USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 754 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 77 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 90 GLN : amide:sc=-0.00624 X(o=-0.0062,f=-0.44) USER MOD Set 2.1: A 25 THR OG1 : rot 180:sc= -0.48 USER MOD Set 2.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 30 CYS SG : rot -5:sc= -0.154 USER MOD Set 3.2: A 80 CYS SG : rot 118:sc= 0.085 USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0666 (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 9 ASN : amide:sc= -4.21! C(o=-4.2!,f=-3.5!) USER MOD Single : A 10 CYS SG : rot 180:sc= 0.145 USER MOD Single : A 12 THR OG1 : rot -150:sc= -1.09 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.231 K(o=-0.23,f=0.27) USER MOD Single : A 19 GLN : amide:sc= -1.62! K(o=-1.6!,f=-0.29) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0118 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 120:sc= 0.0746 USER MOD Single : A 34 HIS : no HD1:sc= -1.54 X(o=-1.5,f=-1.8!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -70:sc= 0.117 USER MOD Single : A 53 LYS NZ :NH3+ -160:sc= 0.0696 (180deg=-0.29) USER MOD Single : A 54 HIS : no HD1:sc= -0.824 X(o=-0.82,f=-0.58) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc=-0.00866 USER MOD Single : A 58 GLN : amide:sc= 0.444 X(o=0.44,f=0) USER MOD Single : A 62 THR OG1 : rot 84:sc= 1.22 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot -91:sc= 0.758 USER MOD Single : A 78 TYR OH : rot -8:sc= 1.11 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0344 USER MOD Single : A 84 GLN : amide:sc= -1.26 K(o=-1.3,f=-4.2!) USER MOD Single : A 86 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.7!) USER MOD Single : A 87 SER OG : rot 90:sc= -1.25 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 98 SER OG : rot 16:sc= 1 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 58:sc=0.000626 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.343 29.542 -9.638 1.00 0.00 N ATOM 2 CA GLY A 1 10.426 30.498 -9.504 1.00 0.00 C ATOM 3 C GLY A 1 10.789 30.764 -8.056 1.00 0.00 C ATOM 4 O GLY A 1 10.432 29.990 -7.167 1.00 0.00 O ATOM 0 H1 GLY A 1 9.633 28.777 -10.280 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.114 29.143 -8.705 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.504 30.020 -10.025 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.303 30.125 -10.033 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.140 31.435 -9.982 1.00 0.00 H new ATOM 8 N SER A 2 11.502 31.860 -7.818 1.00 0.00 N ATOM 9 CA SER A 2 11.918 32.223 -6.468 1.00 0.00 C ATOM 10 C SER A 2 10.708 32.506 -5.584 1.00 0.00 C ATOM 11 O SER A 2 10.603 31.991 -4.471 1.00 0.00 O ATOM 12 CB SER A 2 12.834 33.447 -6.506 1.00 0.00 C ATOM 13 OG SER A 2 14.192 33.064 -6.641 1.00 0.00 O ATOM 0 H SER A 2 11.804 32.512 -8.542 1.00 0.00 H new ATOM 0 HA SER A 2 12.466 31.381 -6.045 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.550 34.092 -7.338 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.706 34.029 -5.593 1.00 0.00 H new ATOM 0 HG SER A 2 14.757 33.864 -6.665 1.00 0.00 H new ATOM 19 N SER A 3 9.794 33.330 -6.089 1.00 0.00 N ATOM 20 CA SER A 3 8.592 33.686 -5.344 1.00 0.00 C ATOM 21 C SER A 3 7.421 32.795 -5.745 1.00 0.00 C ATOM 22 O SER A 3 6.853 32.945 -6.826 1.00 0.00 O ATOM 23 CB SER A 3 8.235 35.155 -5.584 1.00 0.00 C ATOM 24 OG SER A 3 7.294 35.613 -4.629 1.00 0.00 O ATOM 0 H SER A 3 9.863 33.763 -7.010 1.00 0.00 H new ATOM 0 HA SER A 3 8.794 33.536 -4.283 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.137 35.765 -5.532 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.827 35.274 -6.588 1.00 0.00 H new ATOM 0 HG SER A 3 7.083 36.554 -4.803 1.00 0.00 H new ATOM 30 N GLY A 4 7.064 31.865 -4.864 1.00 0.00 N ATOM 31 CA GLY A 4 5.963 30.962 -5.143 1.00 0.00 C ATOM 32 C GLY A 4 5.731 29.967 -4.023 1.00 0.00 C ATOM 33 O GLY A 4 6.390 30.025 -2.986 1.00 0.00 O ATOM 0 H GLY A 4 7.518 31.721 -3.962 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.054 31.541 -5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.165 30.422 -6.068 1.00 0.00 H new ATOM 37 N SER A 5 4.789 29.053 -4.232 1.00 0.00 N ATOM 38 CA SER A 5 4.468 28.044 -3.229 1.00 0.00 C ATOM 39 C SER A 5 5.112 26.706 -3.578 1.00 0.00 C ATOM 40 O SER A 5 5.722 26.058 -2.729 1.00 0.00 O ATOM 41 CB SER A 5 2.951 27.878 -3.110 1.00 0.00 C ATOM 42 OG SER A 5 2.352 29.042 -2.569 1.00 0.00 O ATOM 0 H SER A 5 4.235 28.990 -5.086 1.00 0.00 H new ATOM 0 HA SER A 5 4.866 28.379 -2.271 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.527 27.670 -4.092 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.724 27.020 -2.476 1.00 0.00 H new ATOM 0 HG SER A 5 1.383 28.911 -2.505 1.00 0.00 H new ATOM 48 N SER A 6 4.970 26.298 -4.836 1.00 0.00 N ATOM 49 CA SER A 6 5.534 25.036 -5.298 1.00 0.00 C ATOM 50 C SER A 6 6.935 24.826 -4.731 1.00 0.00 C ATOM 51 O SER A 6 7.794 25.701 -4.829 1.00 0.00 O ATOM 52 CB SER A 6 5.581 25.003 -6.827 1.00 0.00 C ATOM 53 OG SER A 6 6.421 23.960 -7.290 1.00 0.00 O ATOM 0 H SER A 6 4.469 26.824 -5.552 1.00 0.00 H new ATOM 0 HA SER A 6 4.893 24.229 -4.943 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.574 24.866 -7.222 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.943 25.960 -7.203 1.00 0.00 H new ATOM 0 HG SER A 6 6.432 23.960 -8.270 1.00 0.00 H new ATOM 59 N GLY A 7 7.157 23.658 -4.136 1.00 0.00 N ATOM 60 CA GLY A 7 8.454 23.353 -3.561 1.00 0.00 C ATOM 61 C GLY A 7 8.611 21.881 -3.233 1.00 0.00 C ATOM 62 O GLY A 7 8.046 21.024 -3.911 1.00 0.00 O ATOM 0 H GLY A 7 6.462 22.918 -4.042 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.237 23.652 -4.258 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.593 23.941 -2.654 1.00 0.00 H new ATOM 66 N ALA A 8 9.382 21.588 -2.190 1.00 0.00 N ATOM 67 CA ALA A 8 9.611 20.210 -1.774 1.00 0.00 C ATOM 68 C ALA A 8 8.466 19.701 -0.906 1.00 0.00 C ATOM 69 O ALA A 8 8.187 20.254 0.157 1.00 0.00 O ATOM 70 CB ALA A 8 10.932 20.098 -1.027 1.00 0.00 C ATOM 0 H ALA A 8 9.858 22.286 -1.619 1.00 0.00 H new ATOM 0 HA ALA A 8 9.657 19.589 -2.669 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.091 19.064 -0.722 1.00 0.00 H new ATOM 0 HB2 ALA A 8 11.747 20.413 -1.679 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.906 20.737 -0.144 1.00 0.00 H new ATOM 76 N ASN A 9 7.805 18.644 -1.367 1.00 0.00 N ATOM 77 CA ASN A 9 6.689 18.060 -0.632 1.00 0.00 C ATOM 78 C ASN A 9 7.185 17.065 0.413 1.00 0.00 C ATOM 79 O ASN A 9 8.259 16.481 0.267 1.00 0.00 O ATOM 80 CB ASN A 9 5.724 17.366 -1.596 1.00 0.00 C ATOM 81 CG ASN A 9 4.646 18.302 -2.109 1.00 0.00 C ATOM 82 OD1 ASN A 9 4.934 19.412 -2.557 1.00 0.00 O ATOM 83 ND2 ASN A 9 3.397 17.857 -2.045 1.00 0.00 N ATOM 0 H ASN A 9 8.023 18.175 -2.246 1.00 0.00 H new ATOM 0 HA ASN A 9 6.164 18.866 -0.119 1.00 0.00 H new ATOM 0 HB2 ASN A 9 6.284 16.964 -2.440 1.00 0.00 H new ATOM 0 HB3 ASN A 9 5.257 16.520 -1.092 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.630 18.442 -2.375 1.00 0.00 H new ATOM 0 HD22 ASN A 9 3.205 16.930 -1.666 1.00 0.00 H new ATOM 90 N CYS A 10 6.396 16.878 1.465 1.00 0.00 N ATOM 91 CA CYS A 10 6.755 15.954 2.535 1.00 0.00 C ATOM 92 C CYS A 10 5.522 15.225 3.060 1.00 0.00 C ATOM 93 O CYS A 10 4.401 15.486 2.624 1.00 0.00 O ATOM 94 CB CYS A 10 7.443 16.704 3.675 1.00 0.00 C ATOM 95 SG CYS A 10 8.634 15.707 4.602 1.00 0.00 S ATOM 0 H CYS A 10 5.504 17.354 1.600 1.00 0.00 H new ATOM 0 HA CYS A 10 7.445 15.215 2.128 1.00 0.00 H new ATOM 0 HB2 CYS A 10 7.955 17.575 3.266 1.00 0.00 H new ATOM 0 HB3 CYS A 10 6.683 17.075 4.362 1.00 0.00 H new ATOM 0 HG CYS A 10 9.165 16.429 5.543 1.00 0.00 H new ATOM 101 N PHE A 11 5.738 14.309 3.998 1.00 0.00 N ATOM 102 CA PHE A 11 4.645 13.540 4.582 1.00 0.00 C ATOM 103 C PHE A 11 4.437 13.915 6.046 1.00 0.00 C ATOM 104 O PHE A 11 5.254 13.586 6.906 1.00 0.00 O ATOM 105 CB PHE A 11 4.927 12.041 4.462 1.00 0.00 C ATOM 106 CG PHE A 11 4.699 11.496 3.081 1.00 0.00 C ATOM 107 CD1 PHE A 11 5.598 11.760 2.061 1.00 0.00 C ATOM 108 CD2 PHE A 11 3.585 10.720 2.804 1.00 0.00 C ATOM 109 CE1 PHE A 11 5.391 11.260 0.789 1.00 0.00 C ATOM 110 CE2 PHE A 11 3.374 10.217 1.534 1.00 0.00 C ATOM 111 CZ PHE A 11 4.277 10.488 0.525 1.00 0.00 C ATOM 0 H PHE A 11 6.660 14.081 4.370 1.00 0.00 H new ATOM 0 HA PHE A 11 3.734 13.776 4.033 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.960 11.849 4.753 1.00 0.00 H new ATOM 0 HB3 PHE A 11 4.292 11.503 5.166 1.00 0.00 H new ATOM 0 HD1 PHE A 11 6.471 12.364 2.262 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.874 10.506 3.589 1.00 0.00 H new ATOM 0 HE1 PHE A 11 6.100 11.473 0.002 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.503 9.612 1.331 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.112 10.097 -0.468 1.00 0.00 H new ATOM 121 N THR A 12 3.336 14.608 6.323 1.00 0.00 N ATOM 122 CA THR A 12 3.020 15.030 7.682 1.00 0.00 C ATOM 123 C THR A 12 2.602 13.843 8.543 1.00 0.00 C ATOM 124 O THR A 12 2.865 13.815 9.745 1.00 0.00 O ATOM 125 CB THR A 12 1.895 16.081 7.696 1.00 0.00 C ATOM 126 OG1 THR A 12 0.710 15.539 7.102 1.00 0.00 O ATOM 127 CG2 THR A 12 2.316 17.335 6.945 1.00 0.00 C ATOM 0 H THR A 12 2.648 14.889 5.624 1.00 0.00 H new ATOM 0 HA THR A 12 3.926 15.473 8.094 1.00 0.00 H new ATOM 0 HB THR A 12 1.692 16.348 8.733 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.195 16.260 6.683 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.505 18.063 6.969 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.201 17.762 7.417 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.545 17.080 5.910 1.00 0.00 H new ATOM 135 N GLU A 13 1.952 12.866 7.920 1.00 0.00 N ATOM 136 CA GLU A 13 1.498 11.676 8.631 1.00 0.00 C ATOM 137 C GLU A 13 1.835 10.411 7.847 1.00 0.00 C ATOM 138 O GLU A 13 1.127 10.042 6.911 1.00 0.00 O ATOM 139 CB GLU A 13 -0.010 11.748 8.881 1.00 0.00 C ATOM 140 CG GLU A 13 -0.378 12.410 10.198 1.00 0.00 C ATOM 141 CD GLU A 13 -1.785 12.069 10.648 1.00 0.00 C ATOM 142 OE1 GLU A 13 -2.142 10.873 10.624 1.00 0.00 O ATOM 143 OE2 GLU A 13 -2.530 12.999 11.024 1.00 0.00 O ATOM 0 H GLU A 13 1.728 12.874 6.925 1.00 0.00 H new ATOM 0 HA GLU A 13 2.016 11.637 9.589 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -0.479 12.297 8.065 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.421 10.739 8.864 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.330 12.101 10.966 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.285 13.491 10.096 1.00 0.00 H new ATOM 150 N GLU A 14 2.923 9.753 8.237 1.00 0.00 N ATOM 151 CA GLU A 14 3.355 8.531 7.569 1.00 0.00 C ATOM 152 C GLU A 14 2.289 7.444 7.680 1.00 0.00 C ATOM 153 O GLU A 14 1.490 7.435 8.618 1.00 0.00 O ATOM 154 CB GLU A 14 4.671 8.033 8.170 1.00 0.00 C ATOM 155 CG GLU A 14 5.876 8.867 7.772 1.00 0.00 C ATOM 156 CD GLU A 14 7.025 8.739 8.753 1.00 0.00 C ATOM 157 OE1 GLU A 14 7.804 7.771 8.633 1.00 0.00 O ATOM 158 OE2 GLU A 14 7.144 9.608 9.642 1.00 0.00 O ATOM 0 H GLU A 14 3.520 10.045 9.011 1.00 0.00 H new ATOM 0 HA GLU A 14 3.509 8.759 6.514 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.586 8.029 9.257 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.835 7.001 7.859 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.213 8.561 6.782 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.580 9.914 7.699 1.00 0.00 H new ATOM 165 N LEU A 15 2.282 6.530 6.717 1.00 0.00 N ATOM 166 CA LEU A 15 1.314 5.438 6.705 1.00 0.00 C ATOM 167 C LEU A 15 1.384 4.634 7.999 1.00 0.00 C ATOM 168 O LEU A 15 2.243 4.876 8.848 1.00 0.00 O ATOM 169 CB LEU A 15 1.565 4.521 5.507 1.00 0.00 C ATOM 170 CG LEU A 15 1.276 5.121 4.130 1.00 0.00 C ATOM 171 CD1 LEU A 15 2.187 4.507 3.079 1.00 0.00 C ATOM 172 CD2 LEU A 15 -0.185 4.919 3.756 1.00 0.00 C ATOM 0 H LEU A 15 2.935 6.523 5.934 1.00 0.00 H new ATOM 0 HA LEU A 15 0.317 5.870 6.621 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.607 4.202 5.531 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.955 3.626 5.626 1.00 0.00 H new ATOM 0 HG LEU A 15 1.474 6.192 4.172 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.967 4.946 2.106 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.227 4.704 3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.021 3.431 3.038 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.372 5.352 2.773 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.410 3.853 3.731 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.821 5.407 4.495 1.00 0.00 H new ATOM 184 N THR A 16 0.476 3.674 8.143 1.00 0.00 N ATOM 185 CA THR A 16 0.436 2.833 9.333 1.00 0.00 C ATOM 186 C THR A 16 0.197 1.372 8.966 1.00 0.00 C ATOM 187 O THR A 16 -0.618 1.066 8.097 1.00 0.00 O ATOM 188 CB THR A 16 -0.665 3.292 10.308 1.00 0.00 C ATOM 189 OG1 THR A 16 -0.720 2.409 11.435 1.00 0.00 O ATOM 190 CG2 THR A 16 -2.020 3.326 9.617 1.00 0.00 C ATOM 0 H THR A 16 -0.241 3.460 7.450 1.00 0.00 H new ATOM 0 HA THR A 16 1.406 2.928 9.821 1.00 0.00 H new ATOM 0 HB THR A 16 -0.423 4.299 10.647 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.421 2.708 12.051 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.781 3.653 10.325 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.983 4.020 8.778 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.268 2.329 9.252 1.00 0.00 H new ATOM 198 N ASN A 17 0.914 0.475 9.634 1.00 0.00 N ATOM 199 CA ASN A 17 0.779 -0.955 9.378 1.00 0.00 C ATOM 200 C ASN A 17 -0.674 -1.398 9.515 1.00 0.00 C ATOM 201 O ASN A 17 -1.319 -1.143 10.533 1.00 0.00 O ATOM 202 CB ASN A 17 1.660 -1.752 10.342 1.00 0.00 C ATOM 203 CG ASN A 17 1.703 -1.138 11.728 1.00 0.00 C ATOM 204 OD1 ASN A 17 0.702 -1.125 12.444 1.00 0.00 O ATOM 205 ND2 ASN A 17 2.866 -0.625 12.112 1.00 0.00 N ATOM 0 H ASN A 17 1.594 0.712 10.356 1.00 0.00 H new ATOM 0 HA ASN A 17 1.104 -1.148 8.355 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.286 -2.773 10.412 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.672 -1.810 9.942 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.955 -0.198 13.034 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.670 -0.658 11.485 1.00 0.00 H new ATOM 212 N LEU A 18 -1.184 -2.062 8.484 1.00 0.00 N ATOM 213 CA LEU A 18 -2.561 -2.542 8.488 1.00 0.00 C ATOM 214 C LEU A 18 -2.607 -4.065 8.564 1.00 0.00 C ATOM 215 O LEU A 18 -1.791 -4.751 7.950 1.00 0.00 O ATOM 216 CB LEU A 18 -3.294 -2.061 7.235 1.00 0.00 C ATOM 217 CG LEU A 18 -3.485 -0.549 7.108 1.00 0.00 C ATOM 218 CD1 LEU A 18 -4.049 -0.194 5.741 1.00 0.00 C ATOM 219 CD2 LEU A 18 -4.395 -0.031 8.213 1.00 0.00 C ATOM 0 H LEU A 18 -0.664 -2.280 7.634 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.057 -2.137 9.370 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.746 -2.413 6.361 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.275 -2.535 7.208 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.511 -0.070 7.212 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.178 0.886 5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.361 -0.529 4.965 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.013 -0.684 5.607 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.519 1.047 8.107 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.368 -0.517 8.141 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.950 -0.251 9.184 1.00 0.00 H new ATOM 231 N GLN A 19 -3.569 -4.586 9.320 1.00 0.00 N ATOM 232 CA GLN A 19 -3.722 -6.028 9.474 1.00 0.00 C ATOM 233 C GLN A 19 -5.166 -6.451 9.228 1.00 0.00 C ATOM 234 O GLN A 19 -6.049 -6.188 10.045 1.00 0.00 O ATOM 235 CB GLN A 19 -3.282 -6.462 10.873 1.00 0.00 C ATOM 236 CG GLN A 19 -1.815 -6.852 10.956 1.00 0.00 C ATOM 237 CD GLN A 19 -1.214 -6.576 12.320 1.00 0.00 C ATOM 238 OE1 GLN A 19 -1.355 -5.479 12.863 1.00 0.00 O ATOM 239 NE2 GLN A 19 -0.538 -7.571 12.882 1.00 0.00 N ATOM 0 H GLN A 19 -4.253 -4.032 9.835 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.088 -6.517 8.734 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.473 -5.649 11.573 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -3.893 -7.307 11.191 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.711 -7.912 10.725 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -1.254 -6.305 10.199 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.446 -8.463 12.396 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.111 -7.443 13.799 1.00 0.00 H new ATOM 248 N VAL A 20 -5.400 -7.109 8.097 1.00 0.00 N ATOM 249 CA VAL A 20 -6.738 -7.570 7.743 1.00 0.00 C ATOM 250 C VAL A 20 -6.700 -8.988 7.186 1.00 0.00 C ATOM 251 O VAL A 20 -5.659 -9.459 6.729 1.00 0.00 O ATOM 252 CB VAL A 20 -7.396 -6.640 6.706 1.00 0.00 C ATOM 253 CG1 VAL A 20 -8.864 -6.995 6.526 1.00 0.00 C ATOM 254 CG2 VAL A 20 -7.238 -5.185 7.120 1.00 0.00 C ATOM 0 H VAL A 20 -4.681 -7.335 7.410 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.330 -7.558 8.658 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.893 -6.778 5.749 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -9.312 -6.328 5.790 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -8.949 -8.025 6.181 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.384 -6.887 7.478 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.709 -4.542 6.376 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -7.714 -5.028 8.088 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.178 -4.940 7.193 1.00 0.00 H new ATOM 264 N GLU A 21 -7.844 -9.664 7.227 1.00 0.00 N ATOM 265 CA GLU A 21 -7.942 -11.030 6.726 1.00 0.00 C ATOM 266 C GLU A 21 -8.021 -11.047 5.202 1.00 0.00 C ATOM 267 O GLU A 21 -8.525 -10.108 4.587 1.00 0.00 O ATOM 268 CB GLU A 21 -9.168 -11.728 7.318 1.00 0.00 C ATOM 269 CG GLU A 21 -9.265 -11.609 8.830 1.00 0.00 C ATOM 270 CD GLU A 21 -9.800 -10.262 9.275 1.00 0.00 C ATOM 271 OE1 GLU A 21 -11.018 -10.029 9.131 1.00 0.00 O ATOM 272 OE2 GLU A 21 -8.999 -9.440 9.769 1.00 0.00 O ATOM 0 H GLU A 21 -8.715 -9.288 7.602 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.044 -11.566 7.032 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.068 -11.306 6.870 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.142 -12.783 7.046 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.913 -12.398 9.212 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.279 -11.767 9.267 1.00 0.00 H new ATOM 279 N GLU A 22 -7.518 -12.121 4.601 1.00 0.00 N ATOM 280 CA GLU A 22 -7.530 -12.258 3.149 1.00 0.00 C ATOM 281 C GLU A 22 -8.931 -12.021 2.592 1.00 0.00 C ATOM 282 O GLU A 22 -9.929 -12.208 3.288 1.00 0.00 O ATOM 283 CB GLU A 22 -7.036 -13.648 2.742 1.00 0.00 C ATOM 284 CG GLU A 22 -8.071 -14.744 2.940 1.00 0.00 C ATOM 285 CD GLU A 22 -7.580 -16.100 2.473 1.00 0.00 C ATOM 286 OE1 GLU A 22 -7.457 -16.297 1.246 1.00 0.00 O ATOM 287 OE2 GLU A 22 -7.319 -16.965 3.335 1.00 0.00 O ATOM 0 H GLU A 22 -7.098 -12.908 5.096 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.860 -11.506 2.733 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.738 -13.626 1.694 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.145 -13.892 3.321 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.337 -14.802 3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -8.979 -14.484 2.397 1.00 0.00 H new ATOM 294 N LYS A 23 -8.997 -11.606 1.331 1.00 0.00 N ATOM 295 CA LYS A 23 -10.274 -11.343 0.678 1.00 0.00 C ATOM 296 C LYS A 23 -11.034 -10.234 1.397 1.00 0.00 C ATOM 297 O LYS A 23 -12.260 -10.271 1.495 1.00 0.00 O ATOM 298 CB LYS A 23 -11.122 -12.616 0.640 1.00 0.00 C ATOM 299 CG LYS A 23 -10.569 -13.688 -0.283 1.00 0.00 C ATOM 300 CD LYS A 23 -11.100 -13.534 -1.698 1.00 0.00 C ATOM 301 CE LYS A 23 -10.576 -14.631 -2.613 1.00 0.00 C ATOM 302 NZ LYS A 23 -11.285 -15.922 -2.394 1.00 0.00 N ATOM 0 H LYS A 23 -8.181 -11.445 0.741 1.00 0.00 H new ATOM 0 HA LYS A 23 -10.072 -11.018 -0.343 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -11.199 -13.021 1.649 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -12.132 -12.360 0.321 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.480 -13.634 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -10.835 -14.673 0.101 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -12.190 -13.560 -1.684 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.810 -12.560 -2.093 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.694 -14.324 -3.652 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.509 -14.769 -2.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.899 -16.643 -3.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.152 -16.228 -1.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.300 -15.797 -2.584 1.00 0.00 H new ATOM 316 N GLY A 24 -10.298 -9.246 1.898 1.00 0.00 N ATOM 317 CA GLY A 24 -10.922 -8.140 2.601 1.00 0.00 C ATOM 318 C GLY A 24 -10.765 -6.824 1.865 1.00 0.00 C ATOM 319 O GLY A 24 -10.988 -6.749 0.656 1.00 0.00 O ATOM 0 H GLY A 24 -9.282 -9.192 1.830 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.982 -8.352 2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.484 -8.052 3.595 1.00 0.00 H new ATOM 323 N THR A 25 -10.382 -5.781 2.595 1.00 0.00 N ATOM 324 CA THR A 25 -10.199 -4.461 2.005 1.00 0.00 C ATOM 325 C THR A 25 -9.271 -3.602 2.857 1.00 0.00 C ATOM 326 O THR A 25 -9.619 -3.213 3.972 1.00 0.00 O ATOM 327 CB THR A 25 -11.544 -3.730 1.835 1.00 0.00 C ATOM 328 OG1 THR A 25 -12.530 -4.632 1.322 1.00 0.00 O ATOM 329 CG2 THR A 25 -11.399 -2.542 0.896 1.00 0.00 C ATOM 0 H THR A 25 -10.193 -5.825 3.596 1.00 0.00 H new ATOM 0 HA THR A 25 -9.750 -4.613 1.023 1.00 0.00 H new ATOM 0 HB THR A 25 -11.860 -3.364 2.812 1.00 0.00 H new ATOM 0 HG1 THR A 25 -13.383 -4.160 1.218 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.362 -2.041 0.791 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.669 -1.843 1.304 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.063 -2.889 -0.081 1.00 0.00 H new ATOM 337 N ALA A 26 -8.089 -3.309 2.325 1.00 0.00 N ATOM 338 CA ALA A 26 -7.112 -2.493 3.036 1.00 0.00 C ATOM 339 C ALA A 26 -6.909 -1.151 2.342 1.00 0.00 C ATOM 340 O ALA A 26 -6.578 -1.096 1.157 1.00 0.00 O ATOM 341 CB ALA A 26 -5.789 -3.235 3.151 1.00 0.00 C ATOM 0 H ALA A 26 -7.785 -3.625 1.404 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.496 -2.300 4.038 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.069 -2.614 3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.940 -4.166 3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.409 -3.457 2.154 1.00 0.00 H new ATOM 347 N VAL A 27 -7.110 -0.068 3.087 1.00 0.00 N ATOM 348 CA VAL A 27 -6.949 1.275 2.543 1.00 0.00 C ATOM 349 C VAL A 27 -5.802 2.011 3.227 1.00 0.00 C ATOM 350 O VAL A 27 -5.937 2.479 4.358 1.00 0.00 O ATOM 351 CB VAL A 27 -8.239 2.102 2.698 1.00 0.00 C ATOM 352 CG1 VAL A 27 -8.042 3.507 2.151 1.00 0.00 C ATOM 353 CG2 VAL A 27 -9.402 1.409 2.003 1.00 0.00 C ATOM 0 H VAL A 27 -7.385 -0.095 4.069 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.724 1.162 1.483 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.474 2.181 3.759 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.964 4.076 2.269 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.238 4.001 2.697 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.782 3.453 1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.306 2.007 2.122 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.178 1.298 0.942 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.557 0.425 2.446 1.00 0.00 H new ATOM 363 N PHE A 28 -4.673 2.109 2.534 1.00 0.00 N ATOM 364 CA PHE A 28 -3.501 2.788 3.075 1.00 0.00 C ATOM 365 C PHE A 28 -3.705 4.300 3.087 1.00 0.00 C ATOM 366 O PHE A 28 -3.512 4.973 2.073 1.00 0.00 O ATOM 367 CB PHE A 28 -2.258 2.436 2.254 1.00 0.00 C ATOM 368 CG PHE A 28 -1.563 1.190 2.723 1.00 0.00 C ATOM 369 CD1 PHE A 28 -1.222 1.031 4.057 1.00 0.00 C ATOM 370 CD2 PHE A 28 -1.250 0.178 1.830 1.00 0.00 C ATOM 371 CE1 PHE A 28 -0.582 -0.115 4.492 1.00 0.00 C ATOM 372 CE2 PHE A 28 -0.611 -0.970 2.259 1.00 0.00 C ATOM 373 CZ PHE A 28 -0.276 -1.116 3.591 1.00 0.00 C ATOM 0 H PHE A 28 -4.544 1.727 1.597 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.358 2.451 4.102 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.545 2.311 1.210 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.558 3.270 2.294 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.459 1.811 4.765 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.508 0.287 0.787 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -0.322 -0.227 5.534 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.374 -1.752 1.553 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.225 -2.012 3.928 1.00 0.00 H new ATOM 383 N THR A 29 -4.098 4.829 4.241 1.00 0.00 N ATOM 384 CA THR A 29 -4.330 6.261 4.386 1.00 0.00 C ATOM 385 C THR A 29 -3.058 6.984 4.811 1.00 0.00 C ATOM 386 O THR A 29 -2.331 6.518 5.690 1.00 0.00 O ATOM 387 CB THR A 29 -5.439 6.548 5.416 1.00 0.00 C ATOM 388 OG1 THR A 29 -5.249 5.736 6.580 1.00 0.00 O ATOM 389 CG2 THR A 29 -6.813 6.278 4.822 1.00 0.00 C ATOM 0 H THR A 29 -4.262 4.287 5.089 1.00 0.00 H new ATOM 0 HA THR A 29 -4.645 6.631 3.410 1.00 0.00 H new ATOM 0 HB THR A 29 -5.382 7.600 5.694 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.957 5.926 7.230 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.580 6.488 5.568 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.966 6.919 3.954 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.879 5.233 4.518 1.00 0.00 H new ATOM 397 N CYS A 30 -2.794 8.125 4.183 1.00 0.00 N ATOM 398 CA CYS A 30 -1.607 8.913 4.497 1.00 0.00 C ATOM 399 C CYS A 30 -1.905 10.406 4.399 1.00 0.00 C ATOM 400 O CYS A 30 -3.027 10.807 4.089 1.00 0.00 O ATOM 401 CB CYS A 30 -0.462 8.546 3.553 1.00 0.00 C ATOM 402 SG CYS A 30 -0.969 8.305 1.835 1.00 0.00 S ATOM 0 H CYS A 30 -3.385 8.525 3.454 1.00 0.00 H new ATOM 0 HA CYS A 30 -1.310 8.686 5.521 1.00 0.00 H new ATOM 0 HB2 CYS A 30 0.292 9.332 3.591 1.00 0.00 H new ATOM 0 HB3 CYS A 30 0.012 7.632 3.912 1.00 0.00 H new ATOM 0 HG CYS A 30 -2.263 8.392 1.748 1.00 0.00 H new ATOM 408 N LYS A 31 -0.894 11.224 4.667 1.00 0.00 N ATOM 409 CA LYS A 31 -1.045 12.674 4.610 1.00 0.00 C ATOM 410 C LYS A 31 0.207 13.330 4.037 1.00 0.00 C ATOM 411 O LYS A 31 1.283 12.731 4.020 1.00 0.00 O ATOM 412 CB LYS A 31 -1.334 13.232 6.005 1.00 0.00 C ATOM 413 CG LYS A 31 -2.214 14.470 5.995 1.00 0.00 C ATOM 414 CD LYS A 31 -2.372 15.053 7.389 1.00 0.00 C ATOM 415 CE LYS A 31 -3.104 16.386 7.356 1.00 0.00 C ATOM 416 NZ LYS A 31 -3.056 17.078 8.673 1.00 0.00 N ATOM 0 H LYS A 31 0.040 10.908 4.926 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.885 12.901 3.953 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.816 12.459 6.604 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.390 13.472 6.494 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.781 15.220 5.333 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.195 14.217 5.592 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.920 14.351 8.018 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.390 15.187 7.842 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.660 17.026 6.593 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.143 16.223 7.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -3.566 17.982 8.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.503 16.479 9.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.066 17.257 8.935 1.00 0.00 H new ATOM 430 N THR A 32 0.060 14.565 3.568 1.00 0.00 N ATOM 431 CA THR A 32 1.179 15.303 2.995 1.00 0.00 C ATOM 432 C THR A 32 1.117 16.778 3.373 1.00 0.00 C ATOM 433 O THR A 32 0.036 17.332 3.568 1.00 0.00 O ATOM 434 CB THR A 32 1.206 15.178 1.460 1.00 0.00 C ATOM 435 OG1 THR A 32 -0.081 15.496 0.920 1.00 0.00 O ATOM 436 CG2 THR A 32 1.606 13.773 1.038 1.00 0.00 C ATOM 0 H THR A 32 -0.823 15.075 3.574 1.00 0.00 H new ATOM 0 HA THR A 32 2.089 14.865 3.404 1.00 0.00 H new ATOM 0 HB THR A 32 1.945 15.880 1.074 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.002 16.263 0.315 1.00 0.00 H new ATOM 0 HG21 THR A 32 1.618 13.709 -0.050 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.599 13.545 1.426 1.00 0.00 H new ATOM 0 HG23 THR A 32 0.888 13.055 1.435 1.00 0.00 H new ATOM 444 N GLU A 33 2.283 17.408 3.474 1.00 0.00 N ATOM 445 CA GLU A 33 2.359 18.821 3.829 1.00 0.00 C ATOM 446 C GLU A 33 1.835 19.696 2.694 1.00 0.00 C ATOM 447 O GLU A 33 1.236 20.746 2.930 1.00 0.00 O ATOM 448 CB GLU A 33 3.801 19.209 4.163 1.00 0.00 C ATOM 449 CG GLU A 33 4.028 20.710 4.227 1.00 0.00 C ATOM 450 CD GLU A 33 5.268 21.079 5.018 1.00 0.00 C ATOM 451 OE1 GLU A 33 5.175 21.160 6.261 1.00 0.00 O ATOM 452 OE2 GLU A 33 6.330 21.286 4.395 1.00 0.00 O ATOM 0 H GLU A 33 3.187 16.963 3.315 1.00 0.00 H new ATOM 0 HA GLU A 33 1.734 18.983 4.707 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.074 18.767 5.121 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.466 18.781 3.413 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.117 21.104 3.215 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.158 21.186 4.679 1.00 0.00 H new ATOM 459 N HIS A 34 2.065 19.256 1.461 1.00 0.00 N ATOM 460 CA HIS A 34 1.616 19.999 0.288 1.00 0.00 C ATOM 461 C HIS A 34 0.844 19.093 -0.666 1.00 0.00 C ATOM 462 O HIS A 34 1.108 17.895 -0.774 1.00 0.00 O ATOM 463 CB HIS A 34 2.811 20.621 -0.435 1.00 0.00 C ATOM 464 CG HIS A 34 3.602 21.565 0.417 1.00 0.00 C ATOM 465 ND1 HIS A 34 3.073 22.720 0.952 1.00 0.00 N ATOM 466 CD2 HIS A 34 4.891 21.519 0.827 1.00 0.00 C ATOM 467 CE1 HIS A 34 4.002 23.344 1.653 1.00 0.00 C ATOM 468 NE2 HIS A 34 5.115 22.636 1.594 1.00 0.00 N ATOM 0 H HIS A 34 2.559 18.390 1.248 1.00 0.00 H new ATOM 0 HA HIS A 34 0.950 20.794 0.624 1.00 0.00 H new ATOM 0 HB2 HIS A 34 3.467 19.825 -0.786 1.00 0.00 H new ATOM 0 HB3 HIS A 34 2.455 21.153 -1.317 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.610 20.747 0.594 1.00 0.00 H new ATOM 0 HE1 HIS A 34 3.873 24.275 2.184 1.00 0.00 H new ATOM 0 HE2 HIS A 34 5.997 22.879 2.045 1.00 0.00 H new ATOM 477 N PRO A 35 -0.134 19.676 -1.375 1.00 0.00 N ATOM 478 CA PRO A 35 -0.965 18.940 -2.332 1.00 0.00 C ATOM 479 C PRO A 35 -0.184 18.517 -3.572 1.00 0.00 C ATOM 480 O PRO A 35 0.024 19.313 -4.487 1.00 0.00 O ATOM 481 CB PRO A 35 -2.055 19.948 -2.704 1.00 0.00 C ATOM 482 CG PRO A 35 -1.437 21.281 -2.462 1.00 0.00 C ATOM 483 CD PRO A 35 -0.504 21.099 -1.297 1.00 0.00 C ATOM 0 HA PRO A 35 -1.350 18.012 -1.909 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.359 19.836 -3.745 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -2.948 19.809 -2.094 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.898 21.627 -3.344 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.198 22.029 -2.240 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.369 21.746 -1.377 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -0.991 21.336 -0.351 1.00 0.00 H new ATOM 491 N ALA A 36 0.245 17.259 -3.595 1.00 0.00 N ATOM 492 CA ALA A 36 1.000 16.730 -4.724 1.00 0.00 C ATOM 493 C ALA A 36 0.176 16.779 -6.006 1.00 0.00 C ATOM 494 O ALA A 36 -1.044 16.931 -5.966 1.00 0.00 O ATOM 495 CB ALA A 36 1.450 15.305 -4.437 1.00 0.00 C ATOM 0 H ALA A 36 0.082 16.588 -2.845 1.00 0.00 H new ATOM 0 HA ALA A 36 1.881 17.356 -4.865 1.00 0.00 H new ATOM 0 HB1 ALA A 36 2.013 14.923 -5.289 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.083 15.295 -3.550 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.577 14.675 -4.267 1.00 0.00 H new ATOM 501 N ALA A 37 0.852 16.648 -7.143 1.00 0.00 N ATOM 502 CA ALA A 37 0.183 16.676 -8.437 1.00 0.00 C ATOM 503 C ALA A 37 0.042 15.271 -9.013 1.00 0.00 C ATOM 504 O ALA A 37 -0.831 15.012 -9.842 1.00 0.00 O ATOM 505 CB ALA A 37 0.941 17.572 -9.405 1.00 0.00 C ATOM 0 H ALA A 37 1.863 16.521 -7.194 1.00 0.00 H new ATOM 0 HA ALA A 37 -0.818 17.083 -8.291 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.429 17.583 -10.367 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.984 18.585 -9.005 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.954 17.191 -9.537 1.00 0.00 H new ATOM 511 N THR A 38 0.908 14.365 -8.569 1.00 0.00 N ATOM 512 CA THR A 38 0.882 12.986 -9.041 1.00 0.00 C ATOM 513 C THR A 38 1.284 12.018 -7.934 1.00 0.00 C ATOM 514 O THR A 38 2.129 12.334 -7.096 1.00 0.00 O ATOM 515 CB THR A 38 1.819 12.788 -10.247 1.00 0.00 C ATOM 516 OG1 THR A 38 1.636 11.480 -10.800 1.00 0.00 O ATOM 517 CG2 THR A 38 3.273 12.972 -9.838 1.00 0.00 C ATOM 0 H THR A 38 1.636 14.562 -7.883 1.00 0.00 H new ATOM 0 HA THR A 38 -0.143 12.776 -9.348 1.00 0.00 H new ATOM 0 HB THR A 38 1.571 13.538 -10.999 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.234 11.363 -11.567 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.916 12.827 -10.706 1.00 0.00 H new ATOM 0 HG22 THR A 38 3.416 13.978 -9.444 1.00 0.00 H new ATOM 0 HG23 THR A 38 3.530 12.242 -9.070 1.00 0.00 H new ATOM 525 N VAL A 39 0.674 10.837 -7.937 1.00 0.00 N ATOM 526 CA VAL A 39 0.970 9.821 -6.934 1.00 0.00 C ATOM 527 C VAL A 39 1.141 8.449 -7.575 1.00 0.00 C ATOM 528 O VAL A 39 0.271 7.982 -8.312 1.00 0.00 O ATOM 529 CB VAL A 39 -0.140 9.744 -5.869 1.00 0.00 C ATOM 530 CG1 VAL A 39 0.135 8.611 -4.892 1.00 0.00 C ATOM 531 CG2 VAL A 39 -0.269 11.071 -5.137 1.00 0.00 C ATOM 0 H VAL A 39 -0.028 10.560 -8.623 1.00 0.00 H new ATOM 0 HA VAL A 39 1.904 10.113 -6.454 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.086 9.538 -6.370 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.660 8.572 -4.147 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.172 7.665 -5.433 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.090 8.783 -4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.058 10.998 -4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.675 11.310 -4.647 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.517 11.857 -5.850 1.00 0.00 H new ATOM 541 N THR A 40 2.268 7.804 -7.290 1.00 0.00 N ATOM 542 CA THR A 40 2.554 6.485 -7.839 1.00 0.00 C ATOM 543 C THR A 40 2.877 5.487 -6.733 1.00 0.00 C ATOM 544 O THR A 40 3.992 5.464 -6.211 1.00 0.00 O ATOM 545 CB THR A 40 3.732 6.533 -8.831 1.00 0.00 C ATOM 546 OG1 THR A 40 3.434 7.436 -9.902 1.00 0.00 O ATOM 547 CG2 THR A 40 4.021 5.149 -9.394 1.00 0.00 C ATOM 0 H THR A 40 2.998 8.175 -6.681 1.00 0.00 H new ATOM 0 HA THR A 40 1.657 6.161 -8.366 1.00 0.00 H new ATOM 0 HB THR A 40 4.615 6.883 -8.296 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.188 7.462 -10.527 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.856 5.207 -10.092 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.275 4.471 -8.580 1.00 0.00 H new ATOM 0 HG23 THR A 40 3.139 4.776 -9.914 1.00 0.00 H new ATOM 555 N TRP A 41 1.896 4.665 -6.380 1.00 0.00 N ATOM 556 CA TRP A 41 2.077 3.664 -5.335 1.00 0.00 C ATOM 557 C TRP A 41 2.930 2.503 -5.835 1.00 0.00 C ATOM 558 O TRP A 41 3.003 2.248 -7.037 1.00 0.00 O ATOM 559 CB TRP A 41 0.720 3.146 -4.855 1.00 0.00 C ATOM 560 CG TRP A 41 -0.134 4.208 -4.232 1.00 0.00 C ATOM 561 CD1 TRP A 41 -0.748 5.247 -4.872 1.00 0.00 C ATOM 562 CD2 TRP A 41 -0.468 4.336 -2.845 1.00 0.00 C ATOM 563 NE1 TRP A 41 -1.443 6.013 -3.967 1.00 0.00 N ATOM 564 CE2 TRP A 41 -1.287 5.475 -2.717 1.00 0.00 C ATOM 565 CE3 TRP A 41 -0.155 3.599 -1.700 1.00 0.00 C ATOM 566 CZ2 TRP A 41 -1.795 5.891 -1.489 1.00 0.00 C ATOM 567 CZ3 TRP A 41 -0.660 4.014 -0.483 1.00 0.00 C ATOM 568 CH2 TRP A 41 -1.473 5.150 -0.385 1.00 0.00 C ATOM 0 H TRP A 41 0.967 4.672 -6.802 1.00 0.00 H new ATOM 0 HA TRP A 41 2.594 4.137 -4.500 1.00 0.00 H new ATOM 0 HB2 TRP A 41 0.186 2.709 -5.699 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.879 2.347 -4.131 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.695 5.438 -5.934 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.987 6.847 -4.190 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.470 2.721 -1.765 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.421 6.768 -1.411 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.424 3.452 0.409 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -1.853 5.447 0.581 1.00 0.00 H new ATOM 579 N ARG A 42 3.572 1.803 -4.905 1.00 0.00 N ATOM 580 CA ARG A 42 4.421 0.669 -5.253 1.00 0.00 C ATOM 581 C ARG A 42 4.191 -0.496 -4.295 1.00 0.00 C ATOM 582 O ARG A 42 4.258 -0.334 -3.076 1.00 0.00 O ATOM 583 CB ARG A 42 5.894 1.081 -5.228 1.00 0.00 C ATOM 584 CG ARG A 42 6.856 -0.089 -5.346 1.00 0.00 C ATOM 585 CD ARG A 42 8.230 0.262 -4.799 1.00 0.00 C ATOM 586 NE ARG A 42 8.936 1.208 -5.659 1.00 0.00 N ATOM 587 CZ ARG A 42 9.367 0.912 -6.880 1.00 0.00 C ATOM 588 NH1 ARG A 42 9.164 -0.298 -7.383 1.00 0.00 N ATOM 589 NH2 ARG A 42 10.001 1.828 -7.601 1.00 0.00 N ATOM 0 H ARG A 42 3.521 2.001 -3.906 1.00 0.00 H new ATOM 0 HA ARG A 42 4.158 0.346 -6.260 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.081 1.778 -6.045 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.097 1.615 -4.300 1.00 0.00 H new ATOM 0 HG2 ARG A 42 6.456 -0.946 -4.805 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.944 -0.385 -6.391 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.125 0.688 -3.801 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.823 -0.647 -4.697 1.00 0.00 H new ATOM 0 HE ARG A 42 9.108 2.148 -5.302 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.676 -1.004 -6.832 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.496 -0.523 -8.321 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.158 2.760 -7.218 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.332 1.600 -8.539 1.00 0.00 H new ATOM 603 N LYS A 43 3.920 -1.670 -4.854 1.00 0.00 N ATOM 604 CA LYS A 43 3.681 -2.863 -4.051 1.00 0.00 C ATOM 605 C LYS A 43 4.730 -3.932 -4.339 1.00 0.00 C ATOM 606 O LYS A 43 4.953 -4.302 -5.491 1.00 0.00 O ATOM 607 CB LYS A 43 2.282 -3.419 -4.329 1.00 0.00 C ATOM 608 CG LYS A 43 2.031 -4.777 -3.698 1.00 0.00 C ATOM 609 CD LYS A 43 1.035 -5.592 -4.507 1.00 0.00 C ATOM 610 CE LYS A 43 1.085 -7.065 -4.132 1.00 0.00 C ATOM 611 NZ LYS A 43 0.405 -7.919 -5.145 1.00 0.00 N ATOM 0 H LYS A 43 3.860 -1.821 -5.861 1.00 0.00 H new ATOM 0 HA LYS A 43 3.752 -2.583 -3.000 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.539 -2.713 -3.958 1.00 0.00 H new ATOM 0 HB3 LYS A 43 2.138 -3.496 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.971 -5.323 -3.621 1.00 0.00 H new ATOM 0 HG3 LYS A 43 1.655 -4.644 -2.684 1.00 0.00 H new ATOM 0 HD2 LYS A 43 0.029 -5.207 -4.341 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.249 -5.479 -5.570 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.124 -7.379 -4.031 1.00 0.00 H new ATOM 0 HE3 LYS A 43 0.613 -7.209 -3.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 0.461 -8.916 -4.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -0.593 -7.637 -5.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 0.871 -7.802 -6.067 1.00 0.00 H new ATOM 625 N GLY A 44 5.372 -4.426 -3.283 1.00 0.00 N ATOM 626 CA GLY A 44 6.389 -5.448 -3.445 1.00 0.00 C ATOM 627 C GLY A 44 7.320 -5.161 -4.605 1.00 0.00 C ATOM 628 O GLY A 44 7.325 -5.886 -5.601 1.00 0.00 O ATOM 0 H GLY A 44 5.205 -4.136 -2.319 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.971 -5.526 -2.527 1.00 0.00 H new ATOM 0 HA3 GLY A 44 5.908 -6.414 -3.600 1.00 0.00 H new ATOM 632 N LEU A 45 8.110 -4.101 -4.480 1.00 0.00 N ATOM 633 CA LEU A 45 9.050 -3.718 -5.528 1.00 0.00 C ATOM 634 C LEU A 45 8.374 -3.726 -6.895 1.00 0.00 C ATOM 635 O LEU A 45 8.965 -4.148 -7.890 1.00 0.00 O ATOM 636 CB LEU A 45 10.251 -4.666 -5.534 1.00 0.00 C ATOM 637 CG LEU A 45 11.283 -4.449 -4.427 1.00 0.00 C ATOM 638 CD1 LEU A 45 10.770 -4.995 -3.104 1.00 0.00 C ATOM 639 CD2 LEU A 45 12.607 -5.102 -4.798 1.00 0.00 C ATOM 0 H LEU A 45 8.119 -3.491 -3.663 1.00 0.00 H new ATOM 0 HA LEU A 45 9.395 -2.705 -5.320 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.881 -5.689 -5.463 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.755 -4.575 -6.496 1.00 0.00 H new ATOM 0 HG LEU A 45 11.447 -3.377 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 45 11.518 -4.831 -2.328 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.847 -4.482 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU A 45 10.576 -6.063 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.330 -4.938 -3.999 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.458 -6.173 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.982 -4.664 -5.723 1.00 0.00 H new ATOM 651 N LEU A 46 7.133 -3.255 -6.938 1.00 0.00 N ATOM 652 CA LEU A 46 6.376 -3.205 -8.184 1.00 0.00 C ATOM 653 C LEU A 46 5.550 -1.925 -8.269 1.00 0.00 C ATOM 654 O LEU A 46 5.006 -1.460 -7.268 1.00 0.00 O ATOM 655 CB LEU A 46 5.460 -4.425 -8.296 1.00 0.00 C ATOM 656 CG LEU A 46 5.121 -4.882 -9.716 1.00 0.00 C ATOM 657 CD1 LEU A 46 6.157 -5.875 -10.218 1.00 0.00 C ATOM 658 CD2 LEU A 46 3.728 -5.492 -9.762 1.00 0.00 C ATOM 0 H LEU A 46 6.629 -2.902 -6.124 1.00 0.00 H new ATOM 0 HA LEU A 46 7.085 -3.213 -9.012 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.930 -5.256 -7.771 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.529 -4.204 -7.775 1.00 0.00 H new ATOM 0 HG LEU A 46 5.135 -4.011 -10.371 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.900 -6.189 -11.230 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.140 -5.404 -10.223 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.175 -6.745 -9.562 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.504 -5.811 -10.780 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.685 -6.352 -9.094 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.995 -4.750 -9.445 1.00 0.00 H new ATOM 670 N GLU A 47 5.460 -1.364 -9.470 1.00 0.00 N ATOM 671 CA GLU A 47 4.699 -0.138 -9.685 1.00 0.00 C ATOM 672 C GLU A 47 3.209 -0.440 -9.816 1.00 0.00 C ATOM 673 O GLU A 47 2.797 -1.239 -10.658 1.00 0.00 O ATOM 674 CB GLU A 47 5.196 0.584 -10.938 1.00 0.00 C ATOM 675 CG GLU A 47 4.653 1.996 -11.083 1.00 0.00 C ATOM 676 CD GLU A 47 5.131 2.678 -12.350 1.00 0.00 C ATOM 677 OE1 GLU A 47 6.347 2.937 -12.463 1.00 0.00 O ATOM 678 OE2 GLU A 47 4.288 2.953 -13.229 1.00 0.00 O ATOM 0 H GLU A 47 5.904 -1.738 -10.309 1.00 0.00 H new ATOM 0 HA GLU A 47 4.847 0.508 -8.820 1.00 0.00 H new ATOM 0 HB2 GLU A 47 6.285 0.623 -10.917 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.915 0.004 -11.817 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.563 1.964 -11.081 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.956 2.588 -10.220 1.00 0.00 H new ATOM 685 N LEU A 48 2.405 0.205 -8.977 1.00 0.00 N ATOM 686 CA LEU A 48 0.960 0.007 -8.998 1.00 0.00 C ATOM 687 C LEU A 48 0.299 0.923 -10.022 1.00 0.00 C ATOM 688 O LEU A 48 0.922 1.857 -10.528 1.00 0.00 O ATOM 689 CB LEU A 48 0.370 0.265 -7.610 1.00 0.00 C ATOM 690 CG LEU A 48 0.847 -0.665 -6.494 1.00 0.00 C ATOM 691 CD1 LEU A 48 0.193 -0.293 -5.173 1.00 0.00 C ATOM 692 CD2 LEU A 48 0.554 -2.116 -6.847 1.00 0.00 C ATOM 0 H LEU A 48 2.729 0.869 -8.274 1.00 0.00 H new ATOM 0 HA LEU A 48 0.764 -1.027 -9.283 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.601 1.291 -7.324 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.715 0.190 -7.679 1.00 0.00 H new ATOM 0 HG LEU A 48 1.925 -0.549 -6.387 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.545 -0.966 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.454 0.733 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.890 -0.379 -5.266 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.900 -2.763 -6.041 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.519 -2.248 -6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.071 -2.377 -7.770 1.00 0.00 H new ATOM 704 N ARG A 49 -0.967 0.651 -10.322 1.00 0.00 N ATOM 705 CA ARG A 49 -1.713 1.451 -11.286 1.00 0.00 C ATOM 706 C ARG A 49 -3.195 1.495 -10.925 1.00 0.00 C ATOM 707 O ARG A 49 -3.761 0.503 -10.466 1.00 0.00 O ATOM 708 CB ARG A 49 -1.536 0.886 -12.696 1.00 0.00 C ATOM 709 CG ARG A 49 -2.175 -0.480 -12.889 1.00 0.00 C ATOM 710 CD ARG A 49 -1.225 -1.600 -12.494 1.00 0.00 C ATOM 711 NE ARG A 49 -1.917 -2.877 -12.342 1.00 0.00 N ATOM 712 CZ ARG A 49 -1.305 -4.055 -12.392 1.00 0.00 C ATOM 713 NH1 ARG A 49 0.004 -4.118 -12.589 1.00 0.00 N ATOM 714 NH2 ARG A 49 -2.004 -5.173 -12.245 1.00 0.00 N ATOM 0 H ARG A 49 -1.497 -0.117 -9.911 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.320 2.467 -11.258 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.966 1.584 -13.415 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.471 0.815 -12.919 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.084 -0.545 -12.292 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -2.469 -0.601 -13.932 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.446 -1.698 -13.250 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.730 -1.342 -11.558 1.00 0.00 H new ATOM 0 HE ARG A 49 -2.925 -2.864 -12.189 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.544 -3.260 -12.703 1.00 0.00 H new ATOM 0 HH12 ARG A 49 0.471 -5.024 -12.627 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -3.012 -5.128 -12.094 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.534 -6.077 -12.283 1.00 0.00 H new ATOM 728 N ALA A 50 -3.816 2.650 -11.136 1.00 0.00 N ATOM 729 CA ALA A 50 -5.232 2.823 -10.835 1.00 0.00 C ATOM 730 C ALA A 50 -6.077 1.773 -11.549 1.00 0.00 C ATOM 731 O ALA A 50 -6.332 1.878 -12.748 1.00 0.00 O ATOM 732 CB ALA A 50 -5.687 4.222 -11.222 1.00 0.00 C ATOM 0 H ALA A 50 -3.361 3.481 -11.514 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.368 2.693 -9.761 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.746 4.337 -10.992 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.112 4.960 -10.662 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.529 4.373 -12.290 1.00 0.00 H new ATOM 738 N SER A 51 -6.507 0.759 -10.804 1.00 0.00 N ATOM 739 CA SER A 51 -7.319 -0.313 -11.367 1.00 0.00 C ATOM 740 C SER A 51 -8.248 -0.903 -10.310 1.00 0.00 C ATOM 741 O SER A 51 -8.080 -0.662 -9.115 1.00 0.00 O ATOM 742 CB SER A 51 -6.424 -1.410 -11.945 1.00 0.00 C ATOM 743 OG SER A 51 -5.626 -2.002 -10.935 1.00 0.00 O ATOM 0 H SER A 51 -6.306 0.658 -9.809 1.00 0.00 H new ATOM 0 HA SER A 51 -7.928 0.108 -12.167 1.00 0.00 H new ATOM 0 HB2 SER A 51 -7.040 -2.173 -12.420 1.00 0.00 H new ATOM 0 HB3 SER A 51 -5.783 -0.990 -12.720 1.00 0.00 H new ATOM 0 HG SER A 51 -4.948 -1.361 -10.636 1.00 0.00 H new ATOM 749 N GLY A 52 -9.230 -1.678 -10.760 1.00 0.00 N ATOM 750 CA GLY A 52 -10.172 -2.291 -9.842 1.00 0.00 C ATOM 751 C GLY A 52 -9.520 -2.718 -8.542 1.00 0.00 C ATOM 752 O GLY A 52 -10.124 -2.620 -7.474 1.00 0.00 O ATOM 0 H GLY A 52 -9.390 -1.892 -11.744 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.976 -1.587 -9.628 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -10.627 -3.159 -10.319 1.00 0.00 H new ATOM 756 N LYS A 53 -8.283 -3.195 -8.631 1.00 0.00 N ATOM 757 CA LYS A 53 -7.547 -3.639 -7.453 1.00 0.00 C ATOM 758 C LYS A 53 -7.045 -2.448 -6.644 1.00 0.00 C ATOM 759 O LYS A 53 -7.516 -2.195 -5.535 1.00 0.00 O ATOM 760 CB LYS A 53 -6.367 -4.522 -7.867 1.00 0.00 C ATOM 761 CG LYS A 53 -5.671 -5.195 -6.696 1.00 0.00 C ATOM 762 CD LYS A 53 -6.527 -6.299 -6.099 1.00 0.00 C ATOM 763 CE LYS A 53 -5.819 -6.990 -4.943 1.00 0.00 C ATOM 764 NZ LYS A 53 -4.544 -7.627 -5.376 1.00 0.00 N ATOM 0 H LYS A 53 -7.769 -3.284 -9.507 1.00 0.00 H new ATOM 0 HA LYS A 53 -8.226 -4.219 -6.828 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.721 -5.288 -8.557 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.642 -3.915 -8.409 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.719 -5.610 -7.027 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.446 -4.453 -5.930 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.471 -5.881 -5.751 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.768 -7.031 -6.870 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.614 -6.264 -4.156 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.476 -7.747 -4.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.266 -8.352 -4.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -4.676 -8.070 -6.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.799 -6.904 -5.439 1.00 0.00 H new ATOM 778 N HIS A 54 -6.087 -1.717 -7.206 1.00 0.00 N ATOM 779 CA HIS A 54 -5.523 -0.550 -6.537 1.00 0.00 C ATOM 780 C HIS A 54 -6.102 0.739 -7.112 1.00 0.00 C ATOM 781 O HIS A 54 -5.648 1.226 -8.147 1.00 0.00 O ATOM 782 CB HIS A 54 -4.000 -0.545 -6.674 1.00 0.00 C ATOM 783 CG HIS A 54 -3.368 -1.872 -6.390 1.00 0.00 C ATOM 784 ND1 HIS A 54 -3.103 -2.805 -7.370 1.00 0.00 N ATOM 785 CD2 HIS A 54 -2.946 -2.422 -5.227 1.00 0.00 C ATOM 786 CE1 HIS A 54 -2.547 -3.871 -6.823 1.00 0.00 C ATOM 787 NE2 HIS A 54 -2.441 -3.663 -5.522 1.00 0.00 N ATOM 0 H HIS A 54 -5.685 -1.912 -8.123 1.00 0.00 H new ATOM 0 HA HIS A 54 -5.785 -0.605 -5.480 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -3.736 -0.235 -7.685 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.585 0.199 -5.994 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -2.997 -1.968 -4.248 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -2.233 -4.760 -7.349 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -2.048 -4.319 -4.847 1.00 0.00 H new ATOM 796 N GLN A 55 -7.107 1.284 -6.434 1.00 0.00 N ATOM 797 CA GLN A 55 -7.748 2.516 -6.879 1.00 0.00 C ATOM 798 C GLN A 55 -7.454 3.662 -5.916 1.00 0.00 C ATOM 799 O GLN A 55 -8.202 3.920 -4.973 1.00 0.00 O ATOM 800 CB GLN A 55 -9.259 2.313 -7.002 1.00 0.00 C ATOM 801 CG GLN A 55 -10.023 3.594 -7.296 1.00 0.00 C ATOM 802 CD GLN A 55 -9.868 4.049 -8.734 1.00 0.00 C ATOM 803 OE1 GLN A 55 -9.187 5.036 -9.014 1.00 0.00 O ATOM 804 NE2 GLN A 55 -10.500 3.331 -9.654 1.00 0.00 N ATOM 0 H GLN A 55 -7.495 0.892 -5.576 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.342 2.775 -7.857 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.457 1.592 -7.795 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -9.636 1.880 -6.075 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -11.080 3.440 -7.080 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.673 4.382 -6.630 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.054 2.520 -9.377 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -10.432 3.590 -10.638 1.00 0.00 H new ATOM 813 N PRO A 56 -6.338 4.366 -6.157 1.00 0.00 N ATOM 814 CA PRO A 56 -5.919 5.496 -5.323 1.00 0.00 C ATOM 815 C PRO A 56 -6.834 6.705 -5.483 1.00 0.00 C ATOM 816 O PRO A 56 -7.724 6.714 -6.334 1.00 0.00 O ATOM 817 CB PRO A 56 -4.514 5.817 -5.839 1.00 0.00 C ATOM 818 CG PRO A 56 -4.505 5.322 -7.244 1.00 0.00 C ATOM 819 CD PRO A 56 -5.399 4.113 -7.264 1.00 0.00 C ATOM 0 HA PRO A 56 -5.952 5.253 -4.261 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.311 6.887 -5.795 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.749 5.322 -5.240 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.869 6.087 -7.930 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.494 5.065 -7.561 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -5.919 4.013 -8.217 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -4.835 3.193 -7.110 1.00 0.00 H new ATOM 827 N SER A 57 -6.610 7.724 -4.660 1.00 0.00 N ATOM 828 CA SER A 57 -7.417 8.938 -4.708 1.00 0.00 C ATOM 829 C SER A 57 -6.637 10.131 -4.163 1.00 0.00 C ATOM 830 O SER A 57 -5.505 9.987 -3.703 1.00 0.00 O ATOM 831 CB SER A 57 -8.708 8.749 -3.909 1.00 0.00 C ATOM 832 OG SER A 57 -8.474 8.900 -2.519 1.00 0.00 O ATOM 0 H SER A 57 -5.876 7.733 -3.952 1.00 0.00 H new ATOM 0 HA SER A 57 -7.669 9.137 -5.750 1.00 0.00 H new ATOM 0 HB2 SER A 57 -9.452 9.475 -4.237 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.120 7.759 -4.106 1.00 0.00 H new ATOM 0 HG SER A 57 -9.314 8.776 -2.030 1.00 0.00 H new ATOM 838 N GLN A 58 -7.253 11.307 -4.218 1.00 0.00 N ATOM 839 CA GLN A 58 -6.617 12.525 -3.730 1.00 0.00 C ATOM 840 C GLN A 58 -7.626 13.418 -3.015 1.00 0.00 C ATOM 841 O GLN A 58 -8.757 13.580 -3.472 1.00 0.00 O ATOM 842 CB GLN A 58 -5.974 13.289 -4.889 1.00 0.00 C ATOM 843 CG GLN A 58 -5.245 14.550 -4.456 1.00 0.00 C ATOM 844 CD GLN A 58 -4.104 14.913 -5.386 1.00 0.00 C ATOM 845 OE1 GLN A 58 -4.285 15.015 -6.600 1.00 0.00 O ATOM 846 NE2 GLN A 58 -2.919 15.110 -4.821 1.00 0.00 N ATOM 0 H GLN A 58 -8.191 11.442 -4.595 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.843 12.240 -3.017 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.272 12.631 -5.402 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -6.746 13.555 -5.611 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.953 15.378 -4.415 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.856 14.412 -3.447 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.814 15.015 -3.811 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.114 15.356 -5.397 1.00 0.00 H new ATOM 855 N GLU A 59 -7.209 13.993 -1.892 1.00 0.00 N ATOM 856 CA GLU A 59 -8.078 14.868 -1.114 1.00 0.00 C ATOM 857 C GLU A 59 -7.261 15.907 -0.350 1.00 0.00 C ATOM 858 O GLU A 59 -6.032 15.873 -0.356 1.00 0.00 O ATOM 859 CB GLU A 59 -8.922 14.047 -0.136 1.00 0.00 C ATOM 860 CG GLU A 59 -10.157 13.428 -0.770 1.00 0.00 C ATOM 861 CD GLU A 59 -11.169 14.467 -1.210 1.00 0.00 C ATOM 862 OE1 GLU A 59 -11.146 15.588 -0.661 1.00 0.00 O ATOM 863 OE2 GLU A 59 -11.985 14.159 -2.104 1.00 0.00 O ATOM 0 H GLU A 59 -6.275 13.869 -1.501 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.740 15.389 -1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.305 13.254 0.287 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.230 14.687 0.691 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.858 12.830 -1.631 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.625 12.749 -0.057 1.00 0.00 H new ATOM 870 N GLY A 60 -7.956 16.830 0.307 1.00 0.00 N ATOM 871 CA GLY A 60 -7.280 17.866 1.066 1.00 0.00 C ATOM 872 C GLY A 60 -6.069 17.342 1.812 1.00 0.00 C ATOM 873 O GLY A 60 -6.200 16.728 2.871 1.00 0.00 O ATOM 0 H GLY A 60 -8.975 16.879 0.327 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -6.970 18.663 0.390 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.979 18.305 1.778 1.00 0.00 H new ATOM 877 N LEU A 61 -4.885 17.582 1.257 1.00 0.00 N ATOM 878 CA LEU A 61 -3.645 17.129 1.876 1.00 0.00 C ATOM 879 C LEU A 61 -3.819 15.747 2.497 1.00 0.00 C ATOM 880 O LEU A 61 -3.175 15.415 3.493 1.00 0.00 O ATOM 881 CB LEU A 61 -3.189 18.126 2.942 1.00 0.00 C ATOM 882 CG LEU A 61 -2.874 19.539 2.449 1.00 0.00 C ATOM 883 CD1 LEU A 61 -2.748 20.498 3.622 1.00 0.00 C ATOM 884 CD2 LEU A 61 -1.600 19.541 1.617 1.00 0.00 C ATOM 0 H LEU A 61 -4.759 18.087 0.380 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.883 17.064 1.099 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.966 18.193 3.704 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.299 17.726 3.428 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.697 19.875 1.818 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.524 21.498 3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.686 20.518 4.178 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.944 20.166 4.279 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.391 20.554 1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.768 19.184 2.224 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.727 18.886 0.755 1.00 0.00 H new ATOM 896 N THR A 62 -4.695 14.942 1.902 1.00 0.00 N ATOM 897 CA THR A 62 -4.954 13.596 2.396 1.00 0.00 C ATOM 898 C THR A 62 -5.080 12.603 1.246 1.00 0.00 C ATOM 899 O THR A 62 -5.977 12.718 0.409 1.00 0.00 O ATOM 900 CB THR A 62 -6.237 13.546 3.246 1.00 0.00 C ATOM 901 OG1 THR A 62 -6.244 14.625 4.187 1.00 0.00 O ATOM 902 CG2 THR A 62 -6.347 12.221 3.985 1.00 0.00 C ATOM 0 H THR A 62 -5.237 15.200 1.077 1.00 0.00 H new ATOM 0 HA THR A 62 -4.104 13.320 3.020 1.00 0.00 H new ATOM 0 HB THR A 62 -7.092 13.642 2.577 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.588 15.434 3.754 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.261 12.210 4.578 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.372 11.404 3.264 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.486 12.099 4.643 1.00 0.00 H new ATOM 910 N LEU A 63 -4.179 11.628 1.210 1.00 0.00 N ATOM 911 CA LEU A 63 -4.191 10.613 0.162 1.00 0.00 C ATOM 912 C LEU A 63 -4.488 9.235 0.742 1.00 0.00 C ATOM 913 O LEU A 63 -4.314 9.003 1.939 1.00 0.00 O ATOM 914 CB LEU A 63 -2.847 10.592 -0.570 1.00 0.00 C ATOM 915 CG LEU A 63 -2.357 11.936 -1.111 1.00 0.00 C ATOM 916 CD1 LEU A 63 -0.869 11.876 -1.417 1.00 0.00 C ATOM 917 CD2 LEU A 63 -3.143 12.329 -2.353 1.00 0.00 C ATOM 0 H LEU A 63 -3.431 11.518 1.894 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.980 10.866 -0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.091 10.199 0.110 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.920 9.893 -1.403 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.520 12.696 -0.347 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.537 12.841 -1.801 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.319 11.640 -0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.682 11.104 -2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.781 13.288 -2.724 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.011 11.569 -3.123 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.201 12.413 -2.103 1.00 0.00 H new ATOM 929 N ARG A 64 -4.936 8.322 -0.114 1.00 0.00 N ATOM 930 CA ARG A 64 -5.257 6.966 0.314 1.00 0.00 C ATOM 931 C ARG A 64 -5.386 6.033 -0.887 1.00 0.00 C ATOM 932 O ARG A 64 -5.690 6.472 -1.998 1.00 0.00 O ATOM 933 CB ARG A 64 -6.556 6.956 1.122 1.00 0.00 C ATOM 934 CG ARG A 64 -7.771 7.403 0.326 1.00 0.00 C ATOM 935 CD ARG A 64 -8.959 7.684 1.233 1.00 0.00 C ATOM 936 NE ARG A 64 -10.232 7.453 0.556 1.00 0.00 N ATOM 937 CZ ARG A 64 -11.408 7.816 1.057 1.00 0.00 C ATOM 938 NH1 ARG A 64 -11.471 8.424 2.233 1.00 0.00 N ATOM 939 NH2 ARG A 64 -12.522 7.571 0.380 1.00 0.00 N ATOM 0 H ARG A 64 -5.085 8.497 -1.108 1.00 0.00 H new ATOM 0 HA ARG A 64 -4.443 6.609 0.945 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.731 5.949 1.501 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.440 7.607 1.989 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.525 8.300 -0.242 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.038 6.632 -0.396 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.898 7.049 2.117 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.915 8.717 1.579 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.218 6.987 -0.351 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.616 8.614 2.755 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -12.375 8.702 2.616 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -12.476 7.104 -0.526 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -13.424 7.850 0.765 1.00 0.00 H new ATOM 953 N LEU A 65 -5.152 4.746 -0.658 1.00 0.00 N ATOM 954 CA LEU A 65 -5.242 3.751 -1.721 1.00 0.00 C ATOM 955 C LEU A 65 -6.066 2.548 -1.273 1.00 0.00 C ATOM 956 O LEU A 65 -5.636 1.769 -0.421 1.00 0.00 O ATOM 957 CB LEU A 65 -3.842 3.297 -2.140 1.00 0.00 C ATOM 958 CG LEU A 65 -3.780 2.077 -3.060 1.00 0.00 C ATOM 959 CD1 LEU A 65 -4.007 2.487 -4.507 1.00 0.00 C ATOM 960 CD2 LEU A 65 -2.445 1.363 -2.909 1.00 0.00 C ATOM 0 H LEU A 65 -4.898 4.367 0.254 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.740 4.211 -2.575 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.346 4.129 -2.639 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.268 3.078 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.573 1.387 -2.771 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.959 1.606 -5.147 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.988 2.953 -4.604 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.237 3.197 -4.809 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.418 0.497 -3.571 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.636 2.045 -3.171 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.323 1.034 -1.877 1.00 0.00 H new ATOM 972 N THR A 66 -7.252 2.400 -1.854 1.00 0.00 N ATOM 973 CA THR A 66 -8.136 1.292 -1.516 1.00 0.00 C ATOM 974 C THR A 66 -7.705 0.010 -2.220 1.00 0.00 C ATOM 975 O THR A 66 -7.470 0.004 -3.428 1.00 0.00 O ATOM 976 CB THR A 66 -9.597 1.604 -1.891 1.00 0.00 C ATOM 977 OG1 THR A 66 -9.988 2.864 -1.334 1.00 0.00 O ATOM 978 CG2 THR A 66 -10.530 0.511 -1.391 1.00 0.00 C ATOM 0 H THR A 66 -7.623 3.034 -2.562 1.00 0.00 H new ATOM 0 HA THR A 66 -8.068 1.151 -0.437 1.00 0.00 H new ATOM 0 HB THR A 66 -9.667 1.650 -2.978 1.00 0.00 H new ATOM 0 HG1 THR A 66 -10.917 3.055 -1.579 1.00 0.00 H new ATOM 0 HG21 THR A 66 -11.556 0.754 -1.668 1.00 0.00 H new ATOM 0 HG22 THR A 66 -10.248 -0.441 -1.840 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.455 0.437 -0.306 1.00 0.00 H new ATOM 986 N ILE A 67 -7.605 -1.073 -1.457 1.00 0.00 N ATOM 987 CA ILE A 67 -7.204 -2.361 -2.009 1.00 0.00 C ATOM 988 C ILE A 67 -8.180 -3.460 -1.605 1.00 0.00 C ATOM 989 O ILE A 67 -8.318 -3.779 -0.424 1.00 0.00 O ATOM 990 CB ILE A 67 -5.787 -2.754 -1.550 1.00 0.00 C ATOM 991 CG1 ILE A 67 -4.818 -1.589 -1.761 1.00 0.00 C ATOM 992 CG2 ILE A 67 -5.311 -3.989 -2.300 1.00 0.00 C ATOM 993 CD1 ILE A 67 -3.661 -1.581 -0.786 1.00 0.00 C ATOM 0 H ILE A 67 -7.796 -1.084 -0.455 1.00 0.00 H new ATOM 0 HA ILE A 67 -7.209 -2.255 -3.094 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.817 -2.989 -0.486 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.426 -1.633 -2.777 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.365 -0.651 -1.670 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.308 -4.254 -1.965 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.991 -4.818 -2.104 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.293 -3.780 -3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.015 -0.728 -0.995 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.044 -1.506 0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.090 -2.503 -0.892 1.00 0.00 H new ATOM 1005 N SER A 68 -8.855 -4.038 -2.594 1.00 0.00 N ATOM 1006 CA SER A 68 -9.820 -5.101 -2.341 1.00 0.00 C ATOM 1007 C SER A 68 -9.294 -6.443 -2.843 1.00 0.00 C ATOM 1008 O SER A 68 -8.271 -6.506 -3.523 1.00 0.00 O ATOM 1009 CB SER A 68 -11.154 -4.779 -3.017 1.00 0.00 C ATOM 1010 OG SER A 68 -12.223 -5.467 -2.390 1.00 0.00 O ATOM 0 H SER A 68 -8.751 -3.788 -3.577 1.00 0.00 H new ATOM 0 HA SER A 68 -9.973 -5.170 -1.264 1.00 0.00 H new ATOM 0 HB2 SER A 68 -11.336 -3.705 -2.977 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.108 -5.055 -4.070 1.00 0.00 H new ATOM 0 HG SER A 68 -13.065 -5.243 -2.839 1.00 0.00 H new ATOM 1016 N ALA A 69 -10.004 -7.514 -2.503 1.00 0.00 N ATOM 1017 CA ALA A 69 -9.611 -8.854 -2.920 1.00 0.00 C ATOM 1018 C ALA A 69 -8.197 -9.182 -2.453 1.00 0.00 C ATOM 1019 O ALA A 69 -7.396 -9.738 -3.207 1.00 0.00 O ATOM 1020 CB ALA A 69 -9.714 -8.988 -4.432 1.00 0.00 C ATOM 0 H ALA A 69 -10.854 -7.479 -1.940 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.293 -9.566 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.417 -9.994 -4.729 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.742 -8.806 -4.744 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.056 -8.260 -4.907 1.00 0.00 H new ATOM 1026 N LEU A 70 -7.895 -8.835 -1.207 1.00 0.00 N ATOM 1027 CA LEU A 70 -6.576 -9.092 -0.639 1.00 0.00 C ATOM 1028 C LEU A 70 -6.235 -10.578 -0.704 1.00 0.00 C ATOM 1029 O LEU A 70 -7.050 -11.392 -1.135 1.00 0.00 O ATOM 1030 CB LEU A 70 -6.519 -8.606 0.810 1.00 0.00 C ATOM 1031 CG LEU A 70 -6.790 -7.118 1.030 1.00 0.00 C ATOM 1032 CD1 LEU A 70 -7.177 -6.854 2.477 1.00 0.00 C ATOM 1033 CD2 LEU A 70 -5.573 -6.291 0.642 1.00 0.00 C ATOM 0 H LEU A 70 -8.546 -8.375 -0.570 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.841 -8.544 -1.228 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.243 -9.177 1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.533 -8.838 1.212 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.623 -6.822 0.393 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.366 -5.789 2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.078 -7.417 2.721 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.365 -7.166 3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.784 -5.234 0.805 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.721 -6.589 1.253 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.341 -6.456 -0.410 1.00 0.00 H new ATOM 1045 N GLU A 71 -5.027 -10.922 -0.270 1.00 0.00 N ATOM 1046 CA GLU A 71 -4.580 -12.310 -0.277 1.00 0.00 C ATOM 1047 C GLU A 71 -3.213 -12.445 0.386 1.00 0.00 C ATOM 1048 O GLU A 71 -2.426 -11.499 0.411 1.00 0.00 O ATOM 1049 CB GLU A 71 -4.519 -12.842 -1.710 1.00 0.00 C ATOM 1050 CG GLU A 71 -3.281 -12.398 -2.472 1.00 0.00 C ATOM 1051 CD GLU A 71 -3.274 -12.884 -3.908 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -3.064 -14.096 -4.123 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -3.478 -12.052 -4.817 1.00 0.00 O ATOM 0 H GLU A 71 -4.341 -10.259 0.091 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.300 -12.899 0.291 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.549 -13.931 -1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.406 -12.510 -2.250 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.223 -11.310 -2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.392 -12.770 -1.962 1.00 0.00 H new ATOM 1060 N LYS A 72 -2.936 -13.628 0.924 1.00 0.00 N ATOM 1061 CA LYS A 72 -1.665 -13.890 1.587 1.00 0.00 C ATOM 1062 C LYS A 72 -0.517 -13.201 0.855 1.00 0.00 C ATOM 1063 O LYS A 72 0.335 -12.566 1.476 1.00 0.00 O ATOM 1064 CB LYS A 72 -1.405 -15.396 1.661 1.00 0.00 C ATOM 1065 CG LYS A 72 -2.165 -16.091 2.778 1.00 0.00 C ATOM 1066 CD LYS A 72 -2.222 -17.594 2.564 1.00 0.00 C ATOM 1067 CE LYS A 72 -3.433 -17.993 1.736 1.00 0.00 C ATOM 1068 NZ LYS A 72 -3.257 -19.331 1.105 1.00 0.00 N ATOM 0 H LYS A 72 -3.577 -14.422 0.913 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.722 -13.487 2.598 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.679 -15.851 0.709 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.337 -15.565 1.799 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.686 -15.877 3.733 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.178 -15.692 2.833 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.312 -17.926 2.064 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.257 -18.099 3.529 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.319 -18.004 2.371 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.605 -17.246 0.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.104 -19.567 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.426 -19.313 0.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.118 -20.048 1.845 1.00 0.00 H new ATOM 1082 N ALA A 73 -0.503 -13.330 -0.468 1.00 0.00 N ATOM 1083 CA ALA A 73 0.537 -12.716 -1.284 1.00 0.00 C ATOM 1084 C ALA A 73 0.535 -11.199 -1.127 1.00 0.00 C ATOM 1085 O ALA A 73 1.556 -10.599 -0.793 1.00 0.00 O ATOM 1086 CB ALA A 73 0.356 -13.099 -2.745 1.00 0.00 C ATOM 0 H ALA A 73 -1.200 -13.854 -0.997 1.00 0.00 H new ATOM 0 HA ALA A 73 1.502 -13.088 -0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.140 -12.633 -3.343 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.417 -14.182 -2.847 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.618 -12.756 -3.093 1.00 0.00 H new ATOM 1092 N ASP A 74 -0.618 -10.586 -1.372 1.00 0.00 N ATOM 1093 CA ASP A 74 -0.753 -9.139 -1.258 1.00 0.00 C ATOM 1094 C ASP A 74 0.061 -8.608 -0.083 1.00 0.00 C ATOM 1095 O ASP A 74 0.685 -7.550 -0.175 1.00 0.00 O ATOM 1096 CB ASP A 74 -2.224 -8.754 -1.090 1.00 0.00 C ATOM 1097 CG ASP A 74 -2.921 -8.538 -2.419 1.00 0.00 C ATOM 1098 OD1 ASP A 74 -2.445 -7.696 -3.209 1.00 0.00 O ATOM 1099 OD2 ASP A 74 -3.943 -9.211 -2.669 1.00 0.00 O ATOM 0 H ASP A 74 -1.472 -11.069 -1.651 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.370 -8.690 -2.175 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.741 -9.537 -0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.293 -7.843 -0.495 1.00 0.00 H new ATOM 1104 N SER A 75 0.050 -9.348 1.021 1.00 0.00 N ATOM 1105 CA SER A 75 0.784 -8.949 2.216 1.00 0.00 C ATOM 1106 C SER A 75 2.242 -8.646 1.883 1.00 0.00 C ATOM 1107 O SER A 75 3.034 -9.554 1.630 1.00 0.00 O ATOM 1108 CB SER A 75 0.710 -10.049 3.277 1.00 0.00 C ATOM 1109 OG SER A 75 1.703 -11.036 3.059 1.00 0.00 O ATOM 0 H SER A 75 -0.459 -10.227 1.113 1.00 0.00 H new ATOM 0 HA SER A 75 0.323 -8.043 2.609 1.00 0.00 H new ATOM 0 HB2 SER A 75 0.838 -9.612 4.267 1.00 0.00 H new ATOM 0 HB3 SER A 75 -0.277 -10.511 3.258 1.00 0.00 H new ATOM 0 HG SER A 75 1.341 -11.743 2.485 1.00 0.00 H new ATOM 1115 N ASP A 76 2.588 -7.364 1.885 1.00 0.00 N ATOM 1116 CA ASP A 76 3.950 -6.939 1.583 1.00 0.00 C ATOM 1117 C ASP A 76 4.159 -5.476 1.960 1.00 0.00 C ATOM 1118 O ASP A 76 3.259 -4.825 2.493 1.00 0.00 O ATOM 1119 CB ASP A 76 4.255 -7.145 0.099 1.00 0.00 C ATOM 1120 CG ASP A 76 5.728 -7.398 -0.160 1.00 0.00 C ATOM 1121 OD1 ASP A 76 6.532 -7.242 0.783 1.00 0.00 O ATOM 1122 OD2 ASP A 76 6.075 -7.754 -1.305 1.00 0.00 O ATOM 0 H ASP A 76 1.944 -6.600 2.092 1.00 0.00 H new ATOM 0 HA ASP A 76 4.633 -7.549 2.174 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.673 -7.988 -0.275 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.937 -6.265 -0.460 1.00 0.00 H new ATOM 1127 N THR A 77 5.353 -4.962 1.680 1.00 0.00 N ATOM 1128 CA THR A 77 5.682 -3.577 1.991 1.00 0.00 C ATOM 1129 C THR A 77 5.343 -2.657 0.824 1.00 0.00 C ATOM 1130 O THR A 77 5.883 -2.805 -0.273 1.00 0.00 O ATOM 1131 CB THR A 77 7.174 -3.418 2.340 1.00 0.00 C ATOM 1132 OG1 THR A 77 7.511 -4.264 3.445 1.00 0.00 O ATOM 1133 CG2 THR A 77 7.497 -1.972 2.685 1.00 0.00 C ATOM 0 H THR A 77 6.109 -5.485 1.238 1.00 0.00 H new ATOM 0 HA THR A 77 5.083 -3.296 2.857 1.00 0.00 H new ATOM 0 HB THR A 77 7.762 -3.707 1.469 1.00 0.00 H new ATOM 0 HG1 THR A 77 8.461 -4.158 3.660 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.556 -1.884 2.928 1.00 0.00 H new ATOM 0 HG22 THR A 77 7.266 -1.334 1.832 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.901 -1.661 3.543 1.00 0.00 H new ATOM 1141 N TYR A 78 4.448 -1.705 1.067 1.00 0.00 N ATOM 1142 CA TYR A 78 4.037 -0.761 0.035 1.00 0.00 C ATOM 1143 C TYR A 78 4.730 0.585 0.221 1.00 0.00 C ATOM 1144 O TYR A 78 5.113 0.952 1.332 1.00 0.00 O ATOM 1145 CB TYR A 78 2.519 -0.574 0.061 1.00 0.00 C ATOM 1146 CG TYR A 78 1.747 -1.857 -0.154 1.00 0.00 C ATOM 1147 CD1 TYR A 78 1.843 -2.908 0.749 1.00 0.00 C ATOM 1148 CD2 TYR A 78 0.923 -2.017 -1.261 1.00 0.00 C ATOM 1149 CE1 TYR A 78 1.141 -4.082 0.557 1.00 0.00 C ATOM 1150 CE2 TYR A 78 0.216 -3.187 -1.461 1.00 0.00 C ATOM 1151 CZ TYR A 78 0.328 -4.216 -0.549 1.00 0.00 C ATOM 1152 OH TYR A 78 -0.374 -5.383 -0.746 1.00 0.00 O ATOM 0 H TYR A 78 3.994 -1.567 1.970 1.00 0.00 H new ATOM 0 HA TYR A 78 4.330 -1.169 -0.932 1.00 0.00 H new ATOM 0 HB2 TYR A 78 2.231 -0.143 1.020 1.00 0.00 H new ATOM 0 HB3 TYR A 78 2.236 0.144 -0.709 1.00 0.00 H new ATOM 0 HD1 TYR A 78 2.478 -2.805 1.617 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.834 -1.213 -1.977 1.00 0.00 H new ATOM 0 HE1 TYR A 78 1.228 -4.890 1.268 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.421 -3.295 -2.327 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.088 -6.051 -0.089 1.00 0.00 H new ATOM 1162 N THR A 79 4.887 1.319 -0.876 1.00 0.00 N ATOM 1163 CA THR A 79 5.534 2.625 -0.837 1.00 0.00 C ATOM 1164 C THR A 79 4.743 3.654 -1.636 1.00 0.00 C ATOM 1165 O THR A 79 4.579 3.518 -2.849 1.00 0.00 O ATOM 1166 CB THR A 79 6.971 2.557 -1.387 1.00 0.00 C ATOM 1167 OG1 THR A 79 7.793 1.772 -0.516 1.00 0.00 O ATOM 1168 CG2 THR A 79 7.562 3.951 -1.530 1.00 0.00 C ATOM 0 H THR A 79 4.575 1.031 -1.803 1.00 0.00 H new ATOM 0 HA THR A 79 5.568 2.930 0.209 1.00 0.00 H new ATOM 0 HB THR A 79 6.938 2.091 -2.372 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.704 1.733 -0.874 1.00 0.00 H new ATOM 0 HG21 THR A 79 8.577 3.878 -1.920 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.951 4.537 -2.217 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.582 4.439 -0.556 1.00 0.00 H new ATOM 1176 N CYS A 80 4.257 4.682 -0.950 1.00 0.00 N ATOM 1177 CA CYS A 80 3.483 5.736 -1.598 1.00 0.00 C ATOM 1178 C CYS A 80 4.382 6.899 -2.003 1.00 0.00 C ATOM 1179 O CYS A 80 4.873 7.643 -1.154 1.00 0.00 O ATOM 1180 CB CYS A 80 2.377 6.231 -0.665 1.00 0.00 C ATOM 1181 SG CYS A 80 1.535 7.722 -1.245 1.00 0.00 S ATOM 0 H CYS A 80 4.385 4.809 0.054 1.00 0.00 H new ATOM 0 HA CYS A 80 3.030 5.320 -2.498 1.00 0.00 H new ATOM 0 HB2 CYS A 80 1.641 5.437 -0.538 1.00 0.00 H new ATOM 0 HB3 CYS A 80 2.806 6.428 0.317 1.00 0.00 H new ATOM 0 HG CYS A 80 0.279 7.458 -1.453 1.00 0.00 H new ATOM 1187 N ASP A 81 4.594 7.049 -3.306 1.00 0.00 N ATOM 1188 CA ASP A 81 5.434 8.122 -3.825 1.00 0.00 C ATOM 1189 C ASP A 81 4.583 9.267 -4.366 1.00 0.00 C ATOM 1190 O ASP A 81 3.549 9.040 -4.996 1.00 0.00 O ATOM 1191 CB ASP A 81 6.355 7.591 -4.925 1.00 0.00 C ATOM 1192 CG ASP A 81 6.897 8.696 -5.810 1.00 0.00 C ATOM 1193 OD1 ASP A 81 7.810 9.422 -5.362 1.00 0.00 O ATOM 1194 OD2 ASP A 81 6.410 8.835 -6.951 1.00 0.00 O ATOM 0 H ASP A 81 4.196 6.441 -4.022 1.00 0.00 H new ATOM 0 HA ASP A 81 6.042 8.502 -3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 81 7.187 7.053 -4.470 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.809 6.874 -5.538 1.00 0.00 H new ATOM 1199 N ILE A 82 5.023 10.495 -4.114 1.00 0.00 N ATOM 1200 CA ILE A 82 4.301 11.674 -4.576 1.00 0.00 C ATOM 1201 C ILE A 82 5.142 12.485 -5.555 1.00 0.00 C ATOM 1202 O ILE A 82 4.615 13.282 -6.330 1.00 0.00 O ATOM 1203 CB ILE A 82 3.888 12.578 -3.399 1.00 0.00 C ATOM 1204 CG1 ILE A 82 5.087 12.839 -2.484 1.00 0.00 C ATOM 1205 CG2 ILE A 82 2.747 11.943 -2.618 1.00 0.00 C ATOM 1206 CD1 ILE A 82 4.768 13.747 -1.316 1.00 0.00 C ATOM 0 H ILE A 82 5.876 10.699 -3.593 1.00 0.00 H new ATOM 0 HA ILE A 82 3.404 11.317 -5.081 1.00 0.00 H new ATOM 0 HB ILE A 82 3.543 13.532 -3.796 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.458 11.887 -2.104 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.892 13.283 -3.070 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.467 12.594 -1.790 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.889 11.803 -3.276 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.067 10.977 -2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.663 13.888 -0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.426 14.712 -1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.985 13.295 -0.707 1.00 0.00 H new ATOM 1218 N GLY A 83 6.454 12.276 -5.515 1.00 0.00 N ATOM 1219 CA GLY A 83 7.348 12.994 -6.404 1.00 0.00 C ATOM 1220 C GLY A 83 8.574 13.526 -5.689 1.00 0.00 C ATOM 1221 O GLY A 83 9.674 13.519 -6.241 1.00 0.00 O ATOM 0 H GLY A 83 6.914 11.622 -4.882 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.661 12.332 -7.211 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.810 13.824 -6.862 1.00 0.00 H new ATOM 1225 N GLN A 84 8.383 13.991 -4.458 1.00 0.00 N ATOM 1226 CA GLN A 84 9.483 14.532 -3.668 1.00 0.00 C ATOM 1227 C GLN A 84 9.834 13.600 -2.513 1.00 0.00 C ATOM 1228 O GLN A 84 10.999 13.472 -2.138 1.00 0.00 O ATOM 1229 CB GLN A 84 9.118 15.917 -3.129 1.00 0.00 C ATOM 1230 CG GLN A 84 10.326 16.782 -2.808 1.00 0.00 C ATOM 1231 CD GLN A 84 10.977 17.359 -4.050 1.00 0.00 C ATOM 1232 OE1 GLN A 84 10.711 18.499 -4.432 1.00 0.00 O ATOM 1233 NE2 GLN A 84 11.837 16.573 -4.688 1.00 0.00 N ATOM 0 H GLN A 84 7.478 14.004 -3.987 1.00 0.00 H new ATOM 0 HA GLN A 84 10.354 14.620 -4.317 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.498 16.432 -3.863 1.00 0.00 H new ATOM 0 HB3 GLN A 84 8.515 15.800 -2.228 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.021 17.596 -2.151 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.058 16.188 -2.261 1.00 0.00 H new ATOM 0 HE21 GLN A 84 12.028 15.635 -4.336 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.306 16.908 -5.529 1.00 0.00 H new ATOM 1242 N ALA A 85 8.818 12.951 -1.954 1.00 0.00 N ATOM 1243 CA ALA A 85 9.019 12.030 -0.842 1.00 0.00 C ATOM 1244 C ALA A 85 8.226 10.743 -1.045 1.00 0.00 C ATOM 1245 O ALA A 85 7.381 10.659 -1.936 1.00 0.00 O ATOM 1246 CB ALA A 85 8.628 12.692 0.470 1.00 0.00 C ATOM 0 H ALA A 85 7.847 13.046 -2.253 1.00 0.00 H new ATOM 0 HA ALA A 85 10.077 11.772 -0.804 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.783 11.992 1.291 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.242 13.579 0.627 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.578 12.980 0.433 1.00 0.00 H new ATOM 1252 N GLN A 86 8.504 9.744 -0.214 1.00 0.00 N ATOM 1253 CA GLN A 86 7.817 8.462 -0.304 1.00 0.00 C ATOM 1254 C GLN A 86 7.615 7.854 1.080 1.00 0.00 C ATOM 1255 O GLN A 86 8.485 7.952 1.945 1.00 0.00 O ATOM 1256 CB GLN A 86 8.608 7.496 -1.188 1.00 0.00 C ATOM 1257 CG GLN A 86 8.941 8.061 -2.560 1.00 0.00 C ATOM 1258 CD GLN A 86 10.194 8.914 -2.550 1.00 0.00 C ATOM 1259 OE1 GLN A 86 11.142 8.637 -1.815 1.00 0.00 O ATOM 1260 NE2 GLN A 86 10.205 9.960 -3.369 1.00 0.00 N ATOM 0 H GLN A 86 9.200 9.798 0.529 1.00 0.00 H new ATOM 0 HA GLN A 86 6.838 8.634 -0.752 1.00 0.00 H new ATOM 0 HB2 GLN A 86 9.534 7.227 -0.680 1.00 0.00 H new ATOM 0 HB3 GLN A 86 8.035 6.577 -1.312 1.00 0.00 H new ATOM 0 HG2 GLN A 86 9.070 7.240 -3.265 1.00 0.00 H new ATOM 0 HG3 GLN A 86 8.102 8.658 -2.916 1.00 0.00 H new ATOM 0 HE21 GLN A 86 9.397 10.153 -3.961 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.021 10.570 -3.406 1.00 0.00 H new ATOM 1269 N SER A 87 6.461 7.226 1.282 1.00 0.00 N ATOM 1270 CA SER A 87 6.143 6.605 2.563 1.00 0.00 C ATOM 1271 C SER A 87 6.294 5.089 2.484 1.00 0.00 C ATOM 1272 O SER A 87 6.607 4.539 1.428 1.00 0.00 O ATOM 1273 CB SER A 87 4.718 6.965 2.988 1.00 0.00 C ATOM 1274 OG SER A 87 4.388 6.363 4.228 1.00 0.00 O ATOM 0 H SER A 87 5.731 7.134 0.576 1.00 0.00 H new ATOM 0 HA SER A 87 6.844 6.984 3.307 1.00 0.00 H new ATOM 0 HB2 SER A 87 4.622 8.048 3.069 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.014 6.639 2.223 1.00 0.00 H new ATOM 0 HG SER A 87 4.634 6.966 4.960 1.00 0.00 H new ATOM 1280 N ARG A 88 6.071 4.419 3.610 1.00 0.00 N ATOM 1281 CA ARG A 88 6.184 2.967 3.671 1.00 0.00 C ATOM 1282 C ARG A 88 5.218 2.389 4.701 1.00 0.00 C ATOM 1283 O ARG A 88 5.025 2.960 5.774 1.00 0.00 O ATOM 1284 CB ARG A 88 7.617 2.559 4.015 1.00 0.00 C ATOM 1285 CG ARG A 88 8.566 2.607 2.829 1.00 0.00 C ATOM 1286 CD ARG A 88 9.754 1.679 3.027 1.00 0.00 C ATOM 1287 NE ARG A 88 10.742 2.243 3.943 1.00 0.00 N ATOM 1288 CZ ARG A 88 11.470 3.319 3.666 1.00 0.00 C ATOM 1289 NH1 ARG A 88 11.320 3.944 2.506 1.00 0.00 N ATOM 1290 NH2 ARG A 88 12.349 3.773 4.550 1.00 0.00 N ATOM 0 H ARG A 88 5.811 4.859 4.493 1.00 0.00 H new ATOM 0 HA ARG A 88 5.925 2.567 2.691 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.995 3.216 4.798 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.610 1.548 4.423 1.00 0.00 H new ATOM 0 HG2 ARG A 88 8.031 2.326 1.922 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.920 3.628 2.687 1.00 0.00 H new ATOM 0 HD2 ARG A 88 9.406 0.722 3.414 1.00 0.00 H new ATOM 0 HD3 ARG A 88 10.224 1.481 2.064 1.00 0.00 H new ATOM 0 HE ARG A 88 10.880 1.786 4.844 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.644 3.599 1.824 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.880 4.770 2.296 1.00 0.00 H new ATOM 0 HH21 ARG A 88 12.466 3.296 5.444 1.00 0.00 H new ATOM 0 HH22 ARG A 88 12.907 4.599 4.336 1.00 0.00 H new ATOM 1304 N ALA A 89 4.613 1.254 4.366 1.00 0.00 N ATOM 1305 CA ALA A 89 3.668 0.599 5.262 1.00 0.00 C ATOM 1306 C ALA A 89 3.636 -0.907 5.020 1.00 0.00 C ATOM 1307 O ALA A 89 3.773 -1.364 3.886 1.00 0.00 O ATOM 1308 CB ALA A 89 2.278 1.192 5.090 1.00 0.00 C ATOM 0 H ALA A 89 4.761 0.769 3.481 1.00 0.00 H new ATOM 0 HA ALA A 89 3.999 0.770 6.286 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.583 0.693 5.766 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.306 2.257 5.320 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.947 1.052 4.061 1.00 0.00 H new ATOM 1314 N GLN A 90 3.455 -1.670 6.092 1.00 0.00 N ATOM 1315 CA GLN A 90 3.407 -3.124 5.995 1.00 0.00 C ATOM 1316 C GLN A 90 1.982 -3.635 6.180 1.00 0.00 C ATOM 1317 O GLN A 90 1.294 -3.258 7.130 1.00 0.00 O ATOM 1318 CB GLN A 90 4.328 -3.757 7.040 1.00 0.00 C ATOM 1319 CG GLN A 90 5.806 -3.553 6.751 1.00 0.00 C ATOM 1320 CD GLN A 90 6.671 -4.658 7.325 1.00 0.00 C ATOM 1321 OE1 GLN A 90 6.299 -5.309 8.302 1.00 0.00 O ATOM 1322 NE2 GLN A 90 7.833 -4.876 6.720 1.00 0.00 N ATOM 0 H GLN A 90 3.339 -1.306 7.038 1.00 0.00 H new ATOM 0 HA GLN A 90 3.749 -3.408 5.000 1.00 0.00 H new ATOM 0 HB2 GLN A 90 4.096 -3.337 8.019 1.00 0.00 H new ATOM 0 HB3 GLN A 90 4.121 -4.826 7.095 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.958 -3.501 5.673 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.124 -2.596 7.164 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.102 -4.313 5.913 1.00 0.00 H new ATOM 0 HE22 GLN A 90 8.457 -5.607 7.062 1.00 0.00 H new ATOM 1331 N LEU A 91 1.544 -4.495 5.267 1.00 0.00 N ATOM 1332 CA LEU A 91 0.200 -5.058 5.329 1.00 0.00 C ATOM 1333 C LEU A 91 0.243 -6.529 5.730 1.00 0.00 C ATOM 1334 O LEU A 91 1.227 -7.224 5.473 1.00 0.00 O ATOM 1335 CB LEU A 91 -0.501 -4.906 3.977 1.00 0.00 C ATOM 1336 CG LEU A 91 -1.870 -5.576 3.852 1.00 0.00 C ATOM 1337 CD1 LEU A 91 -2.842 -4.997 4.867 1.00 0.00 C ATOM 1338 CD2 LEU A 91 -2.414 -5.417 2.439 1.00 0.00 C ATOM 0 H LEU A 91 2.100 -4.818 4.475 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.362 -4.511 6.086 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.619 -3.843 3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.152 -5.312 3.204 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.753 -6.640 4.058 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.811 -5.486 4.763 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.458 -5.162 5.874 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.955 -3.927 4.693 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -3.389 -5.900 2.368 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -2.516 -4.357 2.205 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.727 -5.880 1.730 1.00 0.00 H new ATOM 1350 N LEU A 92 -0.829 -6.997 6.358 1.00 0.00 N ATOM 1351 CA LEU A 92 -0.915 -8.387 6.792 1.00 0.00 C ATOM 1352 C LEU A 92 -2.239 -9.012 6.363 1.00 0.00 C ATOM 1353 O LEU A 92 -3.312 -8.514 6.704 1.00 0.00 O ATOM 1354 CB LEU A 92 -0.765 -8.477 8.312 1.00 0.00 C ATOM 1355 CG LEU A 92 -0.894 -9.875 8.918 1.00 0.00 C ATOM 1356 CD1 LEU A 92 -0.123 -10.890 8.087 1.00 0.00 C ATOM 1357 CD2 LEU A 92 -0.403 -9.880 10.358 1.00 0.00 C ATOM 0 H LEU A 92 -1.651 -6.435 6.578 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.104 -8.940 6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.210 -8.073 8.585 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.516 -7.834 8.770 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.947 -10.156 8.913 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.226 -11.879 8.533 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.520 -10.906 7.072 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.931 -10.612 8.059 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.502 -10.883 10.773 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.644 -9.578 10.387 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.998 -9.183 10.948 1.00 0.00 H new ATOM 1369 N VAL A 93 -2.155 -10.106 5.613 1.00 0.00 N ATOM 1370 CA VAL A 93 -3.346 -10.801 5.139 1.00 0.00 C ATOM 1371 C VAL A 93 -3.626 -12.045 5.975 1.00 0.00 C ATOM 1372 O VAL A 93 -3.170 -13.140 5.648 1.00 0.00 O ATOM 1373 CB VAL A 93 -3.207 -11.210 3.661 1.00 0.00 C ATOM 1374 CG1 VAL A 93 -4.231 -12.276 3.303 1.00 0.00 C ATOM 1375 CG2 VAL A 93 -3.350 -9.996 2.756 1.00 0.00 C ATOM 0 H VAL A 93 -1.275 -10.530 5.321 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.179 -10.105 5.239 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.213 -11.631 3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -4.117 -12.552 2.255 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.075 -13.155 3.929 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.235 -11.886 3.469 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.249 -10.304 1.715 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.330 -9.543 2.907 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.574 -9.270 2.996 1.00 0.00 H new ATOM 1385 N GLN A 94 -4.379 -11.867 7.056 1.00 0.00 N ATOM 1386 CA GLN A 94 -4.720 -12.976 7.940 1.00 0.00 C ATOM 1387 C GLN A 94 -5.574 -14.009 7.212 1.00 0.00 C ATOM 1388 O GLN A 94 -6.703 -13.727 6.816 1.00 0.00 O ATOM 1389 CB GLN A 94 -5.461 -12.462 9.175 1.00 0.00 C ATOM 1390 CG GLN A 94 -4.570 -11.712 10.152 1.00 0.00 C ATOM 1391 CD GLN A 94 -5.125 -11.708 11.562 1.00 0.00 C ATOM 1392 OE1 GLN A 94 -6.335 -11.598 11.766 1.00 0.00 O ATOM 1393 NE2 GLN A 94 -4.242 -11.827 12.547 1.00 0.00 N ATOM 0 H GLN A 94 -4.764 -10.966 7.341 1.00 0.00 H new ATOM 0 HA GLN A 94 -3.793 -13.455 8.255 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -6.270 -11.805 8.856 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -5.921 -13.306 9.690 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -3.579 -12.166 10.157 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -4.448 -10.684 9.811 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -3.249 -11.916 12.333 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -4.557 -11.830 13.517 1.00 0.00 H new ATOM 1402 N GLY A 95 -5.025 -15.208 7.040 1.00 0.00 N ATOM 1403 CA GLY A 95 -5.750 -16.265 6.360 1.00 0.00 C ATOM 1404 C GLY A 95 -7.093 -16.553 7.002 1.00 0.00 C ATOM 1405 O GLY A 95 -7.204 -17.432 7.857 1.00 0.00 O ATOM 0 H GLY A 95 -4.091 -15.466 7.360 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -5.902 -15.985 5.318 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -5.148 -17.174 6.361 1.00 0.00 H new ATOM 1409 N ARG A 96 -8.115 -15.810 6.590 1.00 0.00 N ATOM 1410 CA ARG A 96 -9.456 -15.988 7.133 1.00 0.00 C ATOM 1411 C ARG A 96 -9.729 -17.459 7.437 1.00 0.00 C ATOM 1412 O ARG A 96 -9.831 -17.855 8.598 1.00 0.00 O ATOM 1413 CB ARG A 96 -10.502 -15.456 6.151 1.00 0.00 C ATOM 1414 CG ARG A 96 -11.933 -15.776 6.553 1.00 0.00 C ATOM 1415 CD ARG A 96 -12.896 -15.565 5.396 1.00 0.00 C ATOM 1416 NE ARG A 96 -14.287 -15.536 5.840 1.00 0.00 N ATOM 1417 CZ ARG A 96 -14.833 -14.507 6.479 1.00 0.00 C ATOM 1418 NH1 ARG A 96 -14.110 -13.429 6.746 1.00 0.00 N ATOM 1419 NH2 ARG A 96 -16.106 -14.556 6.851 1.00 0.00 N ATOM 0 H ARG A 96 -8.040 -15.079 5.882 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.522 -15.424 8.064 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.391 -14.375 6.065 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.308 -15.876 5.164 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -11.994 -16.809 6.895 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -12.226 -15.145 7.392 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.657 -14.629 4.892 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -12.765 -16.363 4.665 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.871 -16.350 5.649 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.132 -13.388 6.461 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -14.532 -12.641 7.237 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -16.666 -15.384 6.646 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -16.525 -13.766 7.342 1.00 0.00 H new ATOM 1433 N ARG A 97 -9.847 -18.262 6.385 1.00 0.00 N ATOM 1434 CA ARG A 97 -10.110 -19.688 6.538 1.00 0.00 C ATOM 1435 C ARG A 97 -9.521 -20.478 5.374 1.00 0.00 C ATOM 1436 O ARG A 97 -9.240 -19.922 4.312 1.00 0.00 O ATOM 1437 CB ARG A 97 -11.615 -19.944 6.632 1.00 0.00 C ATOM 1438 CG ARG A 97 -11.971 -21.230 7.359 1.00 0.00 C ATOM 1439 CD ARG A 97 -13.374 -21.171 7.942 1.00 0.00 C ATOM 1440 NE ARG A 97 -13.385 -20.601 9.287 1.00 0.00 N ATOM 1441 CZ ARG A 97 -12.773 -21.158 10.326 1.00 0.00 C ATOM 1442 NH1 ARG A 97 -12.105 -22.294 10.175 1.00 0.00 N ATOM 1443 NH2 ARG A 97 -12.829 -20.580 11.519 1.00 0.00 N ATOM 0 H ARG A 97 -9.765 -17.950 5.418 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.633 -20.022 7.459 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -12.086 -19.105 7.144 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.032 -19.978 5.626 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.898 -22.071 6.670 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -11.251 -21.409 8.158 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -14.012 -20.574 7.290 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -13.797 -22.175 7.970 1.00 0.00 H new ATOM 0 HE ARG A 97 -13.890 -19.728 9.436 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.060 -22.742 9.260 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.636 -22.720 10.974 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.342 -19.707 11.639 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -12.359 -21.009 12.316 1.00 0.00 H new ATOM 1457 N SER A 98 -9.335 -21.778 5.581 1.00 0.00 N ATOM 1458 CA SER A 98 -8.775 -22.644 4.550 1.00 0.00 C ATOM 1459 C SER A 98 -9.742 -23.773 4.205 1.00 0.00 C ATOM 1460 O SER A 98 -9.978 -24.671 5.012 1.00 0.00 O ATOM 1461 CB SER A 98 -7.438 -23.226 5.014 1.00 0.00 C ATOM 1462 OG SER A 98 -7.626 -24.171 6.052 1.00 0.00 O ATOM 0 H SER A 98 -9.564 -22.255 6.453 1.00 0.00 H new ATOM 0 HA SER A 98 -8.611 -22.043 3.655 1.00 0.00 H new ATOM 0 HB2 SER A 98 -6.933 -23.701 4.173 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.789 -22.422 5.363 1.00 0.00 H new ATOM 0 HG SER A 98 -8.568 -24.439 6.084 1.00 0.00 H new ATOM 1468 N GLY A 99 -10.298 -23.720 2.999 1.00 0.00 N ATOM 1469 CA GLY A 99 -11.232 -24.743 2.567 1.00 0.00 C ATOM 1470 C GLY A 99 -12.555 -24.163 2.108 1.00 0.00 C ATOM 1471 O GLY A 99 -13.540 -24.146 2.847 1.00 0.00 O ATOM 0 H GLY A 99 -10.118 -22.987 2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -10.788 -25.316 1.753 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.409 -25.439 3.387 1.00 0.00 H new ATOM 1475 N PRO A 100 -12.590 -23.673 0.860 1.00 0.00 N ATOM 1476 CA PRO A 100 -13.796 -23.080 0.276 1.00 0.00 C ATOM 1477 C PRO A 100 -14.880 -24.117 0.003 1.00 0.00 C ATOM 1478 O PRO A 100 -16.049 -23.776 -0.175 1.00 0.00 O ATOM 1479 CB PRO A 100 -13.294 -22.474 -1.037 1.00 0.00 C ATOM 1480 CG PRO A 100 -12.086 -23.274 -1.386 1.00 0.00 C ATOM 1481 CD PRO A 100 -11.454 -23.661 -0.077 1.00 0.00 C ATOM 0 HA PRO A 100 -14.258 -22.356 0.947 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -14.051 -22.539 -1.818 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.049 -21.419 -0.918 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -12.356 -24.157 -1.965 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.395 -22.692 -1.996 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -10.972 -24.637 -0.137 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -10.690 -22.946 0.227 1.00 0.00 H new ATOM 1489 N SER A 101 -14.483 -25.386 -0.028 1.00 0.00 N ATOM 1490 CA SER A 101 -15.420 -26.474 -0.283 1.00 0.00 C ATOM 1491 C SER A 101 -16.669 -26.328 0.582 1.00 0.00 C ATOM 1492 O SER A 101 -16.581 -26.032 1.773 1.00 0.00 O ATOM 1493 CB SER A 101 -14.753 -27.823 -0.012 1.00 0.00 C ATOM 1494 OG SER A 101 -14.711 -28.103 1.377 1.00 0.00 O ATOM 0 H SER A 101 -13.519 -25.685 0.120 1.00 0.00 H new ATOM 0 HA SER A 101 -15.717 -26.428 -1.331 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.299 -28.612 -0.529 1.00 0.00 H new ATOM 0 HB3 SER A 101 -13.741 -27.819 -0.416 1.00 0.00 H new ATOM 0 HG SER A 101 -14.281 -28.972 1.523 1.00 0.00 H new ATOM 1500 N SER A 102 -17.831 -26.539 -0.028 1.00 0.00 N ATOM 1501 CA SER A 102 -19.099 -26.428 0.683 1.00 0.00 C ATOM 1502 C SER A 102 -19.949 -27.678 0.476 1.00 0.00 C ATOM 1503 O SER A 102 -20.077 -28.177 -0.641 1.00 0.00 O ATOM 1504 CB SER A 102 -19.866 -25.191 0.212 1.00 0.00 C ATOM 1505 OG SER A 102 -19.289 -24.005 0.729 1.00 0.00 O ATOM 0 H SER A 102 -17.920 -26.788 -1.013 1.00 0.00 H new ATOM 0 HA SER A 102 -18.883 -26.329 1.747 1.00 0.00 H new ATOM 0 HB2 SER A 102 -19.868 -25.153 -0.877 1.00 0.00 H new ATOM 0 HB3 SER A 102 -20.906 -25.261 0.530 1.00 0.00 H new ATOM 0 HG SER A 102 -18.353 -23.946 0.446 1.00 0.00 H new ATOM 1511 N GLY A 103 -20.530 -28.178 1.563 1.00 0.00 N ATOM 1512 CA GLY A 103 -21.361 -29.365 1.480 1.00 0.00 C ATOM 1513 C GLY A 103 -20.574 -30.596 1.076 1.00 0.00 C ATOM 1514 O GLY A 103 -20.114 -31.354 1.929 1.00 0.00 O ATOM 0 H GLY A 103 -20.440 -27.782 2.499 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -21.835 -29.541 2.446 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -22.160 -29.196 0.759 1.00 0.00 H new TER 1518 GLY A 103