 0.00 N ATOM 0 H GLN A 28 -1.715 2.434 3.076 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.998 4.303 1.222 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.595 3.657 3.152 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -3.471 4.483 4.213 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -3.891 6.590 3.232 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -4.578 5.888 1.781 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.727 5.090 1.781 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.865 5.527 3.059 1.00 0.00 H new ATOM 376 N CYS A 29 -1.356 6.084 1.908 1.00 0.00 N ATOM 377 CA CYS A 29 -0.231 6.987 2.128 1.00 0.00 C ATOM 378 C CYS A 29 -0.478 8.336 1.462 1.00 0.00 C ATOM 379 O CYS A 29 -0.872 8.401 0.298 1.00 0.00 O ATOM 380 CB CYS A 29 1.060 6.367 1.590 1.00 0.00 C ATOM 381 SG CYS A 29 0.991 5.924 -0.161 1.00 0.00 S ATOM 0 H CYS A 29 -2.026 6.407 1.210 1.00 0.00 H new ATOM 0 HA CYS A 29 -0.129 7.146 3.202 1.00 0.00 H new ATOM 0 HB2 CYS A 29 1.879 7.069 1.744 1.00 0.00 H new ATOM 0 HB3 CYS A 29 1.291 5.474 2.171 1.00 0.00 H new ATOM 0 HG CYS A 29 0.912 4.632 -0.279 1.00 0.00 H new ATOM 387 N GLU A 30 -0.245 9.411 2.208 1.00 0.00 N ATOM 388 CA GLU A 30 -0.445 10.759 1.690 1.00 0.00 C ATOM 389 C GLU A 30 0.892 11.463 1.474 1.00 0.00 C ATOM 390 O GLU A 30 1.908 11.084 2.058 1.00 0.00 O ATOM 391 CB GLU A 30 -1.314 11.575 2.649 1.00 0.00 C ATOM 392 CG GLU A 30 -1.822 12.876 2.052 1.00 0.00 C ATOM 393 CD GLU A 30 -2.663 13.676 3.028 1.00 0.00 C ATOM 394 OE1 GLU A 30 -3.819 13.278 3.282 1.00 0.00 O ATOM 395 OE2 GLU A 30 -2.164 14.702 3.537 1.00 0.00 O ATOM 0 H GLU A 30 0.083 9.375 3.173 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.954 10.679 0.729 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.166 10.970 2.958 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.738 11.798 3.547 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.973 13.479 1.730 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -2.413 12.657 1.163 1.00 0.00 H new ATOM 402 N LEU A 31 0.884 12.489 0.630 1.00 0.00 N ATOM 403 CA LEU A 31 2.095 13.247 0.336 1.00 0.00 C ATOM 404 C LEU A 31 1.865 14.741 0.539 1.00 0.00 C ATOM 405 O LEU A 31 0.740 15.228 0.423 1.00 0.00 O ATOM 406 CB LEU A 31 2.551 12.979 -1.100 1.00 0.00 C ATOM 407 CG LEU A 31 2.843 11.520 -1.451 1.00 0.00 C ATOM 408 CD1 LEU A 31 2.658 11.282 -2.941 1.00 0.00 C ATOM 409 CD2 LEU A 31 4.251 11.139 -1.018 1.00 0.00 C ATOM 0 H LEU A 31 0.052 12.815 0.137 1.00 0.00 H new ATOM 0 HA LEU A 31 2.875 12.922 1.025 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.782 13.348 -1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.451 13.564 -1.289 1.00 0.00 H new ATOM 0 HG LEU A 31 2.136 10.888 -0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.870 10.238 -3.172 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.631 11.514 -3.222 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.340 11.923 -3.499 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.442 10.097 -1.276 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.973 11.777 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.348 11.270 0.060 1.00 0.00 H new ATOM 421 N SER A 32 2.939 15.464 0.840 1.00 0.00 N ATOM 422 CA SER A 32 2.854 16.903 1.060 1.00 0.00 C ATOM 423 C SER A 32 2.138 17.589 -0.099 1.00 0.00 C ATOM 424 O SER A 32 1.589 18.681 0.053 1.00 0.00 O ATOM 425 CB SER A 32 4.254 17.497 1.233 1.00 0.00 C ATOM 426 OG SER A 32 5.001 17.398 0.033 1.00 0.00 O ATOM 0 H SER A 32 3.878 15.077 0.937 1.00 0.00 H new ATOM 0 HA SER A 32 2.279 17.073 1.970 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.175 18.543 1.531 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.777 16.976 2.035 1.00 0.00 H new ATOM 0 HG SER A 32 5.891 17.786 0.169 1.00 0.00 H new ATOM 432 N LYS A 33 2.146 16.940 -1.259 1.00 0.00 N ATOM 433 CA LYS A 33 1.497 17.484 -2.445 1.00 0.00 C ATOM 434 C LYS A 33 1.440 16.445 -3.560 1.00 0.00 C ATOM 435 O LYS A 33 2.323 15.595 -3.674 1.00 0.00 O ATOM 436 CB LYS A 33 2.240 18.730 -2.932 1.00 0.00 C ATOM 437 CG LYS A 33 3.632 18.438 -3.466 1.00 0.00 C ATOM 438 CD LYS A 33 4.305 19.697 -3.986 1.00 0.00 C ATOM 439 CE LYS A 33 5.292 19.382 -5.100 1.00 0.00 C ATOM 440 NZ LYS A 33 6.079 20.581 -5.499 1.00 0.00 N ATOM 0 H LYS A 33 2.596 16.036 -1.402 1.00 0.00 H new ATOM 0 HA LYS A 33 0.477 17.758 -2.176 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.653 19.210 -3.715 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.317 19.441 -2.110 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.241 17.999 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.568 17.701 -4.267 1.00 0.00 H new ATOM 0 HD2 LYS A 33 3.548 20.390 -4.354 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.825 20.197 -3.169 1.00 0.00 H new ATOM 0 HE2 LYS A 33 5.971 18.595 -4.772 1.00 0.00 H new ATOM 0 HE3 LYS A 33 4.752 18.997 -5.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 6.740 20.325 -6.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.434 21.324 -5.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.614 20.933 -4.680 1.00 0.00 H new ATOM 454 N ALA A 34 0.398 16.519 -4.380 1.00 0.00 N ATOM 455 CA ALA A 34 0.229 15.587 -5.488 1.00 0.00 C ATOM 456 C ALA A 34 1.550 15.350 -6.212 1.00 0.00 C ATOM 457 O ALA A 34 2.199 16.293 -6.664 1.00 0.00 O ATOM 458 CB ALA A 34 -0.822 16.105 -6.459 1.00 0.00 C ATOM 0 H ALA A 34 -0.343 17.215 -4.298 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.108 14.634 -5.080 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.937 15.399 -7.281 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.774 16.216 -5.940 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.509 17.072 -6.853 1.00 0.00 H new ATOM 464 N ALA A 35 1.942 14.084 -6.319 1.00 0.00 N ATOM 465 CA ALA A 35 3.185 13.724 -6.989 1.00 0.00 C ATOM 466 C ALA A 35 3.169 12.263 -7.428 1.00 0.00 C ATOM 467 O ALA A 35 2.494 11.420 -6.837 1.00 0.00 O ATOM 468 CB ALA A 35 4.373 13.990 -6.077 1.00 0.00 C ATOM 0 H ALA A 35 1.416 13.291 -5.950 1.00 0.00 H new ATOM 0 HA ALA A 35 3.280 14.343 -7.881 1.00 0.00 H new ATOM 0 HB1 ALA A 35 5.295 13.716 -6.591 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.403 15.048 -5.817 1.00 0.00 H new ATOM 0 HB3 ALA A 35 4.274 13.396 -5.168 1.00 0.00 H new ATOM 474 N PRO A 36 3.928 11.955 -8.489 1.00 0.00 N ATOM 475 CA PRO A 36 4.018 10.596 -9.031 1.00 0.00 C ATOM 476 C PRO A 36 4.764 9.648 -8.098 1.00 0.00 C ATOM 477 O PRO A 36 5.923 9.883 -7.756 1.00 0.00 O ATOM 478 CB PRO A 36 4.795 10.784 -10.336 1.00 0.00 C ATOM 479 CG PRO A 36 5.594 12.024 -10.125 1.00 0.00 C ATOM 480 CD PRO A 36 4.759 12.910 -9.243 1.00 0.00 C ATOM 0 HA PRO A 36 3.035 10.146 -9.166 1.00 0.00 H new ATOM 0 HB2 PRO A 36 5.438 9.928 -10.541 1.00 0.00 H new ATOM 0 HB3 PRO A 36 4.121 10.887 -11.187 1.00 0.00 H new ATOM 0 HG2 PRO A 36 6.551 11.796 -9.655 1.00 0.00 H new ATOM 0 HG3 PRO A 36 5.813 12.513 -11.074 1.00 0.00 H new ATOM 0 HD2 PRO A 36 5.378 13.515 -8.580 1.00 0.00 H new ATOM 0 HD3 PRO A 36 4.149 13.599 -9.827 1.00 0.00 H new ATOM 488 N VAL A 37 4.093 8.576 -7.690 1.00 0.00 N ATOM 489 CA VAL A 37 4.693 7.592 -6.798 1.00 0.00 C ATOM 490 C VAL A 37 4.984 6.288 -7.533 1.00 0.00 C ATOM 491 O VAL A 37 4.701 6.160 -8.724 1.00 0.00 O ATOM 492 CB VAL A 37 3.781 7.296 -5.593 1.00 0.00 C ATOM 493 CG1 VAL A 37 3.482 8.573 -4.822 1.00 0.00 C ATOM 494 CG2 VAL A 37 2.494 6.626 -6.051 1.00 0.00 C ATOM 0 H VAL A 37 3.133 8.367 -7.963 1.00 0.00 H new ATOM 0 HA VAL A 37 5.629 8.020 -6.439 1.00 0.00 H new ATOM 0 HB VAL A 37 4.303 6.611 -4.925 1.00 0.00 H new ATOM 0 HG11 VAL A 37 2.836 8.344 -3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 37 4.414 9.007 -4.461 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.981 9.285 -5.478 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.861 6.424 -5.187 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.966 7.285 -6.741 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.731 5.689 -6.554 1.00 0.00 H new ATOM 504 N GLU A 38 5.551 5.324 -6.815 1.00 0.00 N ATOM 505 CA GLU A 38 5.881 4.030 -7.401 1.00 0.00 C ATOM 506 C GLU A 38 6.026 2.964 -6.318 1.00 0.00 C ATOM 507 O GLU A 38 6.821 3.111 -5.390 1.00 0.00 O ATOM 508 CB GLU A 38 7.174 4.127 -8.213 1.00 0.00 C ATOM 509 CG GLU A 38 7.302 3.055 -9.283 1.00 0.00 C ATOM 510 CD GLU A 38 6.695 3.477 -10.607 1.00 0.00 C ATOM 511 OE1 GLU A 38 5.454 3.410 -10.738 1.00 0.00 O ATOM 512 OE2 GLU A 38 7.459 3.873 -11.512 1.00 0.00 O ATOM 0 H GLU A 38 5.791 5.414 -5.828 1.00 0.00 H new ATOM 0 HA GLU A 38 5.065 3.742 -8.064 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.224 5.108 -8.685 1.00 0.00 H new ATOM 0 HB3 GLU A 38 8.025 4.056 -7.536 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.356 2.818 -9.430 1.00 0.00 H new ATOM 0 HG3 GLU A 38 6.815 2.143 -8.938 1.00 0.00 H new ATOM 519 N TRP A 39 5.253 1.892 -6.445 1.00 0.00 N ATOM 520 CA TRP A 39 5.295 0.801 -5.478 1.00 0.00 C ATOM 521 C TRP A 39 6.250 -0.296 -5.935 1.00 0.00 C ATOM 522 O TRP A 39 6.452 -0.497 -7.132 1.00 0.00 O ATOM 523 CB TRP A 39 3.894 0.221 -5.271 1.00 0.00 C ATOM 524 CG TRP A 39 2.870 1.255 -4.915 1.00 0.00 C ATOM 525 CD1 TRP A 39 2.333 2.197 -5.745 1.00 0.00 C ATOM 526 CD2 TRP A 39 2.260 1.451 -3.634 1.00 0.00 C ATOM 527 NE1 TRP A 39 1.427 2.968 -5.058 1.00 0.00 N ATOM 528 CE2 TRP A 39 1.363 2.530 -3.761 1.00 0.00 C ATOM 529 CE3 TRP A 39 2.383 0.820 -2.394 1.00 0.00 C ATOM 530 CZ2 TRP A 39 0.596 2.989 -2.694 1.00 0.00 C ATOM 531 CZ3 TRP A 39 1.622 1.278 -1.335 1.00 0.00 C ATOM 532 CH2 TRP A 39 0.737 2.353 -1.491 1.00 0.00 C ATOM 0 H TRP A 39 4.590 1.755 -7.208 1.00 0.00 H new ATOM 0 HA TRP A 39 5.658 1.202 -4.532 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.582 -0.290 -6.182 1.00 0.00 H new ATOM 0 HB3 TRP A 39 3.932 -0.529 -4.481 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.584 2.318 -6.788 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.889 3.741 -5.450 1.00 0.00 H new ATOM 0 HE3 TRP A 39 3.061 -0.011 -2.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -0.086 3.818 -2.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.711 0.799 -0.371 1.00 0.00 H new ATOM 0 HH2 TRP A 39 0.155 2.686 -0.645 1.00 0.00 H new ATOM 543 N ARG A 40 6.837 -1.002 -4.973 1.00 0.00 N ATOM 544 CA ARG A 40 7.772 -2.078 -5.278 1.00 0.00 C ATOM 545 C ARG A 40 7.662 -3.202 -4.252 1.00 0.00 C ATOM 546 O ARG A 40 7.872 -2.989 -3.058 1.00 0.00 O ATOM 547 CB ARG A 40 9.205 -1.542 -5.312 1.00 0.00 C ATOM 548 CG ARG A 40 9.550 -0.807 -6.597 1.00 0.00 C ATOM 549 CD ARG A 40 11.053 -0.757 -6.824 1.00 0.00 C ATOM 550 NE ARG A 40 11.387 -0.466 -8.215 1.00 0.00 N ATOM 551 CZ ARG A 40 12.629 -0.451 -8.685 1.00 0.00 C ATOM 552 NH1 ARG A 40 13.649 -0.710 -7.879 1.00 0.00 N ATOM 553 NH2 ARG A 40 12.853 -0.177 -9.964 1.00 0.00 N ATOM 0 H ARG A 40 6.681 -0.848 -3.977 1.00 0.00 H new ATOM 0 HA ARG A 40 7.518 -2.479 -6.259 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.352 -0.869 -4.468 1.00 0.00 H new ATOM 0 HB3 ARG A 40 9.898 -2.373 -5.182 1.00 0.00 H new ATOM 0 HG2 ARG A 40 9.070 -1.302 -7.441 1.00 0.00 H new ATOM 0 HG3 ARG A 40 9.153 0.207 -6.555 1.00 0.00 H new ATOM 0 HD2 ARG A 40 11.492 0.004 -6.179 1.00 0.00 H new ATOM 0 HD3 ARG A 40 11.495 -1.711 -6.537 1.00 0.00 H new ATOM 0 HE ARG A 40 10.625 -0.263 -8.861 1.00 0.00 H new ATOM 0 HH11 ARG A 40 13.481 -0.921 -6.895 1.00 0.00 H new ATOM 0 HH12 ARG A 40 14.602 -0.698 -8.242 1.00 0.00 H new ATOM 0 HH21 ARG A 40 12.071 0.022 -10.587 1.00 0.00 H new ATOM 0 HH22 ARG A 40 13.807 -0.166 -10.324 1.00 0.00 H new ATOM 567 N LYS A 41 7.330 -4.398 -4.725 1.00 0.00 N ATOM 568 CA LYS A 41 7.192 -5.556 -3.851 1.00 0.00 C ATOM 569 C LYS A 41 8.404 -6.475 -3.969 1.00 0.00 C ATOM 570 O LYS A 41 8.647 -7.066 -5.021 1.00 0.00 O ATOM 571 CB LYS A 41 5.917 -6.330 -4.192 1.00 0.00 C ATOM 572 CG LYS A 41 5.655 -7.508 -3.270 1.00 0.00 C ATOM 573 CD LYS A 41 4.849 -8.592 -3.966 1.00 0.00 C ATOM 574 CE LYS A 41 5.743 -9.520 -4.774 1.00 0.00 C ATOM 575 NZ LYS A 41 5.007 -10.722 -5.253 1.00 0.00 N ATOM 0 H LYS A 41 7.151 -4.591 -5.711 1.00 0.00 H new ATOM 0 HA LYS A 41 7.128 -5.198 -2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.067 -5.650 -4.149 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.985 -6.691 -5.218 1.00 0.00 H new ATOM 0 HG2 LYS A 41 6.604 -7.922 -2.928 1.00 0.00 H new ATOM 0 HG3 LYS A 41 5.119 -7.166 -2.385 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.299 -9.170 -3.224 1.00 0.00 H new ATOM 0 HD3 LYS A 41 4.111 -8.132 -4.624 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.150 -8.979 -5.628 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.589 -9.832 -4.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.651 -11.329 -5.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.640 -11.252 -4.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 4.215 -10.426 -5.858 1.00 0.00 H new ATOM 589 N GLY A 42 9.162 -6.592 -2.883 1.00 0.00 N ATOM 590 CA GLY A 42 10.338 -7.442 -2.886 1.00 0.00 C ATOM 591 C GLY A 42 11.390 -6.971 -3.871 1.00 0.00 C ATOM 592 O GLY A 42 11.917 -7.763 -4.654 1.00 0.00 O ATOM 0 H GLY A 42 8.982 -6.113 -2.001 1.00 0.00 H new ATOM 0 HA2 GLY A 42 10.767 -7.467 -1.884 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.045 -8.462 -3.132 1.00 0.00 H new ATOM 596 N LEU A 43 11.697 -5.679 -3.834 1.00 0.00 N ATOM 597 CA LEU A 43 12.692 -5.103 -4.731 1.00 0.00 C ATOM 598 C LEU A 43 12.320 -5.352 -6.189 1.00 0.00 C ATOM 599 O LEU A 43 13.178 -5.667 -7.013 1.00 0.00 O ATOM 600 CB LEU A 43 14.073 -5.692 -4.438 1.00 0.00 C ATOM 601 CG LEU A 43 14.750 -5.208 -3.155 1.00 0.00 C ATOM 602 CD1 LEU A 43 14.120 -5.866 -1.937 1.00 0.00 C ATOM 603 CD2 LEU A 43 16.245 -5.490 -3.201 1.00 0.00 C ATOM 0 H LEU A 43 11.271 -5.010 -3.192 1.00 0.00 H new ATOM 0 HA LEU A 43 12.719 -4.027 -4.561 1.00 0.00 H new ATOM 0 HB2 LEU A 43 13.980 -6.777 -4.389 1.00 0.00 H new ATOM 0 HB3 LEU A 43 14.729 -5.465 -5.279 1.00 0.00 H new ATOM 0 HG LEU A 43 14.605 -4.131 -3.076 1.00 0.00 H new ATOM 0 HD11 LEU A 43 14.615 -5.509 -1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 43 13.061 -5.613 -1.894 1.00 0.00 H new ATOM 0 HD13 LEU A 43 14.232 -6.948 -2.009 1.00 0.00 H new ATOM 0 HD21 LEU A 43 16.710 -5.139 -2.280 1.00 0.00 H new ATOM 0 HD22 LEU A 43 16.410 -6.562 -3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 43 16.687 -4.971 -4.051 1.00 0.00 H new ATOM 615 N GLU A 44 11.036 -5.208 -6.500 1.00 0.00 N ATOM 616 CA GLU A 44 10.551 -5.416 -7.859 1.00 0.00 C ATOM 617 C GLU A 44 9.640 -4.272 -8.293 1.00 0.00 C ATOM 618 O GLU A 44 8.922 -3.693 -7.478 1.00 0.00 O ATOM 619 CB GLU A 44 9.801 -6.746 -7.959 1.00 0.00 C ATOM 620 CG GLU A 44 9.287 -7.052 -9.356 1.00 0.00 C ATOM 621 CD GLU A 44 8.581 -8.391 -9.438 1.00 0.00 C ATOM 622 OE1 GLU A 44 9.275 -9.429 -9.403 1.00 0.00 O ATOM 623 OE2 GLU A 44 7.337 -8.402 -9.536 1.00 0.00 O ATOM 0 H GLU A 44 10.313 -4.948 -5.829 1.00 0.00 H new ATOM 0 HA GLU A 44 11.414 -5.443 -8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.463 -7.551 -7.640 1.00 0.00 H new ATOM 0 HB3 GLU A 44 8.959 -6.732 -7.266 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.601 -6.264 -9.667 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.122 -7.042 -10.056 1.00 0.00 H new ATOM 630 N ALA A 45 9.675 -3.952 -9.583 1.00 0.00 N ATOM 631 CA ALA A 45 8.851 -2.879 -10.126 1.00 0.00 C ATOM 632 C ALA A 45 7.442 -3.371 -10.435 1.00 0.00 C ATOM 633 O ALA A 45 7.243 -4.196 -11.328 1.00 0.00 O ATOM 634 CB ALA A 45 9.497 -2.300 -11.376 1.00 0.00 C ATOM 0 H ALA A 45 10.265 -4.420 -10.271 1.00 0.00 H new ATOM 0 HA ALA A 45 8.775 -2.095 -9.373 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.871 -1.500 -11.771 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.481 -1.902 -11.126 1.00 0.00 H new ATOM 0 HB3 ALA A 45 9.602 -3.083 -12.127 1.00 0.00 H new ATOM 640 N LEU A 46 6.466 -2.861 -9.692 1.00 0.00 N ATOM 641 CA LEU A 46 5.073 -3.250 -9.887 1.00 0.00 C ATOM 642 C LEU A 46 4.474 -2.541 -11.097 1.00 0.00 C ATOM 643 O LEU A 46 5.064 -1.604 -11.635 1.00 0.00 O ATOM 644 CB LEU A 46 4.254 -2.929 -8.636 1.00 0.00 C ATOM 645 CG LEU A 46 4.706 -3.610 -7.344 1.00 0.00 C ATOM 646 CD1 LEU A 46 3.953 -3.045 -6.150 1.00 0.00 C ATOM 647 CD2 LEU A 46 4.509 -5.116 -7.437 1.00 0.00 C ATOM 0 H LEU A 46 6.613 -2.178 -8.949 1.00 0.00 H new ATOM 0 HA LEU A 46 5.043 -4.325 -10.068 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.274 -1.850 -8.480 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.217 -3.205 -8.825 1.00 0.00 H new ATOM 0 HG LEU A 46 5.768 -3.411 -7.204 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.288 -3.542 -5.240 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.146 -1.975 -6.071 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.884 -3.212 -6.282 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.836 -5.584 -6.508 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.454 -5.335 -7.602 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.095 -5.509 -8.267 1.00 0.00 H new ATOM 659 N ARG A 47 3.297 -2.992 -11.519 1.00 0.00 N ATOM 660 CA ARG A 47 2.617 -2.400 -12.664 1.00 0.00 C ATOM 661 C ARG A 47 1.104 -2.418 -12.468 1.00 0.00 C ATOM 662 O ARG A 47 0.527 -3.447 -12.115 1.00 0.00 O ATOM 663 CB ARG A 47 2.985 -3.150 -13.946 1.00 0.00 C ATOM 664 CG ARG A 47 4.451 -3.023 -14.326 1.00 0.00 C ATOM 665 CD ARG A 47 4.845 -4.051 -15.376 1.00 0.00 C ATOM 666 NE ARG A 47 5.971 -3.599 -16.189 1.00 0.00 N ATOM 667 CZ ARG A 47 5.857 -2.724 -17.181 1.00 0.00 C ATOM 668 NH1 ARG A 47 4.672 -2.209 -17.482 1.00 0.00 N ATOM 669 NH2 ARG A 47 6.928 -2.362 -17.875 1.00 0.00 N ATOM 0 H ARG A 47 2.795 -3.766 -11.084 1.00 0.00 H new ATOM 0 HA ARG A 47 2.942 -1.363 -12.751 1.00 0.00 H new ATOM 0 HB2 ARG A 47 2.740 -4.205 -13.823 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.372 -2.774 -14.765 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.644 -2.020 -14.707 1.00 0.00 H new ATOM 0 HG3 ARG A 47 5.071 -3.152 -13.439 1.00 0.00 H new ATOM 0 HD2 ARG A 47 5.106 -4.989 -14.885 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.991 -4.256 -16.021 1.00 0.00 H new ATOM 0 HE ARG A 47 6.896 -3.976 -15.983 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.846 -2.485 -16.951 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.587 -1.537 -18.245 1.00 0.00 H new ATOM 0 HH21 ARG A 47 7.841 -2.756 -17.647 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.839 -1.690 -18.637 1.00 0.00 H new ATOM 683 N ASP A 48 0.469 -1.275 -12.699 1.00 0.00 N ATOM 684 CA ASP A 48 -0.977 -1.159 -12.548 1.00 0.00 C ATOM 685 C ASP A 48 -1.701 -1.899 -13.669 1.00 0.00 C ATOM 686 O ASP A 48 -1.217 -1.963 -14.798 1.00 0.00 O ATOM 687 CB ASP A 48 -1.394 0.312 -12.539 1.00 0.00 C ATOM 688 CG ASP A 48 -2.897 0.487 -12.444 1.00 0.00 C ATOM 689 OD1 ASP A 48 -3.454 0.245 -11.353 1.00 0.00 O ATOM 690 OD2 ASP A 48 -3.517 0.865 -13.460 1.00 0.00 O ATOM 0 H ASP A 48 0.933 -0.415 -12.992 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.256 -1.613 -11.597 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -0.919 0.816 -11.698 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.032 0.795 -13.446 1.00 0.00 H new ATOM 695 N GLY A 49 -2.864 -2.459 -13.347 1.00 0.00 N ATOM 696 CA GLY A 49 -3.635 -3.188 -14.336 1.00 0.00 C ATOM 697 C GLY A 49 -4.779 -3.969 -13.720 1.00 0.00 C ATOM 698 O GLY A 49 -5.820 -3.401 -13.390 1.00 0.00 O ATOM 0 H GLY A 49 -3.285 -2.420 -12.419 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.032 -2.488 -15.071 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -2.978 -3.874 -14.871 1.00 0.00 H new ATOM 702 N ASP A 50 -4.586 -5.274 -13.565 1.00 0.00 N ATOM 703 CA ASP A 50 -5.610 -6.134 -12.984 1.00 0.00 C ATOM 704 C ASP A 50 -5.157 -6.684 -11.635 1.00 0.00 C ATOM 705 O ASP A 50 -5.923 -6.702 -10.671 1.00 0.00 O ATOM 706 CB ASP A 50 -5.937 -7.287 -13.935 1.00 0.00 C ATOM 707 CG ASP A 50 -6.818 -6.853 -15.090 1.00 0.00 C ATOM 708 OD1 ASP A 50 -6.587 -5.751 -15.630 1.00 0.00 O ATOM 709 OD2 ASP A 50 -7.739 -7.614 -15.453 1.00 0.00 O ATOM 0 H ASP A 50 -3.730 -5.759 -13.834 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.507 -5.535 -12.829 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.010 -7.705 -14.326 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.436 -8.082 -13.380 1.00 0.00 H new ATOM 714 N LYS A 51 -3.909 -7.134 -11.574 1.00 0.00 N ATOM 715 CA LYS A 51 -3.352 -7.684 -10.344 1.00 0.00 C ATOM 716 C LYS A 51 -3.403 -6.658 -9.217 1.00 0.00 C ATOM 717 O LYS A 51 -3.838 -6.963 -8.106 1.00 0.00 O ATOM 718 CB LYS A 51 -1.908 -8.137 -10.571 1.00 0.00 C ATOM 719 CG LYS A 51 -1.481 -9.283 -9.670 1.00 0.00 C ATOM 720 CD LYS A 51 -1.728 -8.962 -8.206 1.00 0.00 C ATOM 721 CE LYS A 51 -0.948 -9.895 -7.292 1.00 0.00 C ATOM 722 NZ LYS A 51 -1.715 -11.132 -6.977 1.00 0.00 N ATOM 0 H LYS A 51 -3.263 -7.129 -12.363 1.00 0.00 H new ATOM 0 HA LYS A 51 -3.955 -8.545 -10.055 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -1.791 -8.441 -11.611 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.241 -7.290 -10.409 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -2.028 -10.185 -9.943 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -0.423 -9.493 -9.824 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -1.441 -7.930 -8.005 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.793 -9.044 -7.989 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -0.005 -10.164 -7.767 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -0.702 -9.375 -6.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -1.247 -11.643 -6.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.682 -10.877 -6.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -1.753 -11.741 -7.819 1.00 0.00 H new ATOM 736 N TYR A 52 -2.958 -5.441 -9.510 1.00 0.00 N ATOM 737 CA TYR A 52 -2.952 -4.371 -8.521 1.00 0.00 C ATOM 738 C TYR A 52 -3.882 -3.236 -8.940 1.00 0.00 C ATOM 739 O TYR A 52 -4.117 -3.018 -10.128 1.00 0.00 O ATOM 740 CB TYR A 52 -1.533 -3.836 -8.326 1.00 0.00 C ATOM 741 CG TYR A 52 -0.533 -4.900 -7.935 1.00 0.00 C ATOM 742 CD1 TYR A 52 0.142 -5.636 -8.901 1.00 0.00 C ATOM 743 CD2 TYR A 52 -0.262 -5.169 -6.598 1.00 0.00 C ATOM 744 CE1 TYR A 52 1.055 -6.610 -8.548 1.00 0.00 C ATOM 745 CE2 TYR A 52 0.651 -6.140 -6.236 1.00 0.00 C ATOM 746 CZ TYR A 52 1.307 -6.858 -7.214 1.00 0.00 C ATOM 747 OH TYR A 52 2.218 -7.827 -6.859 1.00 0.00 O ATOM 0 H TYR A 52 -2.597 -5.171 -10.425 1.00 0.00 H new ATOM 0 HA TYR A 52 -3.311 -4.782 -7.577 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -1.203 -3.361 -9.250 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.548 -3.063 -7.558 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -0.051 -5.443 -9.946 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -0.774 -4.609 -5.830 1.00 0.00 H new ATOM 0 HE1 TYR A 52 1.569 -7.175 -9.312 1.00 0.00 H new ATOM 0 HE2 TYR A 52 0.850 -6.336 -5.193 1.00 0.00 H new ATOM 0 HH TYR A 52 2.280 -7.876 -5.882 1.00 0.00 H new ATOM 757 N SER A 53 -4.409 -2.517 -7.954 1.00 0.00 N ATOM 758 CA SER A 53 -5.317 -1.406 -8.219 1.00 0.00 C ATOM 759 C SER A 53 -4.771 -0.108 -7.634 1.00 0.00 C ATOM 760 O SER A 53 -4.998 0.204 -6.464 1.00 0.00 O ATOM 761 CB SER A 53 -6.700 -1.700 -7.635 1.00 0.00 C ATOM 762 OG SER A 53 -7.708 -0.985 -8.328 1.00 0.00 O ATOM 0 H SER A 53 -4.223 -2.683 -6.965 1.00 0.00 H new ATOM 0 HA SER A 53 -5.404 -1.289 -9.299 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.903 -2.769 -7.693 1.00 0.00 H new ATOM 0 HB3 SER A 53 -6.718 -1.429 -6.579 1.00 0.00 H new ATOM 0 HG SER A 53 -8.583 -1.191 -7.937 1.00 0.00 H new ATOM 768 N LEU A 54 -4.050 0.647 -8.456 1.00 0.00 N ATOM 769 CA LEU A 54 -3.470 1.914 -8.021 1.00 0.00 C ATOM 770 C LEU A 54 -4.517 3.023 -8.032 1.00 0.00 C ATOM 771 O LEU A 54 -4.771 3.640 -9.067 1.00 0.00 O ATOM 772 CB LEU A 54 -2.296 2.295 -8.923 1.00 0.00 C ATOM 773 CG LEU A 54 -0.971 1.588 -8.636 1.00 0.00 C ATOM 774 CD1 LEU A 54 -0.488 1.910 -7.230 1.00 0.00 C ATOM 775 CD2 LEU A 54 -1.118 0.085 -8.819 1.00 0.00 C ATOM 0 H LEU A 54 -3.853 0.404 -9.427 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.110 1.790 -7.000 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.577 2.091 -9.956 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.136 3.370 -8.842 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.227 1.950 -9.346 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.456 1.398 -7.043 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.343 2.986 -7.133 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.231 1.577 -6.505 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.165 -0.402 -8.611 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.876 -0.293 -8.133 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.418 -0.129 -9.845 1.00 0.00 H new ATOM 787 N ARG A 55 -5.119 3.273 -6.874 1.00 0.00 N ATOM 788 CA ARG A 55 -6.137 4.310 -6.750 1.00 0.00 C ATOM 789 C ARG A 55 -5.553 5.574 -6.127 1.00 0.00 C ATOM 790 O ARG A 55 -5.367 5.649 -4.913 1.00 0.00 O ATOM 791 CB ARG A 55 -7.308 3.806 -5.905 1.00 0.00 C ATOM 792 CG ARG A 55 -8.463 4.789 -5.817 1.00 0.00 C ATOM 793 CD ARG A 55 -9.763 4.091 -5.448 1.00 0.00 C ATOM 794 NE ARG A 55 -9.950 4.011 -4.002 1.00 0.00 N ATOM 795 CZ ARG A 55 -10.164 5.070 -3.229 1.00 0.00 C ATOM 796 NH1 ARG A 55 -10.219 6.283 -3.761 1.00 0.00 N ATOM 797 NH2 ARG A 55 -10.325 4.916 -1.921 1.00 0.00 N ATOM 0 H ARG A 55 -4.920 2.772 -6.008 1.00 0.00 H new ATOM 0 HA ARG A 55 -6.497 4.552 -7.750 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -7.671 2.868 -6.326 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -6.951 3.587 -4.899 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -8.236 5.553 -5.074 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -8.581 5.299 -6.773 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -10.601 4.627 -5.893 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -9.767 3.086 -5.870 1.00 0.00 H new ATOM 0 HE ARG A 55 -9.914 3.092 -3.561 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -10.097 6.405 -4.766 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -10.383 7.094 -3.165 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.284 3.984 -1.508 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -10.489 5.730 -1.328 1.00 0.00 H new ATOM 811 N GLN A 56 -5.265 6.563 -6.967 1.00 0.00 N ATOM 812 CA GLN A 56 -4.701 7.823 -6.498 1.00 0.00 C ATOM 813 C GLN A 56 -5.743 8.935 -6.539 1.00 0.00 C ATOM 814 O GLN A 56 -6.360 9.183 -7.575 1.00 0.00 O ATOM 815 CB GLN A 56 -3.490 8.212 -7.348 1.00 0.00 C ATOM 816 CG GLN A 56 -2.195 7.552 -6.900 1.00 0.00 C ATOM 817 CD GLN A 56 -0.965 8.261 -7.431 1.00 0.00 C ATOM 818 OE1 GLN A 56 -0.098 7.645 -8.051 1.00 0.00 O ATOM 819 NE2 GLN A 56 -0.882 9.564 -7.189 1.00 0.00 N ATOM 0 H GLN A 56 -5.413 6.516 -7.975 1.00 0.00 H new ATOM 0 HA GLN A 56 -4.382 7.686 -5.465 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -3.684 7.944 -8.387 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -3.367 9.295 -7.316 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -2.158 7.535 -5.811 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.185 6.515 -7.235 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -1.624 10.035 -6.671 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -0.076 10.094 -7.521 1.00 0.00 H new ATOM 828 N ASP A 57 -5.935 9.601 -5.406 1.00 0.00 N ATOM 829 CA ASP A 57 -6.903 10.688 -5.312 1.00 0.00 C ATOM 830 C ASP A 57 -6.241 11.962 -4.797 1.00 0.00 C ATOM 831 O ASP A 57 -6.339 12.290 -3.615 1.00 0.00 O ATOM 832 CB ASP A 57 -8.060 10.292 -4.393 1.00 0.00 C ATOM 833 CG ASP A 57 -7.611 9.405 -3.247 1.00 0.00 C ATOM 834 OD1 ASP A 57 -7.161 8.272 -3.516 1.00 0.00 O ATOM 835 OD2 ASP A 57 -7.712 9.845 -2.083 1.00 0.00 O ATOM 0 H ASP A 57 -5.433 9.407 -4.539 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.293 10.881 -6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -8.526 11.192 -3.991 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -8.821 9.772 -4.975 1.00 0.00 H new ATOM 840 N GLY A 58 -5.566 12.677 -5.692 1.00 0.00 N ATOM 841 CA GLY A 58 -4.897 13.906 -5.309 1.00 0.00 C ATOM 842 C GLY A 58 -3.567 13.654 -4.628 1.00 0.00 C ATOM 843 O GLY A 58 -2.587 13.293 -5.279 1.00 0.00 O ATOM 0 H GLY A 58 -5.471 12.426 -6.676 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -4.737 14.520 -6.195 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.543 14.474 -4.639 1.00 0.00 H new ATOM 847 N ALA A 59 -3.531 13.845 -3.313 1.00 0.00 N ATOM 848 CA ALA A 59 -2.311 13.636 -2.543 1.00 0.00 C ATOM 849 C ALA A 59 -2.362 12.316 -1.782 1.00 0.00 C ATOM 850 O ALA A 59 -1.362 11.874 -1.217 1.00 0.00 O ATOM 851 CB ALA A 59 -2.089 14.794 -1.582 1.00 0.00 C ATOM 0 H ALA A 59 -4.333 14.144 -2.759 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.474 13.591 -3.240 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.175 14.625 -1.013 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.999 15.723 -2.146 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.934 14.866 -0.897 1.00 0.00 H new ATOM 857 N VAL A 60 -3.535 11.689 -1.771 1.00 0.00 N ATOM 858 CA VAL A 60 -3.716 10.419 -1.079 1.00 0.00 C ATOM 859 C VAL A 60 -3.663 9.249 -2.055 1.00 0.00 C ATOM 860 O VAL A 60 -4.544 9.094 -2.903 1.00 0.00 O ATOM 861 CB VAL A 60 -5.055 10.379 -0.319 1.00 0.00 C ATOM 862 CG1 VAL A 60 -5.180 9.089 0.476 1.00 0.00 C ATOM 863 CG2 VAL A 60 -5.187 11.591 0.591 1.00 0.00 C ATOM 0 H VAL A 60 -4.373 12.040 -2.234 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.898 10.329 -0.364 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.866 10.409 -1.046 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.132 9.079 1.006 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.134 8.237 -0.203 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.364 9.024 1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.139 11.547 1.120 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.370 11.595 1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.147 12.501 -0.007 1.00 0.00 H new ATOM 873 N CYS A 61 -2.627 8.428 -1.931 1.00 0.00 N ATOM 874 CA CYS A 61 -2.459 7.271 -2.803 1.00 0.00 C ATOM 875 C CYS A 61 -2.952 5.999 -2.121 1.00 0.00 C ATOM 876 O CYS A 61 -2.864 5.864 -0.901 1.00 0.00 O ATOM 877 CB CYS A 61 -0.990 7.114 -3.200 1.00 0.00 C ATOM 878 SG CYS A 61 -0.192 8.657 -3.701 1.00 0.00 S ATOM 0 H CYS A 61 -1.890 8.542 -1.235 1.00 0.00 H new ATOM 0 HA CYS A 61 -3.055 7.435 -3.701 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -0.441 6.690 -2.359 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -0.921 6.399 -4.020 1.00 0.00 H new ATOM 0 HG CYS A 61 0.740 8.401 -4.570 1.00 0.00 H new ATOM 884 N GLU A 62 -3.473 5.071 -2.917 1.00 0.00 N ATOM 885 CA GLU A 62 -3.984 3.811 -2.388 1.00 0.00 C ATOM 886 C GLU A 62 -3.685 2.659 -3.343 1.00 0.00 C ATOM 887 O GLU A 62 -3.875 2.777 -4.554 1.00 0.00 O ATOM 888 CB GLU A 62 -5.491 3.908 -2.143 1.00 0.00 C ATOM 889 CG GLU A 62 -6.087 2.660 -1.513 1.00 0.00 C ATOM 890 CD GLU A 62 -7.361 2.948 -0.742 1.00 0.00 C ATOM 891 OE1 GLU A 62 -7.336 3.841 0.130 1.00 0.00 O ATOM 892 OE2 GLU A 62 -8.381 2.280 -1.010 1.00 0.00 O ATOM 0 H GLU A 62 -3.553 5.167 -3.929 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.482 3.614 -1.441 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.691 4.762 -1.496 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.993 4.101 -3.091 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.296 1.928 -2.293 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.355 2.211 -0.842 1.00 0.00 H new ATOM 899 N LEU A 63 -3.217 1.546 -2.790 1.00 0.00 N ATOM 900 CA LEU A 63 -2.891 0.372 -3.592 1.00 0.00 C ATOM 901 C LEU A 63 -3.647 -0.855 -3.093 1.00 0.00 C ATOM 902 O LEU A 63 -3.527 -1.239 -1.929 1.00 0.00 O ATOM 903 CB LEU A 63 -1.385 0.106 -3.555 1.00 0.00 C ATOM 904 CG LEU A 63 -0.938 -1.287 -3.997 1.00 0.00 C ATOM 905 CD1 LEU A 63 -1.118 -1.455 -5.498 1.00 0.00 C ATOM 906 CD2 LEU A 63 0.511 -1.533 -3.601 1.00 0.00 C ATOM 0 H LEU A 63 -3.055 1.432 -1.790 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.194 0.570 -4.620 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.891 0.842 -4.189 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.032 0.273 -2.537 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.562 -2.025 -3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.794 -2.453 -5.794 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.169 -1.323 -5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.520 -0.709 -6.022 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.812 -2.530 -3.924 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.150 -0.789 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.610 -1.457 -2.518 1.00 0.00 H new ATOM 918 N GLN A 64 -4.424 -1.467 -3.981 1.00 0.00 N ATOM 919 CA GLN A 64 -5.198 -2.652 -3.630 1.00 0.00 C ATOM 920 C GLN A 64 -4.642 -3.891 -4.323 1.00 0.00 C ATOM 921 O GLN A 64 -4.574 -3.949 -5.551 1.00 0.00 O ATOM 922 CB GLN A 64 -6.668 -2.458 -4.009 1.00 0.00 C ATOM 923 CG GLN A 64 -7.633 -3.213 -3.110 1.00 0.00 C ATOM 924 CD GLN A 64 -8.944 -3.533 -3.800 1.00 0.00 C ATOM 925 OE1 GLN A 64 -8.979 -3.789 -5.004 1.00 0.00 O ATOM 926 NE2 GLN A 64 -10.032 -3.520 -3.039 1.00 0.00 N ATOM 0 H GLN A 64 -4.534 -1.162 -4.948 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.124 -2.797 -2.552 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.907 -1.395 -3.973 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -6.815 -2.783 -5.039 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -7.165 -4.140 -2.779 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -7.832 -2.620 -2.217 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -9.957 -3.303 -2.045 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -10.943 -3.728 -3.448 1.00 0.00 H new ATOM 935 N ILE A 65 -4.244 -4.879 -3.529 1.00 0.00 N ATOM 936 CA ILE A 65 -3.694 -6.117 -4.067 1.00 0.00 C ATOM 937 C ILE A 65 -4.758 -7.208 -4.133 1.00 0.00 C ATOM 938 O ILE A 65 -5.272 -7.652 -3.106 1.00 0.00 O ATOM 939 CB ILE A 65 -2.510 -6.621 -3.221 1.00 0.00 C ATOM 940 CG1 ILE A 65 -1.426 -5.545 -3.128 1.00 0.00 C ATOM 941 CG2 ILE A 65 -1.943 -7.902 -3.814 1.00 0.00 C ATOM 942 CD1 ILE A 65 -0.592 -5.635 -1.870 1.00 0.00 C ATOM 0 H ILE A 65 -4.292 -4.846 -2.511 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.342 -5.895 -5.074 1.00 0.00 H new ATOM 0 HB ILE A 65 -2.868 -6.837 -2.214 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.771 -5.625 -3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -1.896 -4.563 -3.173 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -1.107 -8.246 -3.205 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -2.718 -8.668 -3.833 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -1.597 -7.711 -4.830 1.00 0.00 H new ATOM 0 HD11 ILE A 65 0.156 -4.842 -1.872 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.236 -5.525 -0.998 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.093 -6.604 -1.832 1.00 0.00 H new ATOM 954 N HIS A 66 -5.082 -7.637 -5.349 1.00 0.00 N ATOM 955 CA HIS A 66 -6.083 -8.679 -5.550 1.00 0.00 C ATOM 956 C HIS A 66 -5.448 -10.064 -5.476 1.00 0.00 C ATOM 957 O HIS A 66 -4.471 -10.348 -6.169 1.00 0.00 O ATOM 958 CB HIS A 66 -6.777 -8.495 -6.900 1.00 0.00 C ATOM 959 CG HIS A 66 -7.801 -7.402 -6.902 1.00 0.00 C ATOM 960 ND1 HIS A 66 -8.013 -6.389 -7.774 1.00 0.00 N flip ATOM 961 CD2 HIS A 66 -8.759 -7.267 -5.920 1.00 0.00 C flip ATOM 962 CE1 HIS A 66 -9.085 -5.668 -7.308 1.00 0.00 C flip ATOM 963 NE2 HIS A 66 -9.517 -6.219 -6.188 1.00 0.00 N flip ATOM 0 H HIS A 66 -4.666 -7.280 -6.209 1.00 0.00 H new ATOM 0 HA HIS A 66 -6.824 -8.595 -4.755 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -6.025 -8.279 -7.659 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -7.257 -9.432 -7.184 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -8.872 -7.917 -5.065 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -9.506 -4.793 -7.780 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -10.302 -5.891 -5.626 1.00 0.00 H new ATOM 971 N GLY A 67 -6.009 -10.923 -4.630 1.00 0.00 N ATOM 972 CA GLY A 67 -5.483 -12.268 -4.481 1.00 0.00 C ATOM 973 C GLY A 67 -4.257 -12.315 -3.592 1.00 0.00 C ATOM 974 O GLY A 67 -3.130 -12.172 -4.068 1.00 0.00 O ATOM 0 H GLY A 67 -6.818 -10.712 -4.045 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -6.256 -12.913 -4.063 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -5.231 -12.667 -5.463 1.00 0.00 H new ATOM 978 N LEU A 68 -4.474 -12.516 -2.297 1.00 0.00 N ATOM 979 CA LEU A 68 -3.377 -12.580 -1.338 1.00 0.00 C ATOM 980 C LEU A 68 -2.878 -14.013 -1.177 1.00 0.00 C ATOM 981 O LEU A 68 -3.613 -14.968 -1.425 1.00 0.00 O ATOM 982 CB LEU A 68 -3.825 -12.029 0.017 1.00 0.00 C ATOM 983 CG LEU A 68 -3.696 -10.516 0.202 1.00 0.00 C ATOM 984 CD1 LEU A 68 -4.449 -10.064 1.443 1.00 0.00 C ATOM 985 CD2 LEU A 68 -2.231 -10.113 0.288 1.00 0.00 C ATOM 0 H LEU A 68 -5.400 -12.637 -1.887 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.558 -11.970 -1.719 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.868 -12.306 0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.244 -12.521 0.797 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.137 -10.024 -0.665 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.346 -8.985 1.558 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.504 -10.319 1.342 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.038 -10.564 2.320 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.158 -9.033 0.419 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.765 -10.614 1.136 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.720 -10.402 -0.630 1.00 0.00 H new ATOM 997 N ALA A 69 -1.625 -14.154 -0.758 1.00 0.00 N ATOM 998 CA ALA A 69 -1.029 -15.469 -0.559 1.00 0.00 C ATOM 999 C ALA A 69 0.316 -15.362 0.151 1.00 0.00 C ATOM 1000 O ALA A 69 0.920 -14.291 0.196 1.00 0.00 O ATOM 1001 CB ALA A 69 -0.868 -16.182 -1.894 1.00 0.00 C ATOM 0 H ALA A 69 -1.003 -13.373 -0.550 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.698 -16.051 0.074 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.422 -17.163 -1.731 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.845 -16.301 -2.363 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.222 -15.593 -2.545 1.00 0.00 H new ATOM 1007 N MET A 70 0.778 -16.477 0.706 1.00 0.00 N ATOM 1008 CA MET A 70 2.052 -16.507 1.414 1.00 0.00 C ATOM 1009 C MET A 70 3.137 -15.795 0.612 1.00 0.00 C ATOM 1010 O MET A 70 4.022 -15.155 1.179 1.00 0.00 O ATOM 1011 CB MET A 70 2.472 -17.952 1.692 1.00 0.00 C ATOM 1012 CG MET A 70 1.629 -18.636 2.756 1.00 0.00 C ATOM 1013 SD MET A 70 1.860 -17.917 4.393 1.00 0.00 S ATOM 1014 CE MET A 70 0.260 -17.158 4.659 1.00 0.00 C ATOM 0 H MET A 70 0.289 -17.372 0.679 1.00 0.00 H new ATOM 0 HA MET A 70 1.924 -15.985 2.362 1.00 0.00 H new ATOM 0 HB2 MET A 70 2.409 -18.524 0.767 1.00 0.00 H new ATOM 0 HB3 MET A 70 3.516 -17.965 2.004 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.577 -18.569 2.479 1.00 0.00 H new ATOM 0 HG3 MET A 70 1.883 -19.695 2.790 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.175 -16.842 5.699 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.156 -16.291 4.007 1.00 0.00 H new ATOM 0 HE3 MET A 70 -0.526 -17.878 4.433 1.00 0.00 H new ATOM 1024 N ALA A 71 3.062 -15.912 -0.710 1.00 0.00 N ATOM 1025 CA ALA A 71 4.036 -15.278 -1.589 1.00 0.00 C ATOM 1026 C ALA A 71 3.996 -13.760 -1.450 1.00 0.00 C ATOM 1027 O ALA A 71 5.029 -13.094 -1.509 1.00 0.00 O ATOM 1028 CB ALA A 71 3.786 -15.684 -3.034 1.00 0.00 C ATOM 0 H ALA A 71 2.337 -16.440 -1.195 1.00 0.00 H new ATOM 0 HA ALA A 71 5.029 -15.617 -1.294 1.00 0.00 H new ATOM 0 HB1 ALA A 71 4.521 -15.203 -3.679 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.874 -16.766 -3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.784 -15.374 -3.331 1.00 0.00 H new ATOM 1034 N ASP A 72 2.796 -13.220 -1.266 1.00 0.00 N ATOM 1035 CA ASP A 72 2.621 -11.779 -1.118 1.00 0.00 C ATOM 1036 C ASP A 72 3.291 -11.279 0.158 1.00 0.00 C ATOM 1037 O ASP A 72 3.744 -10.137 0.227 1.00 0.00 O ATOM 1038 CB ASP A 72 1.134 -11.424 -1.101 1.00 0.00 C ATOM 1039 CG ASP A 72 0.506 -11.497 -2.479 1.00 0.00 C ATOM 1040 OD1 ASP A 72 1.055 -12.211 -3.344 1.00 0.00 O ATOM 1041 OD2 ASP A 72 -0.535 -10.841 -2.693 1.00 0.00 O ATOM 0 H ASP A 72 1.931 -13.758 -1.216 1.00 0.00 H new ATOM 0 HA ASP A 72 3.093 -11.291 -1.970 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.609 -12.103 -0.429 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.008 -10.418 -0.700 1.00 0.00 H new ATOM 1046 N ASN A 73 3.348 -12.141 1.168 1.00 0.00 N ATOM 1047 CA ASN A 73 3.960 -11.786 2.443 1.00 0.00 C ATOM 1048 C ASN A 73 5.348 -11.189 2.232 1.00 0.00 C ATOM 1049 O ASN A 73 6.247 -11.849 1.713 1.00 0.00 O ATOM 1050 CB ASN A 73 4.054 -13.017 3.348 1.00 0.00 C ATOM 1051 CG ASN A 73 2.765 -13.814 3.375 1.00 0.00 C ATOM 1052 OD1 ASN A 73 1.930 -13.697 2.478 1.00 0.00 O ATOM 1053 ND2 ASN A 73 2.596 -14.631 4.408 1.00 0.00 N ATOM 0 H ASN A 73 2.978 -13.091 1.128 1.00 0.00 H new ATOM 0 HA ASN A 73 3.331 -11.037 2.924 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.866 -13.657 3.003 1.00 0.00 H new ATOM 0 HB3 ASN A 73 4.304 -12.702 4.361 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.748 -15.193 4.480 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.314 -14.697 5.129 1.00 0.00 H new ATOM 1060 N GLY A 74 5.515 -9.934 2.640 1.00 0.00 N ATOM 1061 CA GLY A 74 6.796 -9.269 2.488 1.00 0.00 C ATOM 1062 C GLY A 74 6.744 -7.811 2.901 1.00 0.00 C ATOM 1063 O GLY A 74 5.743 -7.348 3.448 1.00 0.00 O ATOM 0 H GLY A 74 4.786 -9.367 3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 74 7.544 -9.787 3.088 1.00 0.00 H new ATOM 0 HA3 GLY A 74 7.117 -9.338 1.449 1.00 0.00 H new ATOM 1067 N VAL A 75 7.827 -7.085 2.641 1.00 0.00 N ATOM 1068 CA VAL A 75 7.902 -5.672 2.990 1.00 0.00 C ATOM 1069 C VAL A 75 7.763 -4.792 1.752 1.00 0.00 C ATOM 1070 O VAL A 75 8.722 -4.598 1.005 1.00 0.00 O ATOM 1071 CB VAL A 75 9.228 -5.338 3.698 1.00 0.00 C ATOM 1072 CG1 VAL A 75 9.361 -3.837 3.903 1.00 0.00 C ATOM 1073 CG2 VAL A 75 9.325 -6.076 5.024 1.00 0.00 C ATOM 0 H VAL A 75 8.665 -7.453 2.190 1.00 0.00 H new ATOM 0 HA VAL A 75 7.075 -5.470 3.671 1.00 0.00 H new ATOM 0 HB VAL A 75 10.051 -5.668 3.064 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.304 -3.620 4.405 1.00 0.00 H new ATOM 0 HG12 VAL A 75 9.341 -3.334 2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.534 -3.479 4.516 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.268 -5.828 5.510 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.496 -5.779 5.667 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.280 -7.151 4.847 1.00 0.00 H new ATOM 1083 N TYR A 76 6.564 -4.262 1.542 1.00 0.00 N ATOM 1084 CA TYR A 76 6.298 -3.403 0.394 1.00 0.00 C ATOM 1085 C TYR A 76 7.023 -2.068 0.533 1.00 0.00 C ATOM 1086 O TYR A 76 7.539 -1.737 1.600 1.00 0.00 O ATOM 1087 CB TYR A 76 4.795 -3.167 0.244 1.00 0.00 C ATOM 1088 CG TYR A 76 4.032 -4.391 -0.211 1.00 0.00 C ATOM 1089 CD1 TYR A 76 3.888 -5.493 0.622 1.00 0.00 C ATOM 1090 CD2 TYR A 76 3.456 -4.445 -1.475 1.00 0.00 C ATOM 1091 CE1 TYR A 76 3.193 -6.614 0.211 1.00 0.00 C ATOM 1092 CE2 TYR A 76 2.758 -5.561 -1.894 1.00 0.00 C ATOM 1093 CZ TYR A 76 2.629 -6.642 -1.048 1.00 0.00 C ATOM 1094 OH TYR A 76 1.935 -7.756 -1.463 1.00 0.00 O ATOM 0 H TYR A 76 5.760 -4.412 2.152 1.00 0.00 H new ATOM 0 HA TYR A 76 6.670 -3.907 -0.498 1.00 0.00 H new ATOM 0 HB2 TYR A 76 4.391 -2.832 1.199 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.632 -2.361 -0.471 1.00 0.00 H new ATOM 0 HD1 TYR A 76 4.327 -5.473 1.609 1.00 0.00 H new ATOM 0 HD2 TYR A 76 3.556 -3.600 -2.141 1.00 0.00 H new ATOM 0 HE1 TYR A 76 3.092 -7.463 0.871 1.00 0.00 H new ATOM 0 HE2 TYR A 76 2.316 -5.587 -2.879 1.00 0.00 H new ATOM 0 HH TYR A 76 1.527 -8.195 -0.688 1.00 0.00 H new ATOM 1104 N SER A 77 7.056 -1.304 -0.555 1.00 0.00 N ATOM 1105 CA SER A 77 7.720 -0.006 -0.557 1.00 0.00 C ATOM 1106 C SER A 77 7.033 0.954 -1.524 1.00 0.00 C ATOM 1107 O SER A 77 6.362 0.529 -2.465 1.00 0.00 O ATOM 1108 CB SER A 77 9.193 -0.163 -0.937 1.00 0.00 C ATOM 1109 OG SER A 77 9.330 -0.761 -2.214 1.00 0.00 O ATOM 0 H SER A 77 6.631 -1.562 -1.446 1.00 0.00 H new ATOM 0 HA SER A 77 7.654 0.409 0.449 1.00 0.00 H new ATOM 0 HB2 SER A 77 9.678 0.813 -0.935 1.00 0.00 H new ATOM 0 HB3 SER A 77 9.701 -0.773 -0.190 1.00 0.00 H new ATOM 0 HG SER A 77 8.819 -1.597 -2.240 1.00 0.00 H new ATOM 1115 N CYS A 78 7.206 2.249 -1.285 1.00 0.00 N ATOM 1116 CA CYS A 78 6.603 3.270 -2.134 1.00 0.00 C ATOM 1117 C CYS A 78 7.513 4.488 -2.250 1.00 0.00 C ATOM 1118 O CYS A 78 7.692 5.237 -1.288 1.00 0.00 O ATOM 1119 CB CYS A 78 5.241 3.687 -1.576 1.00 0.00 C ATOM 1120 SG CYS A 78 4.105 4.347 -2.818 1.00 0.00 S ATOM 0 H CYS A 78 7.759 2.617 -0.511 1.00 0.00 H new ATOM 0 HA CYS A 78 6.466 2.846 -3.129 1.00 0.00 H new ATOM 0 HB2 CYS A 78 4.777 2.825 -1.097 1.00 0.00 H new ATOM 0 HB3 CYS A 78 5.392 4.439 -0.802 1.00 0.00 H new ATOM 0 HG CYS A 78 3.217 3.446 -3.116 1.00 0.00 H new ATOM 1126 N VAL A 79 8.088 4.681 -3.432 1.00 0.00 N ATOM 1127 CA VAL A 79 8.981 5.807 -3.674 1.00 0.00 C ATOM 1128 C VAL A 79 8.245 6.955 -4.357 1.00 0.00 C ATOM 1129 O VAL A 79 7.669 6.784 -5.432 1.00 0.00 O ATOM 1130 CB VAL A 79 10.184 5.394 -4.543 1.00 0.00 C ATOM 1131 CG1 VAL A 79 11.227 6.500 -4.572 1.00 0.00 C ATOM 1132 CG2 VAL A 79 10.787 4.094 -4.034 1.00 0.00 C ATOM 0 H VAL A 79 7.951 4.071 -4.238 1.00 0.00 H new ATOM 0 HA VAL A 79 9.343 6.138 -2.701 1.00 0.00 H new ATOM 0 HB VAL A 79 9.835 5.231 -5.563 1.00 0.00 H new ATOM 0 HG11 VAL A 79 12.069 6.190 -5.191 1.00 0.00 H new ATOM 0 HG12 VAL A 79 10.785 7.406 -4.988 1.00 0.00 H new ATOM 0 HG13 VAL A 79 11.575 6.698 -3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 79 11.636 3.817 -4.660 1.00 0.00 H new ATOM 0 HG22 VAL A 79 11.122 4.227 -3.005 1.00 0.00 H new ATOM 0 HG23 VAL A 79 10.036 3.305 -4.072 1.00 0.00 H new ATOM 1142 N CYS A 80 8.269 8.124 -3.726 1.00 0.00 N ATOM 1143 CA CYS A 80 7.604 9.301 -4.272 1.00 0.00 C ATOM 1144 C CYS A 80 8.624 10.317 -4.777 1.00 0.00 C ATOM 1145 O CYS A 80 8.521 11.509 -4.492 1.00 0.00 O ATOM 1146 CB CYS A 80 6.708 9.944 -3.213 1.00 0.00 C ATOM 1147 SG CYS A 80 7.608 10.640 -1.808 1.00 0.00 S ATOM 0 H CYS A 80 8.742 8.282 -2.836 1.00 0.00 H new ATOM 0 HA CYS A 80 6.989 8.982 -5.113 1.00 0.00 H new ATOM 0 HB2 CYS A 80 6.120 10.733 -3.681 1.00 0.00 H new ATOM 0 HB3 CYS A 80 6.004 9.197 -2.846 1.00 0.00 H new ATOM 0 HG CYS A 80 7.797 9.716 -0.913 1.00 0.00 H new ATOM 1153 N GLY A 81 9.610 9.835 -5.528 1.00 0.00 N ATOM 1154 CA GLY A 81 10.635 10.714 -6.058 1.00 0.00 C ATOM 1155 C GLY A 81 11.910 10.679 -5.239 1.00 0.00 C ATOM 1156 O GLY A 81 12.942 10.197 -5.706 1.00 0.00 O ATOM 0 H GLY A 81 9.717 8.852 -5.778 1.00 0.00 H new ATOM 0 HA2 GLY A 81 10.859 10.427 -7.086 1.00 0.00 H new ATOM 0 HA3 GLY A 81 10.254 11.735 -6.088 1.00 0.00 H new ATOM 1160 N GLN A 82 11.839 11.192 -4.015 1.00 0.00 N ATOM 1161 CA GLN A 82 12.998 11.219 -3.130 1.00 0.00 C ATOM 1162 C GLN A 82 12.766 10.344 -1.903 1.00 0.00 C ATOM 1163 O GLN A 82 13.427 9.321 -1.725 1.00 0.00 O ATOM 1164 CB GLN A 82 13.303 12.654 -2.698 1.00 0.00 C ATOM 1165 CG GLN A 82 13.672 13.572 -3.852 1.00 0.00 C ATOM 1166 CD GLN A 82 15.090 13.353 -4.341 1.00 0.00 C ATOM 1167 OE1 GLN A 82 15.418 12.294 -4.877 1.00 0.00 O ATOM 1168 NE2 GLN A 82 15.940 14.357 -4.159 1.00 0.00 N ATOM 0 H GLN A 82 10.992 11.594 -3.614 1.00 0.00 H new ATOM 0 HA GLN A 82 13.852 10.823 -3.679 1.00 0.00 H new ATOM 0 HB2 GLN A 82 12.433 13.062 -2.184 1.00 0.00 H new ATOM 0 HB3 GLN A 82 14.122 12.642 -1.979 1.00 0.00 H new ATOM 0 HG2 GLN A 82 12.978 13.410 -4.677 1.00 0.00 H new ATOM 0 HG3 GLN A 82 13.556 14.609 -3.538 1.00 0.00 H new ATOM 0 HE21 GLN A 82 15.625 15.217 -3.710 1.00 0.00 H new ATOM 0 HE22 GLN A 82 16.908 14.268 -4.468 1.00 0.00 H new ATOM 1177 N GLU A 83 11.824 10.753 -1.059 1.00 0.00 N ATOM 1178 CA GLU A 83 11.507 10.006 0.152 1.00 0.00 C ATOM 1179 C GLU A 83 10.908 8.645 -0.189 1.00 0.00 C ATOM 1180 O GLU A 83 9.965 8.549 -0.974 1.00 0.00 O ATOM 1181 CB GLU A 83 10.533 10.799 1.027 1.00 0.00 C ATOM 1182 CG GLU A 83 10.981 12.226 1.297 1.00 0.00 C ATOM 1183 CD GLU A 83 12.138 12.299 2.273 1.00 0.00 C ATOM 1184 OE1 GLU A 83 13.208 11.731 1.969 1.00 0.00 O ATOM 1185 OE2 GLU A 83 11.974 12.925 3.341 1.00 0.00 O ATOM 0 H GLU A 83 11.267 11.597 -1.192 1.00 0.00 H new ATOM 0 HA GLU A 83 12.434 9.848 0.703 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.557 10.819 0.543 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.407 10.281 1.978 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.273 12.695 0.357 1.00 0.00 H new ATOM 0 HG3 GLU A 83 10.141 12.798 1.691 1.00 0.00 H new ATOM 1192 N ARG A 84 11.464 7.594 0.406 1.00 0.00 N ATOM 1193 CA ARG A 84 10.987 6.238 0.164 1.00 0.00 C ATOM 1194 C ARG A 84 10.448 5.614 1.448 1.00 0.00 C ATOM 1195 O ARG A 84 11.167 5.490 2.440 1.00 0.00 O ATOM 1196 CB ARG A 84 12.113 5.372 -0.403 1.00 0.00 C ATOM 1197 CG ARG A 84 11.879 3.880 -0.233 1.00 0.00 C ATOM 1198 CD ARG A 84 12.940 3.064 -0.954 1.00 0.00 C ATOM 1199 NE ARG A 84 14.240 3.150 -0.294 1.00 0.00 N ATOM 1200 CZ ARG A 84 15.305 2.454 -0.674 1.00 0.00 C ATOM 1201 NH1 ARG A 84 15.225 1.625 -1.706 1.00 0.00 N ATOM 1202 NH2 ARG A 84 16.453 2.586 -0.023 1.00 0.00 N ATOM 0 H ARG A 84 12.245 7.656 1.059 1.00 0.00 H new ATOM 0 HA ARG A 84 10.176 6.289 -0.563 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.232 5.594 -1.464 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.049 5.642 0.086 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.883 3.628 0.828 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.893 3.619 -0.618 1.00 0.00 H new ATOM 0 HD2 ARG A 84 12.626 2.021 -1.001 1.00 0.00 H new ATOM 0 HD3 ARG A 84 13.031 3.416 -1.982 1.00 0.00 H new ATOM 0 HE ARG A 84 14.335 3.780 0.503 1.00 0.00 H new ATOM 0 HH11 ARG A 84 14.344 1.521 -2.210 1.00 0.00 H new ATOM 0 HH12 ARG A 84 16.044 1.091 -1.996 1.00 0.00 H new ATOM 0 HH21 ARG A 84 16.519 3.223 0.771 1.00 0.00 H new ATOM 0 HH22 ARG A 84 17.270 2.051 -0.316 1.00 0.00 H new ATOM 1216 N THR A 85 9.178 5.223 1.422 1.00 0.00 N ATOM 1217 CA THR A 85 8.542 4.614 2.583 1.00 0.00 C ATOM 1218 C THR A 85 8.361 3.114 2.387 1.00 0.00 C ATOM 1219 O THR A 85 8.203 2.640 1.262 1.00 0.00 O ATOM 1220 CB THR A 85 7.169 5.252 2.871 1.00 0.00 C ATOM 1221 OG1 THR A 85 6.525 4.563 3.949 1.00 0.00 O ATOM 1222 CG2 THR A 85 6.283 5.211 1.635 1.00 0.00 C ATOM 0 H THR A 85 8.569 5.317 0.609 1.00 0.00 H new ATOM 0 HA THR A 85 9.202 4.790 3.433 1.00 0.00 H new ATOM 0 HB THR A 85 7.328 6.294 3.150 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.642 5.071 4.779 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.319 5.667 1.863 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.762 5.761 0.825 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.131 4.176 1.330 1.00 0.00 H new ATOM 1230 N SER A 86 8.383 2.370 3.489 1.00 0.00 N ATOM 1231 CA SER A 86 8.224 0.922 3.437 1.00 0.00 C ATOM 1232 C SER A 86 7.226 0.447 4.488 1.00 0.00 C ATOM 1233 O SER A 86 6.978 1.133 5.480 1.00 0.00 O ATOM 1234 CB SER A 86 9.573 0.232 3.649 1.00 0.00 C ATOM 1235 OG SER A 86 9.598 -1.041 3.028 1.00 0.00 O ATOM 0 H SER A 86 8.509 2.747 4.428 1.00 0.00 H new ATOM 0 HA SER A 86 7.840 0.658 2.452 1.00 0.00 H new ATOM 0 HB2 SER A 86 10.371 0.854 3.243 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.766 0.123 4.716 1.00 0.00 H new ATOM 0 HG SER A 86 8.681 -1.328 2.833 1.00 0.00 H new ATOM 1241 N ALA A 87 6.656 -0.733 4.264 1.00 0.00 N ATOM 1242 CA ALA A 87 5.687 -1.302 5.192 1.00 0.00 C ATOM 1243 C ALA A 87 5.699 -2.825 5.133 1.00 0.00 C ATOM 1244 O ALA A 87 6.237 -3.417 4.196 1.00 0.00 O ATOM 1245 CB ALA A 87 4.293 -0.771 4.890 1.00 0.00 C ATOM 0 H ALA A 87 6.849 -1.313 3.448 1.00 0.00 H new ATOM 0 HA ALA A 87 5.968 -1.002 6.201 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.579 -1.204 5.591 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.287 0.314 4.991 1.00 0.00 H new ATOM 0 HB3 ALA A 87 4.013 -1.042 3.872 1.00 0.00 H new ATOM 1251 N THR A 88 5.102 -3.457 6.139 1.00 0.00 N ATOM 1252 CA THR A 88 5.045 -4.912 6.202 1.00 0.00 C ATOM 1253 C THR A 88 3.605 -5.409 6.157 1.00 0.00 C ATOM 1254 O THR A 88 2.757 -4.956 6.928 1.00 0.00 O ATOM 1255 CB THR A 88 5.721 -5.445 7.479 1.00 0.00 C ATOM 1256 OG1 THR A 88 7.050 -4.923 7.585 1.00 0.00 O ATOM 1257 CG2 THR A 88 5.768 -6.966 7.472 1.00 0.00 C ATOM 0 H THR A 88 4.651 -2.983 6.922 1.00 0.00 H new ATOM 0 HA THR A 88 5.582 -5.287 5.331 1.00 0.00 H new ATOM 0 HB THR A 88 5.133 -5.119 8.337 1.00 0.00 H new ATOM 0 HG1 THR A 88 7.472 -5.266 8.401 1.00 0.00 H new ATOM 0 HG21 THR A 88 6.250 -7.319 8.384 1.00 0.00 H new ATOM 0 HG22 THR A 88 4.753 -7.361 7.421 1.00 0.00 H new ATOM 0 HG23 THR A 88 6.335 -7.309 6.606 1.00 0.00 H new ATOM 1265 N LEU A 89 3.334 -6.342 5.252 1.00 0.00 N ATOM 1266 CA LEU A 89 1.995 -6.902 5.108 1.00 0.00 C ATOM 1267 C LEU A 89 1.915 -8.292 5.730 1.00 0.00 C ATOM 1268 O LEU A 89 2.770 -9.144 5.485 1.00 0.00 O ATOM 1269 CB LEU A 89 1.605 -6.970 3.630 1.00 0.00 C ATOM 1270 CG LEU A 89 0.300 -7.699 3.312 1.00 0.00 C ATOM 1271 CD1 LEU A 89 -0.897 -6.841 3.691 1.00 0.00 C ATOM 1272 CD2 LEU A 89 0.243 -8.075 1.839 1.00 0.00 C ATOM 0 H LEU A 89 4.024 -6.727 4.607 1.00 0.00 H new ATOM 0 HA LEU A 89 1.298 -6.249 5.633 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.531 -5.952 3.247 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.412 -7.458 3.084 1.00 0.00 H new ATOM 0 HG LEU A 89 0.266 -8.615 3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.817 -7.377 3.457 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.865 -6.623 4.759 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.868 -5.907 3.129 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.693 -8.593 1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.301 -7.172 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.081 -8.729 1.598 1.00 0.00 H new ATOM 1284 N THR A 90 0.882 -8.516 6.536 1.00 0.00 N ATOM 1285 CA THR A 90 0.690 -9.803 7.193 1.00 0.00 C ATOM 1286 C THR A 90 -0.462 -10.576 6.561 1.00 0.00 C ATOM 1287 O THR A 90 -1.600 -10.107 6.538 1.00 0.00 O ATOM 1288 CB THR A 90 0.412 -9.629 8.698 1.00 0.00 C ATOM 1289 OG1 THR A 90 1.616 -9.261 9.380 1.00 0.00 O ATOM 1290 CG2 THR A 90 -0.144 -10.912 9.298 1.00 0.00 C ATOM 0 H THR A 90 0.165 -7.822 6.750 1.00 0.00 H new ATOM 0 HA THR A 90 1.615 -10.365 7.064 1.00 0.00 H new ATOM 0 HB THR A 90 -0.329 -8.839 8.818 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.430 -9.151 10.336 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.332 -10.765 10.361 1.00 0.00 H new ATOM 0 HG22 THR A 90 -1.076 -11.174 8.797 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.578 -11.718 9.166 1.00 0.00 H new ATOM 1298 N VAL A 91 -0.160 -11.765 6.050 1.00 0.00 N ATOM 1299 CA VAL A 91 -1.171 -12.606 5.419 1.00 0.00 C ATOM 1300 C VAL A 91 -1.420 -13.870 6.233 1.00 0.00 C ATOM 1301 O VAL A 91 -0.671 -14.842 6.134 1.00 0.00 O ATOM 1302 CB VAL A 91 -0.758 -13.002 3.989 1.00 0.00 C ATOM 1303 CG1 VAL A 91 -1.832 -13.864 3.343 1.00 0.00 C ATOM 1304 CG2 VAL A 91 -0.484 -11.762 3.151 1.00 0.00 C ATOM 0 H VAL A 91 0.777 -12.168 6.060 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.089 -12.019 5.375 1.00 0.00 H new ATOM 0 HB VAL A 91 0.160 -13.587 4.043 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.523 -14.134 2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.976 -14.769 3.933 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.768 -13.307 3.299 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.193 -12.060 2.144 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.384 -11.149 3.103 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.322 -11.187 3.606 1.00 0.00 H new ATOM 1314 N ARG A 92 -2.477 -13.851 7.038 1.00 0.00 N ATOM 1315 CA ARG A 92 -2.826 -14.996 7.870 1.00 0.00 C ATOM 1316 C ARG A 92 -3.444 -16.110 7.030 1.00 0.00 C ATOM 1317 O ARG A 92 -4.422 -15.893 6.316 1.00 0.00 O ATOM 1318 CB ARG A 92 -3.798 -14.575 8.973 1.00 0.00 C ATOM 1319 CG ARG A 92 -3.132 -13.836 10.122 1.00 0.00 C ATOM 1320 CD ARG A 92 -4.041 -13.764 11.340 1.00 0.00 C ATOM 1321 NE ARG A 92 -3.328 -13.305 12.529 1.00 0.00 N ATOM 1322 CZ ARG A 92 -2.516 -14.077 13.243 1.00 0.00 C ATOM 1323 NH1 ARG A 92 -2.316 -15.339 12.889 1.00 0.00 N ATOM 1324 NH2 ARG A 92 -1.903 -13.587 14.312 1.00 0.00 N ATOM 0 H ARG A 92 -3.107 -13.054 7.132 1.00 0.00 H new ATOM 0 HA ARG A 92 -1.911 -15.374 8.327 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -4.570 -13.938 8.541 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.298 -15.462 9.363 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.203 -14.339 10.389 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -2.868 -12.828 9.803 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.872 -13.090 11.133 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.469 -14.748 11.531 1.00 0.00 H new ATOM 0 HE ARG A 92 -3.461 -12.339 12.828 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.786 -15.719 12.067 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -1.692 -15.930 13.438 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -2.055 -12.617 14.587 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -1.280 -14.181 14.859 1.00 0.00 H new ATOM 1338 N ALA A 93 -2.865 -17.303 7.122 1.00 0.00 N ATOM 1339 CA ALA A 93 -3.360 -18.451 6.372 1.00 0.00 C ATOM 1340 C ALA A 93 -4.738 -18.878 6.867 1.00 0.00 C ATOM 1341 O ALA A 93 -4.913 -19.208 8.041 1.00 0.00 O ATOM 1342 CB ALA A 93 -2.379 -19.610 6.474 1.00 0.00 C ATOM 0 H ALA A 93 -2.054 -17.499 7.708 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.453 -18.158 5.326 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.761 -20.461 5.910 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.415 -19.307 6.066 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.258 -19.893 7.520 1.00 0.00 H new ATOM 1348 N LEU A 94 -5.714 -18.868 5.966 1.00 0.00 N ATOM 1349 CA LEU A 94 -7.078 -19.253 6.311 1.00 0.00 C ATOM 1350 C LEU A 94 -7.101 -20.614 7.000 1.00 0.00 C ATOM 1351 O LEU A 94 -6.223 -21.453 6.801 1.00 0.00 O ATOM 1352 CB LEU A 94 -7.952 -19.289 5.056 1.00 0.00 C ATOM 1353 CG LEU A 94 -8.310 -17.933 4.448 1.00 0.00 C ATOM 1354 CD1 LEU A 94 -8.835 -18.104 3.031 1.00 0.00 C ATOM 1355 CD2 LEU A 94 -9.333 -17.213 5.315 1.00 0.00 C ATOM 0 H LEU A 94 -5.586 -18.597 4.991 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.476 -18.509 7.002 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.439 -19.881 4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.877 -19.812 5.297 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.406 -17.325 4.407 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.084 -17.128 2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.071 -18.577 2.414 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.727 -18.730 3.047 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.576 -16.250 4.867 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.237 -17.817 5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.919 -17.056 6.311 1.00 0.00 H new ATOM 1367 N PRO A 95 -8.131 -20.840 7.829 1.00 0.00 N ATOM 1368 CA PRO A 95 -8.296 -22.098 8.563 1.00 0.00 C ATOM 1369 C PRO A 95 -8.653 -23.262 7.644 1.00 0.00 C ATOM 1370 O PRO A 95 -9.025 -23.061 6.489 1.00 0.00 O ATOM 1371 CB PRO A 95 -9.451 -21.801 9.523 1.00 0.00 C ATOM 1372 CG PRO A 95 -10.223 -20.713 8.861 1.00 0.00 C ATOM 1373 CD PRO A 95 -9.215 -19.884 8.114 1.00 0.00 C ATOM 0 HA PRO A 95 -7.376 -22.402 9.063 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -10.069 -22.684 9.684 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -9.083 -21.488 10.500 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -10.971 -21.123 8.182 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.756 -20.110 9.596 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -9.636 -19.469 7.198 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -8.863 -19.044 8.713 1.00 0.00 H new ATOM 1381 N ALA A 96 -8.538 -24.479 8.166 1.00 0.00 N ATOM 1382 CA ALA A 96 -8.851 -25.674 7.394 1.00 0.00 C ATOM 1383 C ALA A 96 -9.007 -26.889 8.301 1.00 0.00 C ATOM 1384 O ALA A 96 -8.236 -27.076 9.243 1.00 0.00 O ATOM 1385 CB ALA A 96 -7.772 -25.927 6.351 1.00 0.00 C ATOM 0 H ALA A 96 -8.230 -24.663 9.121 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.801 -25.509 6.886 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.019 -26.823 5.782 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.711 -25.073 5.676 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.812 -26.066 6.847 1.00 0.00 H new ATOM 1391 N ARG A 97 -10.010 -27.712 8.013 1.00 0.00 N ATOM 1392 CA ARG A 97 -10.268 -28.909 8.806 1.00 0.00 C ATOM 1393 C ARG A 97 -10.794 -30.040 7.927 1.00 0.00 C ATOM 1394 O ARG A 97 -11.809 -29.891 7.246 1.00 0.00 O ATOM 1395 CB ARG A 97 -11.274 -28.603 9.917 1.00 0.00 C ATOM 1396 CG ARG A 97 -11.579 -29.797 10.807 1.00 0.00 C ATOM 1397 CD ARG A 97 -12.779 -29.531 11.703 1.00 0.00 C ATOM 1398 NE ARG A 97 -13.157 -30.711 12.475 1.00 0.00 N ATOM 1399 CZ ARG A 97 -13.853 -30.658 13.606 1.00 0.00 C ATOM 1400 NH1 ARG A 97 -14.244 -29.488 14.093 1.00 0.00 N ATOM 1401 NH2 ARG A 97 -14.158 -31.776 14.252 1.00 0.00 N ATOM 0 H ARG A 97 -10.657 -27.572 7.237 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.327 -29.227 9.254 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.887 -27.791 10.533 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.202 -28.248 9.468 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.772 -30.673 10.188 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.708 -30.026 11.421 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.549 -28.711 12.383 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -13.624 -29.211 11.093 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.871 -31.626 12.127 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -14.011 -28.626 13.599 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -14.778 -29.450 14.961 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.858 -32.678 13.881 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.692 -31.734 15.120 1.00 0.00 H new ATOM 1415 N PHE A 98 -10.095 -31.170 7.946 1.00 0.00 N ATOM 1416 CA PHE A 98 -10.490 -32.326 7.149 1.00 0.00 C ATOM 1417 C PHE A 98 -11.596 -33.114 7.845 1.00 0.00 C ATOM 1418 O PHE A 98 -11.395 -33.660 8.931 1.00 0.00 O ATOM 1419 CB PHE A 98 -9.284 -33.234 6.896 1.00 0.00 C ATOM 1420 CG PHE A 98 -9.024 -34.209 8.008 1.00 0.00 C ATOM 1421 CD1 PHE A 98 -8.219 -33.859 9.080 1.00 0.00 C ATOM 1422 CD2 PHE A 98 -9.584 -35.476 7.981 1.00 0.00 C ATOM 1423 CE1 PHE A 98 -7.978 -34.755 10.105 1.00 0.00 C ATOM 1424 CE2 PHE A 98 -9.346 -36.376 9.003 1.00 0.00 C ATOM 1425 CZ PHE A 98 -8.541 -36.015 10.066 1.00 0.00 C ATOM 0 H PHE A 98 -9.253 -31.310 8.504 1.00 0.00 H new ATOM 0 HA PHE A 98 -10.871 -31.964 6.194 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.443 -33.786 5.970 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.398 -32.616 6.751 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -7.775 -32.875 9.115 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -10.214 -35.764 7.152 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -7.350 -34.469 10.936 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -9.789 -37.360 8.970 1.00 0.00 H new ATOM 0 HZ PHE A 98 -8.352 -36.717 10.865 1.00 0.00 H new ATOM 1435 N ILE A 99 -12.764 -33.167 7.214 1.00 0.00 N ATOM 1436 CA ILE A 99 -13.901 -33.888 7.771 1.00 0.00 C ATOM 1437 C ILE A 99 -14.869 -34.321 6.675 1.00 0.00 C ATOM 1438 O ILE A 99 -15.019 -33.638 5.662 1.00 0.00 O ATOM 1439 CB ILE A 99 -14.660 -33.031 8.802 1.00 0.00 C ATOM 1440 CG1 ILE A 99 -15.797 -33.839 9.431 1.00 0.00 C ATOM 1441 CG2 ILE A 99 -15.200 -31.769 8.146 1.00 0.00 C ATOM 1442 CD1 ILE A 99 -16.239 -33.313 10.778 1.00 0.00 C ATOM 0 H ILE A 99 -12.948 -32.719 6.316 1.00 0.00 H new ATOM 0 HA ILE A 99 -13.501 -34.772 8.268 1.00 0.00 H new ATOM 0 HB ILE A 99 -13.967 -32.739 9.591 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -16.650 -33.839 8.753 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -15.477 -34.875 9.542 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -15.734 -31.174 8.887 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -14.372 -31.187 7.741 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -15.881 -32.041 7.340 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -17.047 -33.934 11.164 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -15.399 -33.338 11.472 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -16.590 -32.287 10.671 1.00 0.00 H new ATOM 1454 N GLU A 100 -15.524 -35.458 6.887 1.00 0.00 N ATOM 1455 CA GLU A 100 -16.479 -35.980 5.916 1.00 0.00 C ATOM 1456 C GLU A 100 -17.912 -35.680 6.346 1.00 0.00 C ATOM 1457 O GLU A 100 -18.707 -35.151 5.569 1.00 0.00 O ATOM 1458 CB GLU A 100 -16.292 -37.489 5.745 1.00 0.00 C ATOM 1459 CG GLU A 100 -17.296 -38.124 4.798 1.00 0.00 C ATOM 1460 CD GLU A 100 -16.928 -37.928 3.340 1.00 0.00 C ATOM 1461 OE1 GLU A 100 -16.152 -36.996 3.043 1.00 0.00 O ATOM 1462 OE2 GLU A 100 -17.416 -38.708 2.496 1.00 0.00 O ATOM 0 H GLU A 100 -15.411 -36.035 7.721 1.00 0.00 H new ATOM 0 HA GLU A 100 -16.294 -35.487 4.962 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.285 -37.682 5.376 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.371 -37.969 6.720 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -17.366 -39.191 5.011 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -18.282 -37.697 4.980 1.00 0.00 H new ATOM 1469 N ASP A 101 -18.234 -36.022 7.589 1.00 0.00 N ATOM 1470 CA ASP A 101 -19.570 -35.790 8.124 1.00 0.00 C ATOM 1471 C ASP A 101 -19.512 -35.479 9.616 1.00 0.00 C ATOM 1472 O ASP A 101 -18.650 -35.987 10.333 1.00 0.00 O ATOM 1473 CB ASP A 101 -20.461 -37.009 7.879 1.00 0.00 C ATOM 1474 CG ASP A 101 -21.832 -36.861 8.508 1.00 0.00 C ATOM 1475 OD1 ASP A 101 -22.389 -35.743 8.462 1.00 0.00 O ATOM 1476 OD2 ASP A 101 -22.348 -37.862 9.046 1.00 0.00 O ATOM 0 H ASP A 101 -17.588 -36.461 8.245 1.00 0.00 H new ATOM 0 HA ASP A 101 -19.996 -34.929 7.608 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.572 -37.164 6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -19.974 -37.898 8.281 1.00 0.00 H new ATOM 1481 N SER A 102 -20.434 -34.640 10.077 1.00 0.00 N ATOM 1482 CA SER A 102 -20.484 -34.257 11.484 1.00 0.00 C ATOM 1483 C SER A 102 -20.066 -35.420 12.378 1.00 0.00 C ATOM 1484 O SER A 102 -19.249 -35.259 13.284 1.00 0.00 O ATOM 1485 CB SER A 102 -21.893 -33.792 11.857 1.00 0.00 C ATOM 1486 OG SER A 102 -21.922 -33.259 13.170 1.00 0.00 O ATOM 0 H SER A 102 -21.156 -34.212 9.497 1.00 0.00 H new ATOM 0 HA SER A 102 -19.785 -33.435 11.637 1.00 0.00 H new ATOM 0 HB2 SER A 102 -22.230 -33.037 11.147 1.00 0.00 H new ATOM 0 HB3 SER A 102 -22.587 -34.630 11.785 1.00 0.00 H new ATOM 0 HG SER A 102 -22.833 -32.967 13.385 1.00 0.00 H new ATOM 1492 N GLY A 103 -20.634 -36.593 12.117 1.00 0.00 N ATOM 1493 CA GLY A 103 -20.308 -37.767 12.906 1.00 0.00 C ATOM 1494 C GLY A 103 -21.439 -38.776 12.937 1.00 0.00 C ATOM 1495 O GLY A 103 -22.617 -38.421 12.917 1.00 0.00 O ATOM 0 H GLY A 103 -21.314 -36.752 11.373 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -19.415 -38.239 12.497 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -20.069 -37.462 13.925 1.00 0.00 H new ATOM 1499 N PRO A 104 -21.082 -40.069 12.986 1.00 0.00 N ATOM 1500 CA PRO A 104 -22.061 -41.159 13.020 1.00 0.00 C ATOM 1501 C PRO A 104 -22.820 -41.217 14.341 1.00 0.00 C ATOM 1502 O PRO A 104 -22.241 -41.510 15.388 1.00 0.00 O ATOM 1503 CB PRO A 104 -21.202 -42.413 12.841 1.00 0.00 C ATOM 1504 CG PRO A 104 -19.854 -42.023 13.342 1.00 0.00 C ATOM 1505 CD PRO A 104 -19.696 -40.564 13.013 1.00 0.00 C ATOM 0 HA PRO A 104 -22.830 -41.040 12.257 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -21.606 -43.254 13.405 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -21.162 -42.720 11.796 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -19.773 -42.192 14.416 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -19.074 -42.617 12.866 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -19.099 -40.045 13.763 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -19.199 -40.420 12.054 1.00 0.00 H new ATOM 1513 N SER A 105 -24.118 -40.936 14.286 1.00 0.00 N ATOM 1514 CA SER A 105 -24.955 -40.953 15.480 1.00 0.00 C ATOM 1515 C SER A 105 -26.011 -42.050 15.388 1.00 0.00 C ATOM 1516 O SER A 105 -27.059 -41.867 14.769 1.00 0.00 O ATOM 1517 CB SER A 105 -25.630 -39.594 15.675 1.00 0.00 C ATOM 1518 OG SER A 105 -24.679 -38.592 15.989 1.00 0.00 O ATOM 0 H SER A 105 -24.613 -40.694 13.428 1.00 0.00 H new ATOM 0 HA SER A 105 -24.316 -41.160 16.339 1.00 0.00 H new ATOM 0 HB2 SER A 105 -26.167 -39.318 14.768 1.00 0.00 H new ATOM 0 HB3 SER A 105 -26.368 -39.662 16.474 1.00 0.00 H new ATOM 0 HG SER A 105 -25.136 -37.733 16.107 1.00 0.00 H new ATOM 1524 N SER A 106 -25.727 -43.191 16.008 1.00 0.00 N ATOM 1525 CA SER A 106 -26.649 -44.320 15.993 1.00 0.00 C ATOM 1526 C SER A 106 -26.595 -45.083 17.313 1.00 0.00 C ATOM 1527 O SER A 106 -25.684 -44.890 18.118 1.00 0.00 O ATOM 1528 CB SER A 106 -26.319 -45.260 14.833 1.00 0.00 C ATOM 1529 OG SER A 106 -27.351 -46.212 14.638 1.00 0.00 O ATOM 0 H SER A 106 -24.865 -43.358 16.527 1.00 0.00 H new ATOM 0 HA SER A 106 -27.658 -43.931 15.859 1.00 0.00 H new ATOM 0 HB2 SER A 106 -26.177 -44.681 13.921 1.00 0.00 H new ATOM 0 HB3 SER A 106 -25.379 -45.774 15.034 1.00 0.00 H new ATOM 0 HG SER A 106 -27.117 -46.800 13.890 1.00 0.00 H new ATOM 1535 N GLY A 107 -27.578 -45.952 17.528 1.00 0.00 N ATOM 1536 CA GLY A 107 -27.624 -46.732 18.751 1.00 0.00 C ATOM 1537 C GLY A 107 -27.221 -45.925 19.969 1.00 0.00 C ATOM 1538 O GLY A 107 -26.177 -46.178 20.571 1.00 0.00 O ATOM 0 H GLY A 107 -28.343 -46.130 16.877 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -28.633 -47.120 18.893 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -26.962 -47.593 18.654 1.00 0.00 H new TER 1542 GLY A 107