USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1060 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 69 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 114 THR OG1 : rot -83:sc= 0.626 USER MOD Set 2.1: A 49 TYR OH : rot 180:sc= 0.156 USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 132 LYS NZ :NH3+ -119:sc= -0.313 (180deg=-0.341) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc=-0.00797 (180deg=-0.36) USER MOD Single : A 8 SER OG : rot -26:sc= 0.172 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.105 USER MOD Single : A 15 SER OG : rot 180:sc=-0.00553 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -161:sc= -0.151 (180deg=-0.627) USER MOD Single : A 38 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.0018) USER MOD Single : A 41 GLN : amide:sc= -0.102 X(o=-0.1,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 45 MET CE :methyl 156:sc= -0.19 (180deg=-0.842) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.358 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.35 X(o=-1.4,f=-1) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -174:sc= 0.324 (180deg=0.311) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.37) USER MOD Single : A 83 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.094) USER MOD Single : A 89 ASN : amide:sc= -1.69 K(o=-1.7,f=-0.11) USER MOD Single : A 90 MET CE :methyl -151:sc= 0 (180deg=-0.00453) USER MOD Single : A 94 THR OG1 : rot -85:sc= 1.2 USER MOD Single : A 95 THR OG1 : rot 78:sc= 1.04 USER MOD Single : A 96 THR OG1 : rot 80:sc= 0.947 USER MOD Single : A 98 GLN : amide:sc= -0.489 X(o=-0.49,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.187 K(o=-0.19,f=-2.5) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl 137:sc= -0.24 (180deg=-1.27) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 160:sc= -0.135 (180deg=-0.753) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.577 -29.726 18.296 1.00 0.00 N ATOM 2 CA MET A 1 15.514 -29.721 17.141 1.00 0.00 C ATOM 3 C MET A 1 15.639 -28.322 16.547 1.00 0.00 C ATOM 4 O MET A 1 16.726 -27.901 16.149 1.00 0.00 O ATOM 5 CB MET A 1 15.031 -30.698 16.066 1.00 0.00 C ATOM 6 CG MET A 1 14.889 -32.128 16.560 1.00 0.00 C ATOM 7 SD MET A 1 14.356 -33.261 15.263 1.00 0.00 S ATOM 8 CE MET A 1 14.207 -34.788 16.185 1.00 0.00 C ATOM 0 H1 MET A 1 14.673 -30.621 18.817 1.00 0.00 H new ATOM 0 H2 MET A 1 14.802 -28.932 18.929 1.00 0.00 H new ATOM 0 H3 MET A 1 13.601 -29.629 17.951 1.00 0.00 H new ATOM 0 HA MET A 1 16.495 -30.034 17.499 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.069 -30.358 15.684 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.730 -30.679 15.230 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.844 -32.466 16.962 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.170 -32.156 17.379 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.884 -35.586 15.517 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.173 -35.047 16.619 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.473 -34.662 16.981 1.00 0.00 H new ATOM 18 N ASP A 2 14.520 -27.605 16.490 1.00 0.00 N ATOM 19 CA ASP A 2 14.507 -26.252 15.944 1.00 0.00 C ATOM 20 C ASP A 2 14.694 -25.217 17.049 1.00 0.00 C ATOM 21 O ASP A 2 14.316 -25.446 18.198 1.00 0.00 O ATOM 22 CB ASP A 2 13.195 -25.992 15.202 1.00 0.00 C ATOM 23 CG ASP A 2 12.964 -26.973 14.069 1.00 0.00 C ATOM 24 OD1 ASP A 2 13.476 -26.726 12.958 1.00 0.00 O ATOM 25 OD2 ASP A 2 12.271 -27.987 14.294 1.00 0.00 O ATOM 0 H ASP A 2 13.612 -27.938 16.815 1.00 0.00 H new ATOM 0 HA ASP A 2 15.337 -26.162 15.243 1.00 0.00 H new ATOM 0 HB2 ASP A 2 12.365 -26.053 15.906 1.00 0.00 H new ATOM 0 HB3 ASP A 2 13.201 -24.977 14.804 1.00 0.00 H new ATOM 30 N ALA A 3 15.280 -24.078 16.694 1.00 0.00 N ATOM 31 CA ALA A 3 15.517 -23.008 17.656 1.00 0.00 C ATOM 32 C ALA A 3 15.376 -21.639 16.999 1.00 0.00 C ATOM 33 O ALA A 3 15.792 -20.624 17.561 1.00 0.00 O ATOM 34 CB ALA A 3 16.898 -23.158 18.279 1.00 0.00 C ATOM 0 H ALA A 3 15.599 -23.872 15.747 1.00 0.00 H new ATOM 0 HA ALA A 3 14.765 -23.083 18.442 1.00 0.00 H new ATOM 0 HB1 ALA A 3 17.063 -22.353 18.995 1.00 0.00 H new ATOM 0 HB2 ALA A 3 16.964 -24.118 18.790 1.00 0.00 H new ATOM 0 HB3 ALA A 3 17.657 -23.110 17.498 1.00 0.00 H new ATOM 40 N LEU A 4 14.785 -21.618 15.806 1.00 0.00 N ATOM 41 CA LEU A 4 14.583 -20.376 15.064 1.00 0.00 C ATOM 42 C LEU A 4 15.913 -19.676 14.798 1.00 0.00 C ATOM 43 O LEU A 4 16.980 -20.235 15.051 1.00 0.00 O ATOM 44 CB LEU A 4 13.642 -19.437 15.826 1.00 0.00 C ATOM 45 CG LEU A 4 12.177 -19.881 15.885 1.00 0.00 C ATOM 46 CD1 LEU A 4 12.006 -21.069 16.820 1.00 0.00 C ATOM 47 CD2 LEU A 4 11.290 -18.724 16.324 1.00 0.00 C ATOM 0 H LEU A 4 14.436 -22.451 15.331 1.00 0.00 H new ATOM 0 HA LEU A 4 14.128 -20.631 14.107 1.00 0.00 H new ATOM 0 HB2 LEU A 4 14.012 -19.328 16.845 1.00 0.00 H new ATOM 0 HB3 LEU A 4 13.687 -18.451 15.363 1.00 0.00 H new ATOM 0 HG LEU A 4 11.875 -20.192 14.885 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.957 -21.365 16.844 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.610 -21.903 16.463 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.328 -20.791 17.824 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.252 -19.055 16.361 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.598 -18.384 17.313 1.00 0.00 H new ATOM 0 HD23 LEU A 4 11.384 -17.903 15.613 1.00 0.00 H new ATOM 59 N GLU A 5 15.840 -18.453 14.283 1.00 0.00 N ATOM 60 CA GLU A 5 17.040 -17.677 13.982 1.00 0.00 C ATOM 61 C GLU A 5 17.134 -16.450 14.883 1.00 0.00 C ATOM 62 O GLU A 5 16.415 -15.468 14.688 1.00 0.00 O ATOM 63 CB GLU A 5 17.040 -17.247 12.515 1.00 0.00 C ATOM 64 CG GLU A 5 18.289 -16.485 12.100 1.00 0.00 C ATOM 65 CD GLU A 5 18.286 -16.122 10.628 1.00 0.00 C ATOM 66 OE1 GLU A 5 17.780 -15.033 10.286 1.00 0.00 O ATOM 67 OE2 GLU A 5 18.789 -16.928 9.817 1.00 0.00 O ATOM 0 H GLU A 5 14.964 -17.977 14.065 1.00 0.00 H new ATOM 0 HA GLU A 5 17.908 -18.310 14.168 1.00 0.00 H new ATOM 0 HB2 GLU A 5 16.940 -18.132 11.886 1.00 0.00 H new ATOM 0 HB3 GLU A 5 16.166 -16.623 12.329 1.00 0.00 H new ATOM 0 HG2 GLU A 5 18.370 -15.575 12.695 1.00 0.00 H new ATOM 0 HG3 GLU A 5 19.169 -17.089 12.320 1.00 0.00 H new ATOM 74 N GLY A 6 18.022 -16.512 15.871 1.00 0.00 N ATOM 75 CA GLY A 6 18.194 -15.397 16.783 1.00 0.00 C ATOM 76 C GLY A 6 19.128 -14.338 16.232 1.00 0.00 C ATOM 77 O GLY A 6 19.947 -14.620 15.356 1.00 0.00 O ATOM 0 H GLY A 6 18.625 -17.314 16.056 1.00 0.00 H new ATOM 0 HA2 GLY A 6 17.223 -14.948 16.991 1.00 0.00 H new ATOM 0 HA3 GLY A 6 18.585 -15.764 17.732 1.00 0.00 H new ATOM 81 N GLU A 7 19.008 -13.118 16.746 1.00 0.00 N ATOM 82 CA GLU A 7 19.851 -12.014 16.298 1.00 0.00 C ATOM 83 C GLU A 7 21.156 -11.972 17.086 1.00 0.00 C ATOM 84 O GLU A 7 21.161 -11.683 18.283 1.00 0.00 O ATOM 85 CB GLU A 7 19.112 -10.683 16.447 1.00 0.00 C ATOM 86 CG GLU A 7 17.826 -10.603 15.638 1.00 0.00 C ATOM 87 CD GLU A 7 18.058 -10.789 14.151 1.00 0.00 C ATOM 88 OE1 GLU A 7 18.300 -9.779 13.457 1.00 0.00 O ATOM 89 OE2 GLU A 7 17.998 -11.944 13.681 1.00 0.00 O ATOM 0 H GLU A 7 18.336 -12.869 17.472 1.00 0.00 H new ATOM 0 HA GLU A 7 20.085 -12.175 15.246 1.00 0.00 H new ATOM 0 HB2 GLU A 7 18.879 -10.523 17.500 1.00 0.00 H new ATOM 0 HB3 GLU A 7 19.774 -9.874 16.140 1.00 0.00 H new ATOM 0 HG2 GLU A 7 17.131 -11.365 15.991 1.00 0.00 H new ATOM 0 HG3 GLU A 7 17.353 -9.636 15.810 1.00 0.00 H new ATOM 96 N SER A 8 22.262 -12.264 16.408 1.00 0.00 N ATOM 97 CA SER A 8 23.574 -12.259 17.044 1.00 0.00 C ATOM 98 C SER A 8 24.554 -11.389 16.263 1.00 0.00 C ATOM 99 O SER A 8 25.635 -11.061 16.753 1.00 0.00 O ATOM 100 CB SER A 8 24.117 -13.684 17.156 1.00 0.00 C ATOM 101 OG SER A 8 25.396 -13.696 17.766 1.00 0.00 O ATOM 0 H SER A 8 22.275 -12.507 15.417 1.00 0.00 H new ATOM 0 HA SER A 8 23.462 -11.841 18.045 1.00 0.00 H new ATOM 0 HB2 SER A 8 23.427 -14.295 17.738 1.00 0.00 H new ATOM 0 HB3 SER A 8 24.179 -14.132 16.164 1.00 0.00 H new ATOM 0 HG SER A 8 25.842 -12.838 17.608 1.00 0.00 H new ATOM 107 N PHE A 9 24.169 -11.019 15.045 1.00 0.00 N ATOM 108 CA PHE A 9 25.015 -10.186 14.197 1.00 0.00 C ATOM 109 C PHE A 9 25.199 -8.801 14.805 1.00 0.00 C ATOM 110 O PHE A 9 24.283 -8.255 15.420 1.00 0.00 O ATOM 111 CB PHE A 9 24.410 -10.063 12.797 1.00 0.00 C ATOM 112 CG PHE A 9 24.235 -11.381 12.099 1.00 0.00 C ATOM 113 CD1 PHE A 9 25.326 -12.043 11.557 1.00 0.00 C ATOM 114 CD2 PHE A 9 22.981 -11.957 11.983 1.00 0.00 C ATOM 115 CE1 PHE A 9 25.168 -13.256 10.913 1.00 0.00 C ATOM 116 CE2 PHE A 9 22.816 -13.169 11.341 1.00 0.00 C ATOM 117 CZ PHE A 9 23.911 -13.819 10.805 1.00 0.00 C ATOM 0 H PHE A 9 23.278 -11.282 14.624 1.00 0.00 H new ATOM 0 HA PHE A 9 25.992 -10.664 14.122 1.00 0.00 H new ATOM 0 HB2 PHE A 9 23.441 -9.569 12.871 1.00 0.00 H new ATOM 0 HB3 PHE A 9 25.049 -9.422 12.190 1.00 0.00 H new ATOM 0 HD1 PHE A 9 26.310 -11.606 11.639 1.00 0.00 H new ATOM 0 HD2 PHE A 9 22.122 -11.453 12.399 1.00 0.00 H new ATOM 0 HE1 PHE A 9 26.025 -13.763 10.495 1.00 0.00 H new ATOM 0 HE2 PHE A 9 21.833 -13.608 11.258 1.00 0.00 H new ATOM 0 HZ PHE A 9 23.784 -14.766 10.302 1.00 0.00 H new ATOM 127 N ALA A 10 26.390 -8.239 14.630 1.00 0.00 N ATOM 128 CA ALA A 10 26.698 -6.915 15.157 1.00 0.00 C ATOM 129 C ALA A 10 26.599 -5.859 14.064 1.00 0.00 C ATOM 130 O ALA A 10 26.361 -4.683 14.341 1.00 0.00 O ATOM 131 CB ALA A 10 28.085 -6.906 15.780 1.00 0.00 C ATOM 0 H ALA A 10 27.159 -8.681 14.126 1.00 0.00 H new ATOM 0 HA ALA A 10 25.966 -6.675 15.928 1.00 0.00 H new ATOM 0 HB1 ALA A 10 28.302 -5.911 16.170 1.00 0.00 H new ATOM 0 HB2 ALA A 10 28.123 -7.631 16.593 1.00 0.00 H new ATOM 0 HB3 ALA A 10 28.825 -7.169 15.024 1.00 0.00 H new ATOM 137 N LEU A 11 26.785 -6.289 12.819 1.00 0.00 N ATOM 138 CA LEU A 11 26.717 -5.384 11.678 1.00 0.00 C ATOM 139 C LEU A 11 25.384 -5.526 10.950 1.00 0.00 C ATOM 140 O LEU A 11 24.761 -6.588 10.979 1.00 0.00 O ATOM 141 CB LEU A 11 27.882 -5.651 10.719 1.00 0.00 C ATOM 142 CG LEU A 11 28.044 -7.106 10.265 1.00 0.00 C ATOM 143 CD1 LEU A 11 27.161 -7.396 9.061 1.00 0.00 C ATOM 144 CD2 LEU A 11 29.501 -7.401 9.943 1.00 0.00 C ATOM 0 H LEU A 11 26.984 -7.259 12.576 1.00 0.00 H new ATOM 0 HA LEU A 11 26.794 -4.361 12.047 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.753 -5.026 9.836 1.00 0.00 H new ATOM 0 HB3 LEU A 11 28.807 -5.334 11.202 1.00 0.00 H new ATOM 0 HG LEU A 11 27.731 -7.757 11.081 1.00 0.00 H new ATOM 0 HD11 LEU A 11 27.292 -8.434 8.756 1.00 0.00 H new ATOM 0 HD12 LEU A 11 26.118 -7.224 9.325 1.00 0.00 H new ATOM 0 HD13 LEU A 11 27.440 -6.738 8.238 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.600 -8.438 9.622 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.838 -6.740 9.144 1.00 0.00 H new ATOM 0 HD23 LEU A 11 30.111 -7.236 10.832 1.00 0.00 H new ATOM 156 N SER A 12 24.951 -4.450 10.302 1.00 0.00 N ATOM 157 CA SER A 12 23.690 -4.453 9.568 1.00 0.00 C ATOM 158 C SER A 12 23.898 -4.911 8.129 1.00 0.00 C ATOM 159 O SER A 12 25.020 -5.201 7.715 1.00 0.00 O ATOM 160 CB SER A 12 23.063 -3.058 9.587 1.00 0.00 C ATOM 161 OG SER A 12 22.821 -2.625 10.914 1.00 0.00 O ATOM 0 H SER A 12 25.455 -3.564 10.270 1.00 0.00 H new ATOM 0 HA SER A 12 23.015 -5.154 10.058 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.725 -2.352 9.086 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.127 -3.069 9.029 1.00 0.00 H new ATOM 0 HG SER A 12 22.422 -1.730 10.898 1.00 0.00 H new ATOM 167 N PHE A 13 22.807 -4.974 7.371 1.00 0.00 N ATOM 168 CA PHE A 13 22.867 -5.397 5.976 1.00 0.00 C ATOM 169 C PHE A 13 23.763 -4.469 5.163 1.00 0.00 C ATOM 170 O PHE A 13 24.905 -4.812 4.850 1.00 0.00 O ATOM 171 CB PHE A 13 21.462 -5.430 5.371 1.00 0.00 C ATOM 172 CG PHE A 13 20.536 -6.391 6.059 1.00 0.00 C ATOM 173 CD1 PHE A 13 20.491 -7.723 5.681 1.00 0.00 C ATOM 174 CD2 PHE A 13 19.710 -5.963 7.086 1.00 0.00 C ATOM 175 CE1 PHE A 13 19.640 -8.610 6.313 1.00 0.00 C ATOM 176 CE2 PHE A 13 18.857 -6.845 7.723 1.00 0.00 C ATOM 177 CZ PHE A 13 18.822 -8.170 7.336 1.00 0.00 C ATOM 0 H PHE A 13 21.871 -4.737 7.700 1.00 0.00 H new ATOM 0 HA PHE A 13 23.292 -6.400 5.944 1.00 0.00 H new ATOM 0 HB2 PHE A 13 21.032 -4.429 5.415 1.00 0.00 H new ATOM 0 HB3 PHE A 13 21.535 -5.699 4.317 1.00 0.00 H new ATOM 0 HD1 PHE A 13 21.129 -8.073 4.883 1.00 0.00 H new ATOM 0 HD2 PHE A 13 19.733 -4.928 7.393 1.00 0.00 H new ATOM 0 HE1 PHE A 13 19.614 -9.646 6.008 1.00 0.00 H new ATOM 0 HE2 PHE A 13 18.219 -6.498 8.522 1.00 0.00 H new ATOM 0 HZ PHE A 13 18.157 -8.861 7.832 1.00 0.00 H new ATOM 187 N SER A 14 23.242 -3.293 4.826 1.00 0.00 N ATOM 188 CA SER A 14 23.995 -2.315 4.050 1.00 0.00 C ATOM 189 C SER A 14 23.258 -0.981 3.993 1.00 0.00 C ATOM 190 O SER A 14 23.738 0.026 4.515 1.00 0.00 O ATOM 191 CB SER A 14 24.242 -2.837 2.632 1.00 0.00 C ATOM 192 OG SER A 14 23.022 -3.145 1.980 1.00 0.00 O ATOM 0 H SER A 14 22.300 -2.995 5.079 1.00 0.00 H new ATOM 0 HA SER A 14 24.954 -2.158 4.543 1.00 0.00 H new ATOM 0 HB2 SER A 14 24.787 -2.089 2.056 1.00 0.00 H new ATOM 0 HB3 SER A 14 24.870 -3.727 2.673 1.00 0.00 H new ATOM 0 HG SER A 14 23.208 -3.474 1.076 1.00 0.00 H new ATOM 198 N SER A 15 22.089 -0.984 3.359 1.00 0.00 N ATOM 199 CA SER A 15 21.281 0.224 3.233 1.00 0.00 C ATOM 200 C SER A 15 19.899 -0.104 2.679 1.00 0.00 C ATOM 201 O SER A 15 18.905 0.513 3.060 1.00 0.00 O ATOM 202 CB SER A 15 21.979 1.239 2.325 1.00 0.00 C ATOM 203 OG SER A 15 21.207 2.419 2.191 1.00 0.00 O ATOM 0 H SER A 15 21.680 -1.811 2.924 1.00 0.00 H new ATOM 0 HA SER A 15 21.163 0.658 4.226 1.00 0.00 H new ATOM 0 HB2 SER A 15 22.958 1.486 2.736 1.00 0.00 H new ATOM 0 HB3 SER A 15 22.147 0.797 1.343 1.00 0.00 H new ATOM 0 HG SER A 15 21.675 3.052 1.607 1.00 0.00 H new ATOM 209 N ALA A 16 19.845 -1.085 1.782 1.00 0.00 N ATOM 210 CA ALA A 16 18.587 -1.498 1.169 1.00 0.00 C ATOM 211 C ALA A 16 17.571 -1.931 2.221 1.00 0.00 C ATOM 212 O ALA A 16 16.366 -1.938 1.967 1.00 0.00 O ATOM 213 CB ALA A 16 18.832 -2.625 0.177 1.00 0.00 C ATOM 0 H ALA A 16 20.660 -1.609 1.463 1.00 0.00 H new ATOM 0 HA ALA A 16 18.174 -0.640 0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 16 17.886 -2.925 -0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 16 19.513 -2.282 -0.602 1.00 0.00 H new ATOM 0 HB3 ALA A 16 19.273 -3.477 0.695 1.00 0.00 H new ATOM 219 N SER A 17 18.063 -2.291 3.402 1.00 0.00 N ATOM 220 CA SER A 17 17.197 -2.727 4.491 1.00 0.00 C ATOM 221 C SER A 17 17.512 -1.969 5.777 1.00 0.00 C ATOM 222 O SER A 17 17.154 -2.407 6.870 1.00 0.00 O ATOM 223 CB SER A 17 17.353 -4.231 4.720 1.00 0.00 C ATOM 224 OG SER A 17 17.037 -4.961 3.547 1.00 0.00 O ATOM 0 H SER A 17 19.057 -2.289 3.629 1.00 0.00 H new ATOM 0 HA SER A 17 16.166 -2.513 4.210 1.00 0.00 H new ATOM 0 HB2 SER A 17 18.376 -4.451 5.025 1.00 0.00 H new ATOM 0 HB3 SER A 17 16.702 -4.547 5.535 1.00 0.00 H new ATOM 0 HG SER A 17 17.146 -5.920 3.719 1.00 0.00 H new ATOM 230 N ASP A 18 18.179 -0.826 5.640 1.00 0.00 N ATOM 231 CA ASP A 18 18.540 -0.011 6.796 1.00 0.00 C ATOM 232 C ASP A 18 18.316 1.471 6.521 1.00 0.00 C ATOM 233 O ASP A 18 17.244 2.011 6.795 1.00 0.00 O ATOM 234 CB ASP A 18 19.998 -0.259 7.188 1.00 0.00 C ATOM 235 CG ASP A 18 20.422 0.561 8.390 1.00 0.00 C ATOM 236 OD1 ASP A 18 20.210 0.098 9.531 1.00 0.00 O ATOM 237 OD2 ASP A 18 20.965 1.669 8.192 1.00 0.00 O ATOM 0 H ASP A 18 18.480 -0.444 4.743 1.00 0.00 H new ATOM 0 HA ASP A 18 17.894 -0.303 7.624 1.00 0.00 H new ATOM 0 HB2 ASP A 18 20.137 -1.318 7.407 1.00 0.00 H new ATOM 0 HB3 ASP A 18 20.644 -0.020 6.343 1.00 0.00 H new ATOM 242 N ALA A 19 19.334 2.123 5.976 1.00 0.00 N ATOM 243 CA ALA A 19 19.258 3.548 5.670 1.00 0.00 C ATOM 244 C ALA A 19 18.269 3.827 4.543 1.00 0.00 C ATOM 245 O ALA A 19 17.328 4.605 4.709 1.00 0.00 O ATOM 246 CB ALA A 19 20.636 4.083 5.312 1.00 0.00 C ATOM 0 H ALA A 19 20.225 1.688 5.736 1.00 0.00 H new ATOM 0 HA ALA A 19 18.897 4.062 6.561 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.566 5.147 5.086 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.314 3.935 6.153 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.018 3.551 4.440 1.00 0.00 H new ATOM 252 N GLU A 20 18.489 3.193 3.396 1.00 0.00 N ATOM 253 CA GLU A 20 17.621 3.380 2.238 1.00 0.00 C ATOM 254 C GLU A 20 16.196 2.918 2.532 1.00 0.00 C ATOM 255 O GLU A 20 15.232 3.537 2.084 1.00 0.00 O ATOM 256 CB GLU A 20 18.174 2.625 1.027 1.00 0.00 C ATOM 257 CG GLU A 20 17.376 2.847 -0.246 1.00 0.00 C ATOM 258 CD GLU A 20 17.940 2.082 -1.429 1.00 0.00 C ATOM 259 OE1 GLU A 20 17.549 0.911 -1.620 1.00 0.00 O ATOM 260 OE2 GLU A 20 18.773 2.654 -2.164 1.00 0.00 O ATOM 0 H GLU A 20 19.261 2.545 3.243 1.00 0.00 H new ATOM 0 HA GLU A 20 17.595 4.446 2.013 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.206 2.934 0.857 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.193 1.559 1.252 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.343 2.542 -0.080 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.361 3.911 -0.480 1.00 0.00 H new ATOM 267 N PHE A 21 16.069 1.830 3.285 1.00 0.00 N ATOM 268 CA PHE A 21 14.755 1.293 3.628 1.00 0.00 C ATOM 269 C PHE A 21 13.947 2.303 4.436 1.00 0.00 C ATOM 270 O PHE A 21 12.830 2.658 4.060 1.00 0.00 O ATOM 271 CB PHE A 21 14.896 -0.010 4.419 1.00 0.00 C ATOM 272 CG PHE A 21 13.583 -0.687 4.694 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.852 -0.379 5.832 1.00 0.00 C ATOM 274 CD2 PHE A 21 13.077 -1.629 3.813 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.644 -0.998 6.085 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.868 -2.251 4.061 1.00 0.00 C ATOM 277 CZ PHE A 21 11.151 -1.935 5.199 1.00 0.00 C ATOM 0 H PHE A 21 16.855 1.305 3.668 1.00 0.00 H new ATOM 0 HA PHE A 21 14.225 1.088 2.698 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.540 -0.694 3.866 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.393 0.201 5.366 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.232 0.354 6.528 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.634 -1.880 2.922 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.085 -0.749 6.975 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.484 -2.983 3.366 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.206 -2.420 5.395 1.00 0.00 H new ATOM 287 N ASP A 22 14.518 2.761 5.547 1.00 0.00 N ATOM 288 CA ASP A 22 13.849 3.734 6.405 1.00 0.00 C ATOM 289 C ASP A 22 13.480 4.986 5.619 1.00 0.00 C ATOM 290 O ASP A 22 12.478 5.641 5.910 1.00 0.00 O ATOM 291 CB ASP A 22 14.742 4.102 7.591 1.00 0.00 C ATOM 292 CG ASP A 22 14.682 3.072 8.701 1.00 0.00 C ATOM 293 OD1 ASP A 22 13.788 3.185 9.567 1.00 0.00 O ATOM 294 OD2 ASP A 22 15.525 2.152 8.706 1.00 0.00 O ATOM 0 H ASP A 22 15.441 2.474 5.874 1.00 0.00 H new ATOM 0 HA ASP A 22 12.932 3.280 6.781 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.772 4.204 7.249 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.439 5.073 7.983 1.00 0.00 H new ATOM 299 N ALA A 23 14.297 5.312 4.622 1.00 0.00 N ATOM 300 CA ALA A 23 14.053 6.480 3.787 1.00 0.00 C ATOM 301 C ALA A 23 12.729 6.343 3.046 1.00 0.00 C ATOM 302 O ALA A 23 11.920 7.270 3.024 1.00 0.00 O ATOM 303 CB ALA A 23 15.197 6.673 2.802 1.00 0.00 C ATOM 0 H ALA A 23 15.133 4.783 4.374 1.00 0.00 H new ATOM 0 HA ALA A 23 13.995 7.358 4.430 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.001 7.550 2.184 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.129 6.816 3.350 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.282 5.792 2.166 1.00 0.00 H new ATOM 309 N VAL A 24 12.515 5.176 2.442 1.00 0.00 N ATOM 310 CA VAL A 24 11.287 4.912 1.703 1.00 0.00 C ATOM 311 C VAL A 24 10.073 5.020 2.616 1.00 0.00 C ATOM 312 O VAL A 24 9.025 5.526 2.214 1.00 0.00 O ATOM 313 CB VAL A 24 11.306 3.514 1.055 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.053 3.291 0.224 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.555 3.336 0.206 1.00 0.00 C ATOM 0 H VAL A 24 13.177 4.400 2.451 1.00 0.00 H new ATOM 0 HA VAL A 24 11.221 5.663 0.916 1.00 0.00 H new ATOM 0 HB VAL A 24 11.324 2.768 1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.086 2.298 -0.225 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.174 3.371 0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.000 4.043 -0.563 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.551 2.343 -0.243 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.571 4.090 -0.581 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.440 3.447 0.833 1.00 0.00 H new ATOM 325 N VAL A 25 10.223 4.543 3.849 1.00 0.00 N ATOM 326 CA VAL A 25 9.138 4.592 4.820 1.00 0.00 C ATOM 327 C VAL A 25 8.694 6.030 5.054 1.00 0.00 C ATOM 328 O VAL A 25 7.500 6.311 5.158 1.00 0.00 O ATOM 329 CB VAL A 25 9.555 3.965 6.166 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.403 4.014 7.160 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.030 2.534 5.962 1.00 0.00 C ATOM 0 H VAL A 25 11.083 4.120 4.197 1.00 0.00 H new ATOM 0 HA VAL A 25 8.310 4.015 4.408 1.00 0.00 H new ATOM 0 HB VAL A 25 10.382 4.545 6.575 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.717 3.567 8.103 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.112 5.051 7.329 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.554 3.459 6.761 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.320 2.107 6.922 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.224 1.941 5.530 1.00 0.00 H new ATOM 0 HG23 VAL A 25 10.887 2.528 5.288 1.00 0.00 H new ATOM 341 N GLY A 26 9.663 6.936 5.131 1.00 0.00 N ATOM 342 CA GLY A 26 9.352 8.337 5.339 1.00 0.00 C ATOM 343 C GLY A 26 8.548 8.917 4.194 1.00 0.00 C ATOM 344 O GLY A 26 7.544 9.598 4.410 1.00 0.00 O ATOM 0 H GLY A 26 10.658 6.725 5.053 1.00 0.00 H new ATOM 0 HA2 GLY A 26 8.793 8.450 6.268 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.278 8.901 5.454 1.00 0.00 H new ATOM 348 N TYR A 27 8.991 8.642 2.970 1.00 0.00 N ATOM 349 CA TYR A 27 8.304 9.135 1.783 1.00 0.00 C ATOM 350 C TYR A 27 6.894 8.561 1.705 1.00 0.00 C ATOM 351 O TYR A 27 5.993 9.178 1.138 1.00 0.00 O ATOM 352 CB TYR A 27 9.088 8.773 0.519 1.00 0.00 C ATOM 353 CG TYR A 27 10.524 9.252 0.530 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.837 10.574 0.827 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.567 8.382 0.238 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.149 11.012 0.835 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.880 8.813 0.245 1.00 0.00 C ATOM 358 CZ TYR A 27 13.166 10.128 0.544 1.00 0.00 C ATOM 359 OH TYR A 27 14.473 10.560 0.550 1.00 0.00 O ATOM 0 H TYR A 27 9.821 8.082 2.776 1.00 0.00 H new ATOM 0 HA TYR A 27 8.237 10.221 1.854 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.077 7.690 0.394 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.580 9.199 -0.346 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.043 11.270 1.055 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.348 7.351 0.001 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.376 12.042 1.068 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.679 8.123 0.017 1.00 0.00 H new ATOM 0 HH TYR A 27 15.066 9.813 0.325 1.00 0.00 H new ATOM 369 N LEU A 28 6.712 7.376 2.280 1.00 0.00 N ATOM 370 CA LEU A 28 5.409 6.720 2.283 1.00 0.00 C ATOM 371 C LEU A 28 4.437 7.459 3.193 1.00 0.00 C ATOM 372 O LEU A 28 3.301 7.736 2.808 1.00 0.00 O ATOM 373 CB LEU A 28 5.545 5.263 2.735 1.00 0.00 C ATOM 374 CG LEU A 28 6.136 4.310 1.694 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.351 2.932 2.298 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.231 4.219 0.474 1.00 0.00 C ATOM 0 H LEU A 28 7.450 6.851 2.749 1.00 0.00 H new ATOM 0 HA LEU A 28 5.017 6.739 1.266 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.170 5.233 3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.560 4.895 3.023 1.00 0.00 H new ATOM 0 HG LEU A 28 7.101 4.705 1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.772 2.266 1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.038 3.007 3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.397 2.533 2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.669 3.536 -0.254 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.251 3.848 0.775 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.123 5.207 0.026 1.00 0.00 H new ATOM 388 N GLU A 29 4.892 7.778 4.402 1.00 0.00 N ATOM 389 CA GLU A 29 4.064 8.489 5.368 1.00 0.00 C ATOM 390 C GLU A 29 3.549 9.796 4.776 1.00 0.00 C ATOM 391 O GLU A 29 2.392 10.168 4.978 1.00 0.00 O ATOM 392 CB GLU A 29 4.862 8.771 6.643 1.00 0.00 C ATOM 393 CG GLU A 29 5.353 7.515 7.344 1.00 0.00 C ATOM 394 CD GLU A 29 6.129 7.822 8.610 1.00 0.00 C ATOM 395 OE1 GLU A 29 7.346 8.083 8.513 1.00 0.00 O ATOM 396 OE2 GLU A 29 5.518 7.802 9.699 1.00 0.00 O ATOM 0 H GLU A 29 5.830 7.555 4.735 1.00 0.00 H new ATOM 0 HA GLU A 29 3.209 7.859 5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.719 9.397 6.394 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.240 9.342 7.332 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.500 6.883 7.589 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.986 6.946 6.663 1.00 0.00 H new ATOM 403 N ASP A 30 4.417 10.488 4.044 1.00 0.00 N ATOM 404 CA ASP A 30 4.052 11.751 3.414 1.00 0.00 C ATOM 405 C ASP A 30 2.887 11.556 2.448 1.00 0.00 C ATOM 406 O ASP A 30 2.057 12.449 2.271 1.00 0.00 O ATOM 407 CB ASP A 30 5.253 12.340 2.672 1.00 0.00 C ATOM 408 CG ASP A 30 4.926 13.662 2.005 1.00 0.00 C ATOM 409 OD1 ASP A 30 5.083 14.713 2.662 1.00 0.00 O ATOM 410 OD2 ASP A 30 4.515 13.647 0.826 1.00 0.00 O ATOM 0 H ASP A 30 5.379 10.194 3.873 1.00 0.00 H new ATOM 0 HA ASP A 30 3.742 12.445 4.195 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.076 12.483 3.373 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.595 11.630 1.919 1.00 0.00 H new ATOM 415 N ILE A 31 2.833 10.382 1.824 1.00 0.00 N ATOM 416 CA ILE A 31 1.769 10.065 0.878 1.00 0.00 C ATOM 417 C ILE A 31 0.495 9.651 1.606 1.00 0.00 C ATOM 418 O ILE A 31 -0.612 9.967 1.168 1.00 0.00 O ATOM 419 CB ILE A 31 2.192 8.938 -0.087 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.471 9.328 -0.832 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.072 8.632 -1.072 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.048 8.214 -1.682 1.00 0.00 C ATOM 0 H ILE A 31 3.514 9.635 1.957 1.00 0.00 H new ATOM 0 HA ILE A 31 1.575 10.969 0.301 1.00 0.00 H new ATOM 0 HB ILE A 31 2.392 8.039 0.496 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.261 10.187 -1.469 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.221 9.644 -0.107 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.387 7.835 -1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.183 8.315 -0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.842 9.526 -1.651 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.952 8.566 -2.178 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.291 7.361 -1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.317 7.912 -2.432 1.00 0.00 H new ATOM 434 N ILE A 32 0.656 8.944 2.720 1.00 0.00 N ATOM 435 CA ILE A 32 -0.482 8.488 3.509 1.00 0.00 C ATOM 436 C ILE A 32 -1.308 9.672 4.003 1.00 0.00 C ATOM 437 O ILE A 32 -2.530 9.579 4.131 1.00 0.00 O ATOM 438 CB ILE A 32 -0.025 7.642 4.715 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.752 6.413 4.234 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.221 7.222 5.561 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.376 5.607 5.353 1.00 0.00 C ATOM 0 H ILE A 32 1.565 8.674 3.097 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.098 7.866 2.859 1.00 0.00 H new ATOM 0 HB ILE A 32 0.633 8.250 5.336 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.080 5.769 3.667 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.537 6.736 3.550 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.877 6.626 6.407 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.737 8.109 5.928 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.906 6.630 4.954 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.909 4.754 4.933 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.074 6.234 5.907 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.595 5.252 6.025 1.00 0.00 H new ATOM 453 N MET A 33 -0.633 10.785 4.274 1.00 0.00 N ATOM 454 CA MET A 33 -1.302 11.989 4.753 1.00 0.00 C ATOM 455 C MET A 33 -1.366 13.052 3.659 1.00 0.00 C ATOM 456 O MET A 33 -1.655 14.218 3.929 1.00 0.00 O ATOM 457 CB MET A 33 -0.572 12.547 5.977 1.00 0.00 C ATOM 458 CG MET A 33 -0.448 11.550 7.117 1.00 0.00 C ATOM 459 SD MET A 33 0.518 12.191 8.500 1.00 0.00 S ATOM 460 CE MET A 33 2.133 12.353 7.742 1.00 0.00 C ATOM 0 H MET A 33 0.377 10.878 4.170 1.00 0.00 H new ATOM 0 HA MET A 33 -2.321 11.721 5.033 1.00 0.00 H new ATOM 0 HB2 MET A 33 0.425 12.871 5.679 1.00 0.00 H new ATOM 0 HB3 MET A 33 -1.101 13.431 6.334 1.00 0.00 H new ATOM 0 HG2 MET A 33 -1.444 11.281 7.469 1.00 0.00 H new ATOM 0 HG3 MET A 33 0.017 10.637 6.747 1.00 0.00 H new ATOM 0 HE1 MET A 33 2.896 12.408 8.519 1.00 0.00 H new ATOM 0 HE2 MET A 33 2.325 11.489 7.106 1.00 0.00 H new ATOM 0 HE3 MET A 33 2.163 13.261 7.140 1.00 0.00 H new ATOM 470 N ASP A 34 -1.100 12.640 2.421 1.00 0.00 N ATOM 471 CA ASP A 34 -1.126 13.558 1.287 1.00 0.00 C ATOM 472 C ASP A 34 -2.560 13.945 0.934 1.00 0.00 C ATOM 473 O ASP A 34 -3.439 13.089 0.853 1.00 0.00 O ATOM 474 CB ASP A 34 -0.442 12.924 0.075 1.00 0.00 C ATOM 475 CG ASP A 34 -0.401 13.857 -1.119 1.00 0.00 C ATOM 476 OD1 ASP A 34 0.534 14.681 -1.199 1.00 0.00 O ATOM 477 OD2 ASP A 34 -1.305 13.762 -1.975 1.00 0.00 O ATOM 0 H ASP A 34 -0.864 11.678 2.179 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.584 14.461 1.569 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.575 12.637 0.344 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.969 12.010 -0.199 1.00 0.00 H new ATOM 482 N ASP A 35 -2.782 15.239 0.717 1.00 0.00 N ATOM 483 CA ASP A 35 -4.109 15.746 0.379 1.00 0.00 C ATOM 484 C ASP A 35 -4.684 15.034 -0.843 1.00 0.00 C ATOM 485 O ASP A 35 -5.799 14.514 -0.799 1.00 0.00 O ATOM 486 CB ASP A 35 -4.047 17.253 0.123 1.00 0.00 C ATOM 487 CG ASP A 35 -5.420 17.861 -0.091 1.00 0.00 C ATOM 488 OD1 ASP A 35 -5.911 17.830 -1.239 1.00 0.00 O ATOM 489 OD2 ASP A 35 -6.004 18.370 0.889 1.00 0.00 O ATOM 0 H ASP A 35 -2.059 15.956 0.769 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.767 15.549 1.225 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.564 17.743 0.968 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -3.427 17.445 -0.753 1.00 0.00 H new ATOM 494 N GLU A 36 -3.918 15.016 -1.930 1.00 0.00 N ATOM 495 CA GLU A 36 -4.355 14.371 -3.164 1.00 0.00 C ATOM 496 C GLU A 36 -4.658 12.892 -2.933 1.00 0.00 C ATOM 497 O GLU A 36 -5.475 12.300 -3.638 1.00 0.00 O ATOM 498 CB GLU A 36 -3.286 14.523 -4.250 1.00 0.00 C ATOM 499 CG GLU A 36 -3.700 13.962 -5.601 1.00 0.00 C ATOM 500 CD GLU A 36 -4.907 14.670 -6.184 1.00 0.00 C ATOM 501 OE1 GLU A 36 -4.725 15.730 -6.818 1.00 0.00 O ATOM 502 OE2 GLU A 36 -6.036 14.162 -6.008 1.00 0.00 O ATOM 0 H GLU A 36 -2.992 15.441 -1.981 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.271 14.861 -3.494 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.045 15.580 -4.364 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.375 14.022 -3.923 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.864 14.045 -6.296 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.922 12.900 -5.496 1.00 0.00 H new ATOM 509 N PHE A 37 -3.997 12.302 -1.941 1.00 0.00 N ATOM 510 CA PHE A 37 -4.198 10.892 -1.619 1.00 0.00 C ATOM 511 C PHE A 37 -5.491 10.687 -0.837 1.00 0.00 C ATOM 512 O PHE A 37 -6.186 9.688 -1.022 1.00 0.00 O ATOM 513 CB PHE A 37 -3.010 10.357 -0.816 1.00 0.00 C ATOM 514 CG PHE A 37 -3.124 8.899 -0.473 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.968 7.930 -1.451 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.383 8.497 0.828 1.00 0.00 C ATOM 517 CE1 PHE A 37 -3.069 6.588 -1.139 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.485 7.156 1.146 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.328 6.200 0.161 1.00 0.00 C ATOM 0 H PHE A 37 -3.318 12.778 -1.347 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.274 10.340 -2.556 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.095 10.517 -1.386 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.916 10.932 0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.765 8.227 -2.469 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.506 9.240 1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.946 5.843 -1.911 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.687 6.856 2.163 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.408 5.151 0.407 1.00 0.00 H new ATOM 529 N GLN A 38 -5.808 11.635 0.041 1.00 0.00 N ATOM 530 CA GLN A 38 -7.021 11.555 0.848 1.00 0.00 C ATOM 531 C GLN A 38 -8.266 11.649 -0.028 1.00 0.00 C ATOM 532 O GLN A 38 -9.213 10.880 0.137 1.00 0.00 O ATOM 533 CB GLN A 38 -7.040 12.674 1.890 1.00 0.00 C ATOM 534 CG GLN A 38 -5.845 12.659 2.827 1.00 0.00 C ATOM 535 CD GLN A 38 -5.851 11.469 3.765 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.398 11.536 4.866 1.00 0.00 O ATOM 537 NE2 GLN A 38 -5.241 10.372 3.334 1.00 0.00 N ATOM 0 H GLN A 38 -5.242 12.466 0.211 1.00 0.00 H new ATOM 0 HA GLN A 38 -7.024 10.590 1.355 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.076 13.635 1.377 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.953 12.593 2.480 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.928 12.648 2.239 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -5.837 13.578 3.413 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.801 10.361 2.414 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -5.213 9.540 3.923 1.00 0.00 H new ATOM 546 N LEU A 39 -8.256 12.599 -0.959 1.00 0.00 N ATOM 547 CA LEU A 39 -9.383 12.807 -1.862 1.00 0.00 C ATOM 548 C LEU A 39 -9.517 11.649 -2.849 1.00 0.00 C ATOM 549 O LEU A 39 -10.623 11.180 -3.122 1.00 0.00 O ATOM 550 CB LEU A 39 -9.210 14.136 -2.614 1.00 0.00 C ATOM 551 CG LEU A 39 -10.463 14.698 -3.304 1.00 0.00 C ATOM 552 CD1 LEU A 39 -10.754 13.952 -4.598 1.00 0.00 C ATOM 553 CD2 LEU A 39 -11.669 14.647 -2.374 1.00 0.00 C ATOM 0 H LEU A 39 -7.476 13.239 -1.108 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.297 12.848 -1.270 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.844 14.883 -1.909 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.435 14.003 -3.369 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.267 15.742 -3.549 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.645 14.369 -5.066 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.906 14.055 -5.276 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.919 12.897 -4.380 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.542 15.051 -2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -11.863 13.614 -2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.466 15.240 -1.482 1.00 0.00 H new ATOM 565 N LEU A 40 -8.386 11.189 -3.375 1.00 0.00 N ATOM 566 CA LEU A 40 -8.379 10.090 -4.338 1.00 0.00 C ATOM 567 C LEU A 40 -8.883 8.794 -3.709 1.00 0.00 C ATOM 568 O LEU A 40 -9.731 8.106 -4.278 1.00 0.00 O ATOM 569 CB LEU A 40 -6.968 9.889 -4.899 1.00 0.00 C ATOM 570 CG LEU A 40 -6.833 8.786 -5.953 1.00 0.00 C ATOM 571 CD1 LEU A 40 -5.788 9.165 -6.991 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.467 7.461 -5.297 1.00 0.00 C ATOM 0 H LEU A 40 -7.462 11.559 -3.152 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.055 10.353 -5.151 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.631 10.829 -5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.295 9.663 -4.072 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.795 8.672 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.706 8.370 -7.732 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.084 10.091 -7.484 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.824 9.307 -6.502 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.375 6.690 -6.062 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.518 7.565 -4.771 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.245 7.179 -4.588 1.00 0.00 H new ATOM 584 N GLN A 41 -8.357 8.466 -2.534 1.00 0.00 N ATOM 585 CA GLN A 41 -8.745 7.244 -1.838 1.00 0.00 C ATOM 586 C GLN A 41 -10.204 7.296 -1.389 1.00 0.00 C ATOM 587 O GLN A 41 -10.943 6.328 -1.548 1.00 0.00 O ATOM 588 CB GLN A 41 -7.834 7.008 -0.631 1.00 0.00 C ATOM 589 CG GLN A 41 -8.139 5.720 0.116 1.00 0.00 C ATOM 590 CD GLN A 41 -7.185 5.473 1.268 1.00 0.00 C ATOM 591 OE1 GLN A 41 -7.433 5.896 2.397 1.00 0.00 O ATOM 592 NE2 GLN A 41 -6.085 4.783 0.988 1.00 0.00 N ATOM 0 H GLN A 41 -7.662 9.028 -2.044 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.636 6.415 -2.537 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.797 6.987 -0.967 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.930 7.849 0.056 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.160 5.758 0.496 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.089 4.881 -0.578 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.919 4.451 0.038 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.406 4.585 1.723 1.00 0.00 H new ATOM 601 N ARG A 42 -10.612 8.432 -0.832 1.00 0.00 N ATOM 602 CA ARG A 42 -11.981 8.601 -0.353 1.00 0.00 C ATOM 603 C ARG A 42 -12.980 8.582 -1.507 1.00 0.00 C ATOM 604 O ARG A 42 -14.092 8.070 -1.369 1.00 0.00 O ATOM 605 CB ARG A 42 -12.111 9.916 0.418 1.00 0.00 C ATOM 606 CG ARG A 42 -13.489 10.135 1.024 1.00 0.00 C ATOM 607 CD ARG A 42 -13.581 11.476 1.732 1.00 0.00 C ATOM 608 NE ARG A 42 -12.648 11.570 2.851 1.00 0.00 N ATOM 609 CZ ARG A 42 -12.446 12.679 3.554 1.00 0.00 C ATOM 610 NH1 ARG A 42 -13.105 13.791 3.252 1.00 0.00 N ATOM 611 NH2 ARG A 42 -11.583 12.680 4.563 1.00 0.00 N ATOM 0 H ARG A 42 -10.015 9.249 -0.701 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.207 7.766 0.310 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.366 9.936 1.214 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.883 10.744 -0.253 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.244 10.084 0.240 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.708 9.334 1.730 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.376 12.276 1.021 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.598 11.625 2.095 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.121 10.736 3.108 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.769 13.796 2.478 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.947 14.641 3.794 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.074 11.828 4.799 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.429 13.532 5.102 1.00 0.00 H new ATOM 625 N ASN A 43 -12.578 9.141 -2.642 1.00 0.00 N ATOM 626 CA ASN A 43 -13.440 9.202 -3.819 1.00 0.00 C ATOM 627 C ASN A 43 -13.789 7.806 -4.333 1.00 0.00 C ATOM 628 O ASN A 43 -14.956 7.503 -4.583 1.00 0.00 O ATOM 629 CB ASN A 43 -12.766 10.009 -4.930 1.00 0.00 C ATOM 630 CG ASN A 43 -13.642 10.150 -6.159 1.00 0.00 C ATOM 631 OD1 ASN A 43 -14.870 10.179 -6.061 1.00 0.00 O ATOM 632 ND2 ASN A 43 -13.015 10.234 -7.326 1.00 0.00 N ATOM 0 H ASN A 43 -11.658 9.560 -2.774 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.366 9.695 -3.523 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.513 11.000 -4.553 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.830 9.526 -5.209 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.552 10.327 -8.188 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.996 10.206 -7.361 1.00 0.00 H new ATOM 639 N PHE A 44 -12.776 6.959 -4.486 1.00 0.00 N ATOM 640 CA PHE A 44 -12.987 5.600 -4.977 1.00 0.00 C ATOM 641 C PHE A 44 -13.646 4.722 -3.916 1.00 0.00 C ATOM 642 O PHE A 44 -14.589 3.989 -4.211 1.00 0.00 O ATOM 643 CB PHE A 44 -11.663 4.983 -5.432 1.00 0.00 C ATOM 644 CG PHE A 44 -11.259 5.401 -6.818 1.00 0.00 C ATOM 645 CD1 PHE A 44 -10.689 6.644 -7.044 1.00 0.00 C ATOM 646 CD2 PHE A 44 -11.453 4.551 -7.895 1.00 0.00 C ATOM 647 CE1 PHE A 44 -10.321 7.032 -8.319 1.00 0.00 C ATOM 648 CE2 PHE A 44 -11.087 4.933 -9.172 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.521 6.176 -9.385 1.00 0.00 C ATOM 0 H PHE A 44 -11.804 7.188 -4.278 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.661 5.656 -5.832 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.878 5.266 -4.731 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.745 3.897 -5.397 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -10.530 7.317 -6.215 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.895 3.579 -7.735 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.878 8.003 -8.482 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.243 4.261 -10.003 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.236 6.477 -10.382 1.00 0.00 H new ATOM 659 N MET A 45 -13.150 4.800 -2.685 1.00 0.00 N ATOM 660 CA MET A 45 -13.706 4.012 -1.589 1.00 0.00 C ATOM 661 C MET A 45 -15.180 4.338 -1.382 1.00 0.00 C ATOM 662 O MET A 45 -15.936 3.525 -0.850 1.00 0.00 O ATOM 663 CB MET A 45 -12.931 4.266 -0.295 1.00 0.00 C ATOM 664 CG MET A 45 -11.555 3.619 -0.270 1.00 0.00 C ATOM 665 SD MET A 45 -10.729 3.799 1.323 1.00 0.00 S ATOM 666 CE MET A 45 -11.850 2.902 2.395 1.00 0.00 C ATOM 0 H MET A 45 -12.367 5.398 -2.421 1.00 0.00 H new ATOM 0 HA MET A 45 -13.615 2.959 -1.854 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.820 5.341 -0.153 1.00 0.00 H new ATOM 0 HB3 MET A 45 -13.514 3.892 0.547 1.00 0.00 H new ATOM 0 HG2 MET A 45 -11.652 2.559 -0.506 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.935 4.064 -1.048 1.00 0.00 H new ATOM 0 HE1 MET A 45 -11.311 2.555 3.277 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.664 3.559 2.702 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.258 2.045 1.859 1.00 0.00 H new ATOM 676 N ASP A 46 -15.579 5.535 -1.799 1.00 0.00 N ATOM 677 CA ASP A 46 -16.963 5.973 -1.667 1.00 0.00 C ATOM 678 C ASP A 46 -17.897 5.061 -2.457 1.00 0.00 C ATOM 679 O ASP A 46 -19.054 4.869 -2.084 1.00 0.00 O ATOM 680 CB ASP A 46 -17.112 7.418 -2.147 1.00 0.00 C ATOM 681 CG ASP A 46 -18.511 7.960 -1.926 1.00 0.00 C ATOM 682 OD1 ASP A 46 -19.370 7.768 -2.812 1.00 0.00 O ATOM 683 OD2 ASP A 46 -18.746 8.579 -0.866 1.00 0.00 O ATOM 0 H ASP A 46 -14.961 6.221 -2.233 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.237 5.920 -0.613 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.394 8.048 -1.622 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.868 7.472 -3.208 1.00 0.00 H new ATOM 688 N LYS A 47 -17.388 4.511 -3.555 1.00 0.00 N ATOM 689 CA LYS A 47 -18.175 3.619 -4.401 1.00 0.00 C ATOM 690 C LYS A 47 -17.882 2.155 -4.079 1.00 0.00 C ATOM 691 O LYS A 47 -18.781 1.315 -4.091 1.00 0.00 O ATOM 692 CB LYS A 47 -17.881 3.893 -5.877 1.00 0.00 C ATOM 693 CG LYS A 47 -18.397 5.237 -6.365 1.00 0.00 C ATOM 694 CD LYS A 47 -19.917 5.279 -6.386 1.00 0.00 C ATOM 695 CE LYS A 47 -20.430 6.615 -6.899 1.00 0.00 C ATOM 696 NZ LYS A 47 -21.917 6.657 -6.951 1.00 0.00 N ATOM 0 H LYS A 47 -16.434 4.667 -3.880 1.00 0.00 H new ATOM 0 HA LYS A 47 -19.229 3.811 -4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.804 3.847 -6.038 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -18.327 3.102 -6.480 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -18.019 6.029 -5.718 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -18.013 5.433 -7.366 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -20.296 4.476 -7.018 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -20.301 5.102 -5.381 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -20.067 7.415 -6.254 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -20.027 6.800 -7.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -22.226 7.584 -7.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -22.263 5.910 -7.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -22.302 6.506 -5.997 1.00 0.00 H new ATOM 710 N TYR A 48 -16.619 1.861 -3.793 1.00 0.00 N ATOM 711 CA TYR A 48 -16.201 0.500 -3.471 1.00 0.00 C ATOM 712 C TYR A 48 -16.950 -0.041 -2.255 1.00 0.00 C ATOM 713 O TYR A 48 -17.485 -1.149 -2.290 1.00 0.00 O ATOM 714 CB TYR A 48 -14.693 0.452 -3.211 1.00 0.00 C ATOM 715 CG TYR A 48 -13.843 0.416 -4.466 1.00 0.00 C ATOM 716 CD1 TYR A 48 -14.093 1.276 -5.528 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.784 -0.477 -4.581 1.00 0.00 C ATOM 718 CE1 TYR A 48 -13.314 1.246 -6.670 1.00 0.00 C ATOM 719 CE2 TYR A 48 -12.000 -0.512 -5.720 1.00 0.00 C ATOM 720 CZ TYR A 48 -12.270 0.351 -6.760 1.00 0.00 C ATOM 721 OH TYR A 48 -11.491 0.321 -7.895 1.00 0.00 O ATOM 0 H TYR A 48 -15.865 2.548 -3.777 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.440 -0.129 -4.328 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.410 1.323 -2.620 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.468 -0.428 -2.609 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.909 1.980 -5.461 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.570 -1.155 -3.768 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -13.523 1.921 -7.487 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -11.181 -1.212 -5.794 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.798 -0.365 -7.798 1.00 0.00 H new ATOM 731 N TYR A 49 -16.990 0.744 -1.181 1.00 0.00 N ATOM 732 CA TYR A 49 -17.663 0.325 0.046 1.00 0.00 C ATOM 733 C TYR A 49 -19.162 0.132 -0.176 1.00 0.00 C ATOM 734 O TYR A 49 -19.832 -0.531 0.615 1.00 0.00 O ATOM 735 CB TYR A 49 -17.407 1.339 1.171 1.00 0.00 C ATOM 736 CG TYR A 49 -18.545 2.309 1.419 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.723 3.425 0.612 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.434 2.111 2.468 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.756 4.314 0.841 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.471 2.994 2.703 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.626 4.095 1.886 1.00 0.00 C ATOM 742 OH TYR A 49 -21.657 4.978 2.115 1.00 0.00 O ATOM 0 H TYR A 49 -16.566 1.671 -1.135 1.00 0.00 H new ATOM 0 HA TYR A 49 -17.248 -0.638 0.343 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.204 0.795 2.093 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.508 1.908 0.932 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -18.043 3.601 -0.208 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.313 1.252 3.111 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.881 5.177 0.203 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.155 2.823 3.521 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.179 4.678 2.889 1.00 0.00 H new ATOM 752 N LEU A 50 -19.685 0.711 -1.254 1.00 0.00 N ATOM 753 CA LEU A 50 -21.106 0.594 -1.568 1.00 0.00 C ATOM 754 C LEU A 50 -21.420 -0.774 -2.162 1.00 0.00 C ATOM 755 O LEU A 50 -22.364 -1.444 -1.742 1.00 0.00 O ATOM 756 CB LEU A 50 -21.536 1.696 -2.540 1.00 0.00 C ATOM 757 CG LEU A 50 -21.595 3.104 -1.943 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.900 4.127 -3.026 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.639 3.171 -0.838 1.00 0.00 C ATOM 0 H LEU A 50 -19.148 1.264 -1.922 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.664 0.706 -0.639 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.845 1.705 -3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.520 1.445 -2.937 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.622 3.337 -1.511 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.939 5.123 -2.585 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -21.119 4.096 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.861 3.896 -3.485 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.667 4.179 -0.425 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.618 2.918 -1.246 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.381 2.463 -0.050 1.00 0.00 H new ATOM 771 N GLU A 51 -20.622 -1.184 -3.142 1.00 0.00 N ATOM 772 CA GLU A 51 -20.815 -2.473 -3.794 1.00 0.00 C ATOM 773 C GLU A 51 -20.466 -3.619 -2.849 1.00 0.00 C ATOM 774 O GLU A 51 -21.057 -4.697 -2.919 1.00 0.00 O ATOM 775 CB GLU A 51 -19.965 -2.556 -5.062 1.00 0.00 C ATOM 776 CG GLU A 51 -20.331 -1.510 -6.104 1.00 0.00 C ATOM 777 CD GLU A 51 -19.452 -1.578 -7.338 1.00 0.00 C ATOM 778 OE1 GLU A 51 -18.383 -0.932 -7.342 1.00 0.00 O ATOM 779 OE2 GLU A 51 -19.834 -2.275 -8.301 1.00 0.00 O ATOM 0 H GLU A 51 -19.836 -0.642 -3.502 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.867 -2.564 -4.066 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.915 -2.440 -4.795 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -20.075 -3.548 -5.500 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -21.372 -1.644 -6.397 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.250 -0.518 -5.660 1.00 0.00 H new ATOM 786 N PHE A 52 -19.504 -3.379 -1.964 1.00 0.00 N ATOM 787 CA PHE A 52 -19.082 -4.391 -1.003 1.00 0.00 C ATOM 788 C PHE A 52 -20.069 -4.491 0.156 1.00 0.00 C ATOM 789 O PHE A 52 -19.902 -3.840 1.187 1.00 0.00 O ATOM 790 CB PHE A 52 -17.681 -4.074 -0.474 1.00 0.00 C ATOM 791 CG PHE A 52 -16.576 -4.544 -1.378 1.00 0.00 C ATOM 792 CD1 PHE A 52 -16.414 -4.001 -2.643 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.700 -5.532 -0.960 1.00 0.00 C ATOM 794 CE1 PHE A 52 -15.399 -4.435 -3.473 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.683 -5.971 -1.786 1.00 0.00 C ATOM 796 CZ PHE A 52 -14.532 -5.421 -3.044 1.00 0.00 C ATOM 0 H PHE A 52 -19.003 -2.494 -1.893 1.00 0.00 H new ATOM 0 HA PHE A 52 -19.058 -5.352 -1.516 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.590 -2.997 -0.333 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.559 -4.536 0.506 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -17.089 -3.230 -2.983 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.813 -5.964 0.023 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -15.283 -4.004 -4.456 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.007 -6.743 -1.449 1.00 0.00 H new ATOM 0 HZ PHE A 52 -13.737 -5.761 -3.691 1.00 0.00 H new ATOM 806 N GLU A 53 -21.102 -5.308 -0.028 1.00 0.00 N ATOM 807 CA GLU A 53 -22.119 -5.501 0.999 1.00 0.00 C ATOM 808 C GLU A 53 -21.978 -6.872 1.651 1.00 0.00 C ATOM 809 O GLU A 53 -21.620 -7.849 0.993 1.00 0.00 O ATOM 810 CB GLU A 53 -23.517 -5.359 0.397 1.00 0.00 C ATOM 811 CG GLU A 53 -23.767 -4.007 -0.249 1.00 0.00 C ATOM 812 CD GLU A 53 -25.163 -3.888 -0.828 1.00 0.00 C ATOM 813 OE1 GLU A 53 -25.365 -4.315 -1.985 1.00 0.00 O ATOM 814 OE2 GLU A 53 -26.056 -3.370 -0.124 1.00 0.00 O ATOM 0 H GLU A 53 -21.256 -5.847 -0.880 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.977 -4.735 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.664 -6.141 -0.348 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -24.258 -5.521 1.179 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.616 -3.221 0.491 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.034 -3.845 -1.040 1.00 0.00 H new ATOM 821 N ASP A 54 -22.261 -6.938 2.948 1.00 0.00 N ATOM 822 CA ASP A 54 -22.166 -8.191 3.686 1.00 0.00 C ATOM 823 C ASP A 54 -23.245 -9.171 3.236 1.00 0.00 C ATOM 824 O ASP A 54 -24.380 -9.122 3.713 1.00 0.00 O ATOM 825 CB ASP A 54 -22.287 -7.933 5.188 1.00 0.00 C ATOM 826 CG ASP A 54 -22.131 -9.199 6.009 1.00 0.00 C ATOM 827 OD1 ASP A 54 -20.983 -9.534 6.371 1.00 0.00 O ATOM 828 OD2 ASP A 54 -23.155 -9.855 6.289 1.00 0.00 O ATOM 0 H ASP A 54 -22.558 -6.139 3.509 1.00 0.00 H new ATOM 0 HA ASP A 54 -21.191 -8.633 3.479 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.529 -7.211 5.492 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.257 -7.484 5.399 1.00 0.00 H new ATOM 833 N THR A 55 -22.886 -10.055 2.309 1.00 0.00 N ATOM 834 CA THR A 55 -23.821 -11.048 1.794 1.00 0.00 C ATOM 835 C THR A 55 -23.181 -12.430 1.753 1.00 0.00 C ATOM 836 O THR A 55 -22.046 -12.610 2.193 1.00 0.00 O ATOM 837 CB THR A 55 -24.317 -10.679 0.383 1.00 0.00 C ATOM 838 OG1 THR A 55 -23.206 -10.567 -0.516 1.00 0.00 O ATOM 839 CG2 THR A 55 -25.089 -9.367 0.407 1.00 0.00 C ATOM 0 H THR A 55 -21.953 -10.103 1.899 1.00 0.00 H new ATOM 0 HA THR A 55 -24.673 -11.064 2.473 1.00 0.00 H new ATOM 0 HB THR A 55 -24.983 -11.470 0.039 1.00 0.00 H new ATOM 0 HG1 THR A 55 -23.531 -10.334 -1.411 1.00 0.00 H new ATOM 0 HG21 THR A 55 -25.429 -9.127 -0.600 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.950 -9.464 1.068 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.441 -8.570 0.771 1.00 0.00 H new ATOM 847 N GLU A 56 -23.914 -13.405 1.223 1.00 0.00 N ATOM 848 CA GLU A 56 -23.413 -14.771 1.133 1.00 0.00 C ATOM 849 C GLU A 56 -23.038 -15.127 -0.303 1.00 0.00 C ATOM 850 O GLU A 56 -22.122 -15.917 -0.536 1.00 0.00 O ATOM 851 CB GLU A 56 -24.461 -15.753 1.658 1.00 0.00 C ATOM 852 CG GLU A 56 -24.829 -15.524 3.115 1.00 0.00 C ATOM 853 CD GLU A 56 -25.790 -16.571 3.644 1.00 0.00 C ATOM 854 OE1 GLU A 56 -27.007 -16.442 3.394 1.00 0.00 O ATOM 855 OE2 GLU A 56 -25.324 -17.520 4.310 1.00 0.00 O ATOM 0 H GLU A 56 -24.854 -13.274 0.850 1.00 0.00 H new ATOM 0 HA GLU A 56 -22.515 -14.842 1.747 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -25.360 -15.673 1.047 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -24.086 -16.770 1.542 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -23.922 -15.529 3.720 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -25.278 -14.537 3.222 1.00 0.00 H new ATOM 862 N GLU A 57 -23.752 -14.544 -1.260 1.00 0.00 N ATOM 863 CA GLU A 57 -23.490 -14.802 -2.672 1.00 0.00 C ATOM 864 C GLU A 57 -22.372 -13.903 -3.191 1.00 0.00 C ATOM 865 O GLU A 57 -22.359 -12.700 -2.930 1.00 0.00 O ATOM 866 CB GLU A 57 -24.760 -14.586 -3.498 1.00 0.00 C ATOM 867 CG GLU A 57 -24.571 -14.841 -4.985 1.00 0.00 C ATOM 868 CD GLU A 57 -24.171 -16.272 -5.285 1.00 0.00 C ATOM 869 OE1 GLU A 57 -22.955 -16.559 -5.297 1.00 0.00 O ATOM 870 OE2 GLU A 57 -25.073 -17.107 -5.507 1.00 0.00 O ATOM 0 H GLU A 57 -24.515 -13.891 -1.085 1.00 0.00 H new ATOM 0 HA GLU A 57 -23.173 -15.840 -2.772 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -25.544 -15.244 -3.122 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -25.107 -13.563 -3.355 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -25.497 -14.609 -5.510 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -23.808 -14.166 -5.372 1.00 0.00 H new ATOM 877 N ASN A 58 -21.438 -14.496 -3.927 1.00 0.00 N ATOM 878 CA ASN A 58 -20.316 -13.749 -4.483 1.00 0.00 C ATOM 879 C ASN A 58 -20.607 -13.321 -5.919 1.00 0.00 C ATOM 880 O ASN A 58 -21.167 -14.087 -6.704 1.00 0.00 O ATOM 881 CB ASN A 58 -19.041 -14.593 -4.437 1.00 0.00 C ATOM 882 CG ASN A 58 -17.823 -13.828 -4.915 1.00 0.00 C ATOM 883 OD1 ASN A 58 -17.125 -13.193 -4.126 1.00 0.00 O ATOM 884 ND2 ASN A 58 -17.563 -13.885 -6.217 1.00 0.00 N ATOM 0 H ASN A 58 -21.436 -15.491 -4.152 1.00 0.00 H new ATOM 0 HA ASN A 58 -20.171 -12.854 -3.878 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -18.873 -14.937 -3.416 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -19.174 -15.481 -5.055 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.757 -13.390 -6.598 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -18.169 -14.424 -6.835 1.00 0.00 H new ATOM 891 N LYS A 59 -20.224 -12.091 -6.255 1.00 0.00 N ATOM 892 CA LYS A 59 -20.445 -11.559 -7.596 1.00 0.00 C ATOM 893 C LYS A 59 -19.142 -11.502 -8.386 1.00 0.00 C ATOM 894 O LYS A 59 -18.057 -11.412 -7.811 1.00 0.00 O ATOM 895 CB LYS A 59 -21.063 -10.163 -7.518 1.00 0.00 C ATOM 896 CG LYS A 59 -22.399 -10.124 -6.796 1.00 0.00 C ATOM 897 CD LYS A 59 -22.954 -8.710 -6.730 1.00 0.00 C ATOM 898 CE LYS A 59 -24.314 -8.679 -6.052 1.00 0.00 C ATOM 899 NZ LYS A 59 -24.881 -7.303 -6.001 1.00 0.00 N ATOM 0 H LYS A 59 -19.759 -11.445 -5.617 1.00 0.00 H new ATOM 0 HA LYS A 59 -21.133 -12.229 -8.112 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -20.367 -9.495 -7.011 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -21.195 -9.777 -8.529 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -23.110 -10.772 -7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -22.280 -10.517 -5.786 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -22.260 -8.070 -6.185 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -23.039 -8.303 -7.738 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -25.001 -9.334 -6.587 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -24.223 -9.071 -5.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -25.808 -7.327 -5.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -24.239 -6.682 -5.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -24.992 -6.937 -6.968 1.00 0.00 H new ATOM 913 N LEU A 60 -19.259 -11.557 -9.709 1.00 0.00 N ATOM 914 CA LEU A 60 -18.093 -11.505 -10.582 1.00 0.00 C ATOM 915 C LEU A 60 -17.612 -10.069 -10.758 1.00 0.00 C ATOM 916 O LEU A 60 -16.528 -9.829 -11.289 1.00 0.00 O ATOM 917 CB LEU A 60 -18.422 -12.121 -11.944 1.00 0.00 C ATOM 918 CG LEU A 60 -18.830 -13.596 -11.909 1.00 0.00 C ATOM 919 CD1 LEU A 60 -19.202 -14.079 -13.303 1.00 0.00 C ATOM 920 CD2 LEU A 60 -17.707 -14.447 -11.331 1.00 0.00 C ATOM 0 H LEU A 60 -20.150 -11.638 -10.199 1.00 0.00 H new ATOM 0 HA LEU A 60 -17.293 -12.081 -10.117 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -19.230 -11.548 -12.399 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.552 -12.016 -12.592 1.00 0.00 H new ATOM 0 HG LEU A 60 -19.704 -13.696 -11.265 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -19.489 -15.130 -13.259 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.037 -13.490 -13.681 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -18.346 -13.964 -13.968 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.015 -15.493 -11.314 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -16.815 -14.341 -11.949 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.486 -14.117 -10.316 1.00 0.00 H new ATOM 932 N ILE A 61 -18.427 -9.118 -10.310 1.00 0.00 N ATOM 933 CA ILE A 61 -18.089 -7.704 -10.415 1.00 0.00 C ATOM 934 C ILE A 61 -16.908 -7.361 -9.508 1.00 0.00 C ATOM 935 O ILE A 61 -16.305 -6.292 -9.626 1.00 0.00 O ATOM 936 CB ILE A 61 -19.298 -6.812 -10.051 1.00 0.00 C ATOM 937 CG1 ILE A 61 -19.000 -5.341 -10.359 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.670 -6.987 -8.585 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.803 -5.057 -11.833 1.00 0.00 C ATOM 0 H ILE A 61 -19.328 -9.303 -9.870 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.812 -7.510 -11.451 1.00 0.00 H new ATOM 0 HB ILE A 61 -20.146 -7.123 -10.661 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.820 -4.727 -9.986 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -18.104 -5.039 -9.817 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.523 -6.351 -8.348 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.931 -8.029 -8.398 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.823 -6.707 -7.959 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.596 -3.996 -11.975 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.964 -5.644 -12.208 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.707 -5.326 -12.379 1.00 0.00 H new ATOM 951 N TYR A 62 -16.573 -8.283 -8.611 1.00 0.00 N ATOM 952 CA TYR A 62 -15.465 -8.081 -7.686 1.00 0.00 C ATOM 953 C TYR A 62 -14.121 -8.191 -8.401 1.00 0.00 C ATOM 954 O TYR A 62 -13.104 -7.708 -7.902 1.00 0.00 O ATOM 955 CB TYR A 62 -15.538 -9.092 -6.541 1.00 0.00 C ATOM 956 CG TYR A 62 -16.611 -8.779 -5.521 1.00 0.00 C ATOM 957 CD1 TYR A 62 -17.955 -8.989 -5.809 1.00 0.00 C ATOM 958 CD2 TYR A 62 -16.281 -8.272 -4.271 1.00 0.00 C ATOM 959 CE1 TYR A 62 -18.937 -8.703 -4.879 1.00 0.00 C ATOM 960 CE2 TYR A 62 -17.258 -7.983 -3.335 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.584 -8.200 -3.645 1.00 0.00 C ATOM 962 OH TYR A 62 -19.559 -7.916 -2.717 1.00 0.00 O ATOM 0 H TYR A 62 -17.053 -9.177 -8.506 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.549 -7.074 -7.277 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.721 -10.084 -6.955 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.571 -9.129 -6.039 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -18.236 -9.382 -6.775 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -15.243 -8.100 -4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -19.976 -8.873 -5.118 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.984 -7.590 -2.367 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.142 -7.570 -1.900 1.00 0.00 H new ATOM 972 N THR A 63 -14.117 -8.823 -9.575 1.00 0.00 N ATOM 973 CA THR A 63 -12.886 -8.983 -10.341 1.00 0.00 C ATOM 974 C THR A 63 -12.491 -7.676 -11.036 1.00 0.00 C ATOM 975 O THR A 63 -11.360 -7.216 -10.882 1.00 0.00 O ATOM 976 CB THR A 63 -12.995 -10.117 -11.384 1.00 0.00 C ATOM 977 OG1 THR A 63 -13.429 -11.326 -10.750 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.655 -10.353 -12.065 1.00 0.00 C ATOM 0 H THR A 63 -14.945 -9.228 -10.011 1.00 0.00 H new ATOM 0 HA THR A 63 -12.109 -9.254 -9.626 1.00 0.00 H new ATOM 0 HB THR A 63 -13.724 -9.819 -12.138 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.497 -12.040 -11.418 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.755 -11.156 -12.796 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.338 -9.440 -12.569 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.912 -10.632 -11.318 1.00 0.00 H new ATOM 986 N PRO A 64 -13.406 -7.046 -11.811 1.00 0.00 N ATOM 987 CA PRO A 64 -13.108 -5.781 -12.490 1.00 0.00 C ATOM 988 C PRO A 64 -12.788 -4.675 -11.492 1.00 0.00 C ATOM 989 O PRO A 64 -11.860 -3.892 -11.694 1.00 0.00 O ATOM 990 CB PRO A 64 -14.397 -5.454 -13.254 1.00 0.00 C ATOM 991 CG PRO A 64 -15.133 -6.746 -13.344 1.00 0.00 C ATOM 992 CD PRO A 64 -14.776 -7.506 -12.100 1.00 0.00 C ATOM 0 HA PRO A 64 -12.236 -5.861 -13.139 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.985 -4.701 -12.730 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -14.178 -5.055 -14.244 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -16.209 -6.580 -13.406 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -14.844 -7.300 -14.237 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -15.458 -7.281 -11.280 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.814 -8.583 -12.260 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.567 -4.616 -10.411 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.355 -3.613 -9.375 1.00 0.00 C ATOM 1002 C ILE A 65 -11.958 -3.751 -8.776 1.00 0.00 C ATOM 1003 O ILE A 65 -11.259 -2.759 -8.566 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.404 -3.733 -8.249 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.808 -3.457 -8.794 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -14.078 -2.778 -7.109 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.910 -3.743 -7.797 1.00 0.00 C ATOM 0 H ILE A 65 -14.346 -5.250 -10.233 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.458 -2.635 -9.845 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.377 -4.752 -7.862 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.870 -2.414 -9.103 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.969 -4.064 -9.685 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.829 -2.877 -6.325 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.095 -3.018 -6.703 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -14.076 -1.754 -7.482 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.877 -3.525 -8.251 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.874 -4.793 -7.506 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.774 -3.117 -6.915 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.562 -4.992 -8.504 1.00 0.00 N ATOM 1020 CA PHE A 66 -10.248 -5.269 -7.939 1.00 0.00 C ATOM 1021 C PHE A 66 -9.145 -4.842 -8.903 1.00 0.00 C ATOM 1022 O PHE A 66 -8.105 -4.334 -8.486 1.00 0.00 O ATOM 1023 CB PHE A 66 -10.118 -6.760 -7.616 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.804 -7.130 -6.989 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.554 -6.852 -5.655 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.820 -7.760 -7.734 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.346 -7.193 -5.076 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.610 -8.104 -7.160 1.00 0.00 C ATOM 1029 CZ PHE A 66 -6.373 -7.821 -5.830 1.00 0.00 C ATOM 0 H PHE A 66 -12.134 -5.821 -8.667 1.00 0.00 H new ATOM 0 HA PHE A 66 -10.141 -4.695 -7.018 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.926 -7.049 -6.943 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -10.247 -7.334 -8.534 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.312 -6.363 -5.061 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -8.000 -7.985 -8.775 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -7.163 -6.969 -4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.851 -8.594 -7.752 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.429 -8.090 -5.380 1.00 0.00 H new ATOM 1039 N ASN A 67 -9.383 -5.049 -10.195 1.00 0.00 N ATOM 1040 CA ASN A 67 -8.412 -4.683 -11.222 1.00 0.00 C ATOM 1041 C ASN A 67 -8.192 -3.174 -11.248 1.00 0.00 C ATOM 1042 O ASN A 67 -7.089 -2.702 -11.521 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.884 -5.164 -12.596 1.00 0.00 C ATOM 1044 CG ASN A 67 -9.116 -6.664 -12.643 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -9.971 -7.148 -13.385 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -8.353 -7.410 -11.851 1.00 0.00 N ATOM 0 H ASN A 67 -10.240 -5.468 -10.556 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.466 -5.167 -10.981 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.808 -4.649 -12.859 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -8.142 -4.891 -13.347 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -8.464 -8.424 -11.843 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -7.656 -6.969 -11.251 1.00 0.00 H new ATOM 1053 N GLU A 68 -9.251 -2.422 -10.959 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.181 -0.965 -10.948 1.00 0.00 C ATOM 1055 C GLU A 68 -8.355 -0.469 -9.764 1.00 0.00 C ATOM 1056 O GLU A 68 -7.609 0.503 -9.879 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.589 -0.370 -10.881 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.612 1.150 -10.881 1.00 0.00 C ATOM 1059 CD GLU A 68 -10.089 1.742 -12.175 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -8.856 1.901 -12.300 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -10.913 2.048 -13.063 1.00 0.00 O ATOM 0 H GLU A 68 -10.170 -2.800 -10.729 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.696 -0.642 -11.869 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.168 -0.733 -11.730 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.084 -0.732 -9.980 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.633 1.494 -10.715 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.012 1.519 -10.049 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.498 -1.145 -8.630 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.772 -0.778 -7.419 1.00 0.00 C ATOM 1070 C TYR A 69 -6.274 -1.030 -7.579 1.00 0.00 C ATOM 1071 O TYR A 69 -5.447 -0.190 -7.221 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.312 -1.576 -6.230 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.729 -1.162 -4.898 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.321 -0.159 -4.144 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.590 -1.778 -4.394 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -7.794 0.222 -2.923 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.056 -1.404 -3.175 1.00 0.00 C ATOM 1078 CZ TYR A 69 -6.662 -0.404 -2.444 1.00 0.00 C ATOM 1079 OH TYR A 69 -6.136 -0.028 -1.229 1.00 0.00 O ATOM 0 H TYR A 69 -9.112 -1.953 -8.523 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.920 0.287 -7.240 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.396 -1.464 -6.192 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -8.107 -2.634 -6.392 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.208 0.332 -4.516 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.114 -2.562 -4.964 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.266 1.005 -2.348 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.170 -1.892 -2.797 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.340 -0.567 -1.036 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.935 -2.195 -8.120 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.542 -2.571 -8.326 1.00 0.00 C ATOM 1091 C ILE A 70 -3.893 -1.734 -9.426 1.00 0.00 C ATOM 1092 O ILE A 70 -2.686 -1.502 -9.411 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.419 -4.067 -8.686 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -5.111 -4.930 -7.625 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.957 -4.466 -8.835 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -4.466 -4.858 -6.254 1.00 0.00 C ATOM 0 H ILE A 70 -6.609 -2.897 -8.425 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.021 -2.383 -7.387 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.915 -4.234 -9.642 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -6.153 -4.620 -7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.113 -5.967 -7.960 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.893 -5.524 -9.089 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.497 -3.874 -9.627 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.433 -4.286 -7.896 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -5.014 -5.496 -5.560 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.432 -5.197 -6.320 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.488 -3.829 -5.895 1.00 0.00 H new ATOM 1108 N SER A 71 -4.698 -1.287 -10.381 1.00 0.00 N ATOM 1109 CA SER A 71 -4.190 -0.488 -11.491 1.00 0.00 C ATOM 1110 C SER A 71 -4.023 0.981 -11.105 1.00 0.00 C ATOM 1111 O SER A 71 -3.063 1.630 -11.514 1.00 0.00 O ATOM 1112 CB SER A 71 -5.128 -0.603 -12.694 1.00 0.00 C ATOM 1113 OG SER A 71 -4.654 0.163 -13.787 1.00 0.00 O ATOM 0 H SER A 71 -5.702 -1.463 -10.411 1.00 0.00 H new ATOM 0 HA SER A 71 -3.207 -0.879 -11.753 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.217 -1.648 -12.990 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.126 -0.264 -12.414 1.00 0.00 H new ATOM 0 HG SER A 71 -5.271 0.071 -14.543 1.00 0.00 H new ATOM 1119 N LEU A 72 -4.966 1.504 -10.326 1.00 0.00 N ATOM 1120 CA LEU A 72 -4.921 2.905 -9.912 1.00 0.00 C ATOM 1121 C LEU A 72 -4.154 3.112 -8.605 1.00 0.00 C ATOM 1122 O LEU A 72 -3.132 3.798 -8.577 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.342 3.451 -9.754 1.00 0.00 C ATOM 1124 CG LEU A 72 -6.427 4.908 -9.293 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.768 5.819 -10.462 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -7.452 5.054 -8.179 1.00 0.00 C ATOM 0 H LEU A 72 -5.767 0.983 -9.970 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.390 3.446 -10.695 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.860 3.357 -10.709 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.877 2.827 -9.038 1.00 0.00 H new ATOM 0 HG LEU A 72 -5.453 5.205 -8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.824 6.851 -10.115 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.995 5.735 -11.226 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -7.729 5.525 -10.884 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.500 6.096 -7.863 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -8.431 4.739 -8.542 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.161 4.431 -7.333 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.655 2.512 -7.528 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.051 2.663 -6.204 1.00 0.00 C ATOM 1140 C VAL A 73 -2.625 2.119 -6.125 1.00 0.00 C ATOM 1141 O VAL A 73 -1.691 2.867 -5.835 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.912 1.983 -5.123 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.313 2.196 -3.741 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.338 2.508 -5.179 1.00 0.00 C ATOM 0 H VAL A 73 -5.481 1.914 -7.545 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.005 3.737 -6.023 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.929 0.911 -5.319 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.938 1.707 -2.994 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.310 1.770 -3.710 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.261 3.264 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.936 2.019 -4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.336 3.585 -5.008 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.765 2.297 -6.159 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.458 0.823 -6.369 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.135 0.201 -6.296 1.00 0.00 C ATOM 1156 C GLU A 74 -0.116 0.960 -7.143 1.00 0.00 C ATOM 1157 O GLU A 74 1.006 1.215 -6.700 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.202 -1.260 -6.744 1.00 0.00 C ATOM 1159 CG GLU A 74 0.094 -2.025 -6.532 1.00 0.00 C ATOM 1160 CD GLU A 74 -0.018 -3.486 -6.927 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.393 -4.307 -6.064 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.270 -3.807 -8.098 1.00 0.00 O ATOM 0 H GLU A 74 -3.214 0.185 -6.617 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.810 0.239 -5.256 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.002 -1.761 -6.200 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.465 -1.295 -7.801 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.888 -1.555 -7.113 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.384 -1.957 -5.483 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.511 1.326 -8.357 1.00 0.00 N ATOM 1170 CA LYS A 75 0.375 2.054 -9.258 1.00 0.00 C ATOM 1171 C LYS A 75 0.573 3.493 -8.795 1.00 0.00 C ATOM 1172 O LYS A 75 1.577 4.124 -9.119 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.181 2.037 -10.683 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.186 0.655 -11.319 1.00 0.00 C ATOM 1175 CD LYS A 75 1.226 0.148 -11.579 1.00 0.00 C ATOM 1176 CE LYS A 75 1.930 0.976 -12.644 1.00 0.00 C ATOM 1177 NZ LYS A 75 3.291 0.453 -12.945 1.00 0.00 N ATOM 0 H LYS A 75 -1.436 1.131 -8.739 1.00 0.00 H new ATOM 0 HA LYS A 75 1.344 1.555 -9.246 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.199 2.426 -10.671 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.411 2.711 -11.303 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.709 -0.044 -10.666 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.739 0.689 -12.258 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.801 0.180 -10.653 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.187 -0.895 -11.895 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.332 0.979 -13.556 1.00 0.00 H new ATOM 0 HE3 LYS A 75 2.005 2.011 -12.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.775 1.101 -13.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.837 0.378 -12.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.213 -0.487 -13.384 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.388 4.009 -8.033 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.303 5.376 -7.532 1.00 0.00 C ATOM 1193 C TYR A 76 0.883 5.530 -6.586 1.00 0.00 C ATOM 1194 O TYR A 76 1.686 6.451 -6.730 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.599 5.768 -6.817 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.628 7.212 -6.367 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -2.011 8.225 -7.237 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.271 7.562 -5.070 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -2.037 9.544 -6.830 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.295 8.880 -4.656 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.678 9.867 -5.538 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.702 11.181 -5.128 1.00 0.00 O ATOM 0 H TYR A 76 -1.229 3.505 -7.751 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.158 6.041 -8.384 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.442 5.587 -7.484 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.735 5.123 -5.949 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.293 7.976 -8.249 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.970 6.792 -4.375 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -2.337 10.319 -7.520 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.015 9.136 -3.645 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.422 11.236 -4.190 1.00 0.00 H new ATOM 1212 N ILE A 77 0.987 4.621 -5.621 1.00 0.00 N ATOM 1213 CA ILE A 77 2.077 4.658 -4.652 1.00 0.00 C ATOM 1214 C ILE A 77 3.420 4.388 -5.324 1.00 0.00 C ATOM 1215 O ILE A 77 4.406 5.077 -5.061 1.00 0.00 O ATOM 1216 CB ILE A 77 1.873 3.620 -3.530 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.484 3.765 -2.906 1.00 0.00 C ATOM 1218 CG2 ILE A 77 2.955 3.772 -2.468 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.141 2.655 -1.932 1.00 0.00 C ATOM 0 H ILE A 77 0.331 3.851 -5.489 1.00 0.00 H new ATOM 0 HA ILE A 77 2.076 5.659 -4.221 1.00 0.00 H new ATOM 0 HB ILE A 77 1.948 2.623 -3.964 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.425 4.723 -2.389 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.262 3.785 -3.700 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.799 3.033 -1.682 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.934 3.618 -2.922 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.907 4.773 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.858 2.821 -1.528 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.168 1.696 -2.449 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.866 2.649 -1.118 1.00 0.00 H new ATOM 1231 N GLU A 78 3.449 3.381 -6.192 1.00 0.00 N ATOM 1232 CA GLU A 78 4.674 3.006 -6.891 1.00 0.00 C ATOM 1233 C GLU A 78 5.216 4.152 -7.745 1.00 0.00 C ATOM 1234 O GLU A 78 6.385 4.509 -7.641 1.00 0.00 O ATOM 1235 CB GLU A 78 4.422 1.778 -7.769 1.00 0.00 C ATOM 1236 CG GLU A 78 5.677 1.237 -8.435 1.00 0.00 C ATOM 1237 CD GLU A 78 5.410 -0.016 -9.247 1.00 0.00 C ATOM 1238 OE1 GLU A 78 5.470 -1.122 -8.670 1.00 0.00 O ATOM 1239 OE2 GLU A 78 5.139 0.109 -10.460 1.00 0.00 O ATOM 0 H GLU A 78 2.638 2.810 -6.428 1.00 0.00 H new ATOM 0 HA GLU A 78 5.424 2.770 -6.136 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.976 0.992 -7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.695 2.035 -8.539 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.099 2.004 -9.085 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.424 1.019 -7.672 1.00 0.00 H new ATOM 1246 N GLU A 79 4.360 4.732 -8.578 1.00 0.00 N ATOM 1247 CA GLU A 79 4.771 5.826 -9.455 1.00 0.00 C ATOM 1248 C GLU A 79 5.271 7.028 -8.658 1.00 0.00 C ATOM 1249 O GLU A 79 6.320 7.592 -8.963 1.00 0.00 O ATOM 1250 CB GLU A 79 3.613 6.246 -10.361 1.00 0.00 C ATOM 1251 CG GLU A 79 3.241 5.197 -11.396 1.00 0.00 C ATOM 1252 CD GLU A 79 2.080 5.628 -12.271 1.00 0.00 C ATOM 1253 OE1 GLU A 79 2.310 6.400 -13.224 1.00 0.00 O ATOM 1254 OE2 GLU A 79 0.941 5.190 -12.002 1.00 0.00 O ATOM 0 H GLU A 79 3.379 4.465 -8.666 1.00 0.00 H new ATOM 0 HA GLU A 79 5.595 5.463 -10.069 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.740 6.462 -9.745 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.879 7.171 -10.872 1.00 0.00 H new ATOM 0 HG2 GLU A 79 4.107 4.989 -12.024 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.984 4.267 -10.889 1.00 0.00 H new ATOM 1261 N GLN A 80 4.516 7.411 -7.635 1.00 0.00 N ATOM 1262 CA GLN A 80 4.874 8.555 -6.801 1.00 0.00 C ATOM 1263 C GLN A 80 6.246 8.383 -6.154 1.00 0.00 C ATOM 1264 O GLN A 80 6.963 9.360 -5.937 1.00 0.00 O ATOM 1265 CB GLN A 80 3.813 8.773 -5.720 1.00 0.00 C ATOM 1266 CG GLN A 80 2.508 9.343 -6.255 1.00 0.00 C ATOM 1267 CD GLN A 80 2.668 10.745 -6.804 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.962 10.932 -7.985 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.474 11.742 -5.948 1.00 0.00 N ATOM 0 H GLN A 80 3.650 6.946 -7.362 1.00 0.00 H new ATOM 0 HA GLN A 80 4.920 9.430 -7.450 1.00 0.00 H new ATOM 0 HB2 GLN A 80 3.609 7.823 -5.225 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.211 9.448 -4.962 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.125 8.691 -7.040 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.765 9.351 -5.457 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.232 11.541 -4.978 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.567 12.708 -6.261 1.00 0.00 H new ATOM 1278 N LEU A 81 6.611 7.142 -5.847 1.00 0.00 N ATOM 1279 CA LEU A 81 7.898 6.863 -5.216 1.00 0.00 C ATOM 1280 C LEU A 81 9.030 6.896 -6.234 1.00 0.00 C ATOM 1281 O LEU A 81 10.131 7.367 -5.947 1.00 0.00 O ATOM 1282 CB LEU A 81 7.867 5.499 -4.520 1.00 0.00 C ATOM 1283 CG LEU A 81 6.994 5.428 -3.266 1.00 0.00 C ATOM 1284 CD1 LEU A 81 6.935 4.003 -2.739 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.518 6.373 -2.195 1.00 0.00 C ATOM 0 H LEU A 81 6.038 6.317 -6.023 1.00 0.00 H new ATOM 0 HA LEU A 81 8.080 7.641 -4.474 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.513 4.753 -5.232 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.886 5.223 -4.250 1.00 0.00 H new ATOM 0 HG LEU A 81 5.984 5.739 -3.532 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.310 3.971 -1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.512 3.350 -3.502 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.941 3.665 -2.490 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.884 6.308 -1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.538 6.094 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.508 7.395 -2.575 1.00 0.00 H new ATOM 1297 N LEU A 82 8.741 6.397 -7.426 1.00 0.00 N ATOM 1298 CA LEU A 82 9.725 6.335 -8.498 1.00 0.00 C ATOM 1299 C LEU A 82 10.098 7.727 -8.998 1.00 0.00 C ATOM 1300 O LEU A 82 11.172 7.921 -9.566 1.00 0.00 O ATOM 1301 CB LEU A 82 9.185 5.484 -9.651 1.00 0.00 C ATOM 1302 CG LEU A 82 9.036 3.974 -9.375 1.00 0.00 C ATOM 1303 CD1 LEU A 82 10.073 3.189 -10.161 1.00 0.00 C ATOM 1304 CD2 LEU A 82 9.164 3.647 -7.891 1.00 0.00 C ATOM 0 H LEU A 82 7.825 6.026 -7.677 1.00 0.00 H new ATOM 0 HA LEU A 82 10.629 5.874 -8.100 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.210 5.877 -9.939 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.846 5.611 -10.509 1.00 0.00 H new ATOM 0 HG LEU A 82 8.035 3.686 -9.696 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.956 2.125 -9.956 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.936 3.371 -11.227 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.072 3.508 -9.864 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.052 2.573 -7.744 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.144 3.962 -7.532 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.387 4.172 -7.334 1.00 0.00 H new ATOM 1316 N GLN A 83 9.206 8.692 -8.787 1.00 0.00 N ATOM 1317 CA GLN A 83 9.452 10.066 -9.214 1.00 0.00 C ATOM 1318 C GLN A 83 10.793 10.570 -8.686 1.00 0.00 C ATOM 1319 O GLN A 83 11.379 11.500 -9.242 1.00 0.00 O ATOM 1320 CB GLN A 83 8.326 10.980 -8.730 1.00 0.00 C ATOM 1321 CG GLN A 83 6.988 10.705 -9.396 1.00 0.00 C ATOM 1322 CD GLN A 83 7.011 10.971 -10.890 1.00 0.00 C ATOM 1323 OE1 GLN A 83 6.290 10.332 -11.656 1.00 0.00 O ATOM 1324 NE2 GLN A 83 7.839 11.920 -11.313 1.00 0.00 N ATOM 0 H GLN A 83 8.309 8.548 -8.324 1.00 0.00 H new ATOM 0 HA GLN A 83 9.482 10.081 -10.303 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.215 10.866 -7.652 1.00 0.00 H new ATOM 0 HB3 GLN A 83 8.607 12.017 -8.914 1.00 0.00 H new ATOM 0 HG2 GLN A 83 6.706 9.667 -9.220 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.222 11.326 -8.932 1.00 0.00 H new ATOM 0 HE21 GLN A 83 8.419 12.426 -10.644 1.00 0.00 H new ATOM 0 HE22 GLN A 83 7.894 12.143 -12.307 1.00 0.00 H new ATOM 1333 N ARG A 84 11.270 9.951 -7.610 1.00 0.00 N ATOM 1334 CA ARG A 84 12.540 10.336 -7.007 1.00 0.00 C ATOM 1335 C ARG A 84 13.536 9.178 -7.044 1.00 0.00 C ATOM 1336 O ARG A 84 14.749 9.391 -7.045 1.00 0.00 O ATOM 1337 CB ARG A 84 12.320 10.794 -5.563 1.00 0.00 C ATOM 1338 CG ARG A 84 13.574 11.333 -4.896 1.00 0.00 C ATOM 1339 CD ARG A 84 13.259 11.949 -3.542 1.00 0.00 C ATOM 1340 NE ARG A 84 12.290 13.037 -3.649 1.00 0.00 N ATOM 1341 CZ ARG A 84 11.723 13.630 -2.603 1.00 0.00 C ATOM 1342 NH1 ARG A 84 12.030 13.246 -1.370 1.00 0.00 N ATOM 1343 NH2 ARG A 84 10.850 14.610 -2.786 1.00 0.00 N ATOM 0 H ARG A 84 10.796 9.181 -7.139 1.00 0.00 H new ATOM 0 HA ARG A 84 12.955 11.162 -7.585 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.551 11.566 -5.549 1.00 0.00 H new ATOM 0 HB3 ARG A 84 11.940 9.956 -4.979 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.297 10.527 -4.772 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.038 12.081 -5.539 1.00 0.00 H new ATOM 0 HD2 ARG A 84 12.869 11.180 -2.876 1.00 0.00 H new ATOM 0 HD3 ARG A 84 14.178 12.325 -3.092 1.00 0.00 H new ATOM 0 HE ARG A 84 12.033 13.361 -4.582 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.703 12.494 -1.223 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.593 13.703 -0.570 1.00 0.00 H new ATOM 0 HH21 ARG A 84 10.612 14.911 -3.731 1.00 0.00 H new ATOM 0 HH22 ARG A 84 10.416 15.063 -1.982 1.00 0.00 H new ATOM 1357 N ILE A 85 13.015 7.953 -7.074 1.00 0.00 N ATOM 1358 CA ILE A 85 13.858 6.762 -7.111 1.00 0.00 C ATOM 1359 C ILE A 85 13.645 5.983 -8.411 1.00 0.00 C ATOM 1360 O ILE A 85 12.721 5.174 -8.511 1.00 0.00 O ATOM 1361 CB ILE A 85 13.569 5.831 -5.916 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.568 6.627 -4.608 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.599 4.712 -5.858 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.062 5.838 -3.419 1.00 0.00 C ATOM 0 H ILE A 85 12.013 7.760 -7.073 1.00 0.00 H new ATOM 0 HA ILE A 85 14.892 7.101 -7.055 1.00 0.00 H new ATOM 0 HB ILE A 85 12.582 5.387 -6.050 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.581 6.971 -4.401 1.00 0.00 H new ATOM 0 HG13 ILE A 85 12.949 7.516 -4.734 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.383 4.062 -5.010 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.558 4.131 -6.780 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.595 5.140 -5.743 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.090 6.465 -2.528 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.037 5.517 -3.605 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.694 4.963 -3.267 1.00 0.00 H new ATOM 1376 N PRO A 86 14.495 6.219 -9.430 1.00 0.00 N ATOM 1377 CA PRO A 86 14.381 5.539 -10.725 1.00 0.00 C ATOM 1378 C PRO A 86 14.871 4.096 -10.681 1.00 0.00 C ATOM 1379 O PRO A 86 14.707 3.344 -11.641 1.00 0.00 O ATOM 1380 CB PRO A 86 15.272 6.378 -11.638 1.00 0.00 C ATOM 1381 CG PRO A 86 16.305 6.952 -10.731 1.00 0.00 C ATOM 1382 CD PRO A 86 15.626 7.168 -9.405 1.00 0.00 C ATOM 0 HA PRO A 86 13.345 5.469 -11.056 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.725 5.768 -12.419 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.702 7.162 -12.136 1.00 0.00 H new ATOM 0 HG2 PRO A 86 17.153 6.275 -10.628 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.693 7.890 -11.127 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.300 6.965 -8.573 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.283 8.197 -9.294 1.00 0.00 H new ATOM 1390 N GLU A 87 15.472 3.717 -9.561 1.00 0.00 N ATOM 1391 CA GLU A 87 15.989 2.364 -9.390 1.00 0.00 C ATOM 1392 C GLU A 87 15.213 1.621 -8.308 1.00 0.00 C ATOM 1393 O GLU A 87 15.656 0.583 -7.814 1.00 0.00 O ATOM 1394 CB GLU A 87 17.474 2.406 -9.031 1.00 0.00 C ATOM 1395 CG GLU A 87 18.328 3.122 -10.065 1.00 0.00 C ATOM 1396 CD GLU A 87 19.801 3.116 -9.710 1.00 0.00 C ATOM 1397 OE1 GLU A 87 20.240 4.036 -8.986 1.00 0.00 O ATOM 1398 OE2 GLU A 87 20.515 2.194 -10.153 1.00 0.00 O ATOM 0 H GLU A 87 15.614 4.327 -8.756 1.00 0.00 H new ATOM 0 HA GLU A 87 15.866 1.831 -10.333 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.593 2.901 -8.067 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.840 1.386 -8.912 1.00 0.00 H new ATOM 0 HG2 GLU A 87 18.190 2.647 -11.036 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.986 4.152 -10.163 1.00 0.00 H new ATOM 1405 N PHE A 88 14.053 2.158 -7.949 1.00 0.00 N ATOM 1406 CA PHE A 88 13.211 1.555 -6.922 1.00 0.00 C ATOM 1407 C PHE A 88 12.709 0.182 -7.354 1.00 0.00 C ATOM 1408 O PHE A 88 12.483 -0.065 -8.538 1.00 0.00 O ATOM 1409 CB PHE A 88 12.018 2.458 -6.617 1.00 0.00 C ATOM 1410 CG PHE A 88 11.264 2.057 -5.382 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.718 2.428 -4.128 1.00 0.00 C ATOM 1412 CD2 PHE A 88 10.103 1.307 -5.477 1.00 0.00 C ATOM 1413 CE1 PHE A 88 11.028 2.060 -2.989 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.407 0.935 -4.341 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.871 1.313 -3.096 1.00 0.00 C ATOM 0 H PHE A 88 13.673 3.013 -8.355 1.00 0.00 H new ATOM 0 HA PHE A 88 13.818 1.436 -6.025 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.369 3.484 -6.502 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.337 2.447 -7.468 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.622 3.012 -4.039 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.737 1.010 -6.449 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.393 2.356 -2.016 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.503 0.350 -4.427 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.330 1.025 -2.207 1.00 0.00 H new ATOM 1425 N ASN A 89 12.532 -0.703 -6.380 1.00 0.00 N ATOM 1426 CA ASN A 89 12.045 -2.051 -6.643 1.00 0.00 C ATOM 1427 C ASN A 89 10.915 -2.403 -5.682 1.00 0.00 C ATOM 1428 O ASN A 89 11.156 -2.846 -4.560 1.00 0.00 O ATOM 1429 CB ASN A 89 13.180 -3.069 -6.508 1.00 0.00 C ATOM 1430 CG ASN A 89 14.288 -2.845 -7.520 1.00 0.00 C ATOM 1431 OD1 ASN A 89 15.455 -3.126 -7.250 1.00 0.00 O ATOM 1432 ND2 ASN A 89 13.927 -2.343 -8.695 1.00 0.00 N ATOM 0 H ASN A 89 12.720 -0.509 -5.396 1.00 0.00 H new ATOM 0 HA ASN A 89 11.665 -2.084 -7.664 1.00 0.00 H new ATOM 0 HB2 ASN A 89 13.595 -3.013 -5.502 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.778 -4.075 -6.632 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.629 -2.176 -9.416 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.947 -2.124 -8.877 1.00 0.00 H new ATOM 1439 N MET A 90 9.680 -2.193 -6.129 1.00 0.00 N ATOM 1440 CA MET A 90 8.509 -2.477 -5.307 1.00 0.00 C ATOM 1441 C MET A 90 8.425 -3.962 -4.963 1.00 0.00 C ATOM 1442 O MET A 90 7.817 -4.342 -3.964 1.00 0.00 O ATOM 1443 CB MET A 90 7.236 -2.040 -6.035 1.00 0.00 C ATOM 1444 CG MET A 90 6.008 -1.992 -5.140 1.00 0.00 C ATOM 1445 SD MET A 90 6.182 -0.809 -3.789 1.00 0.00 S ATOM 1446 CE MET A 90 4.563 -0.916 -3.031 1.00 0.00 C ATOM 0 H MET A 90 9.465 -1.827 -7.056 1.00 0.00 H new ATOM 0 HA MET A 90 8.605 -1.915 -4.378 1.00 0.00 H new ATOM 0 HB2 MET A 90 7.397 -1.054 -6.470 1.00 0.00 H new ATOM 0 HB3 MET A 90 7.047 -2.726 -6.861 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.136 -1.729 -5.739 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.824 -2.984 -4.728 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.317 0.037 -2.563 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.819 -1.149 -3.793 1.00 0.00 H new ATOM 0 HE3 MET A 90 4.566 -1.701 -2.275 1.00 0.00 H new ATOM 1456 N ALA A 91 9.043 -4.794 -5.794 1.00 0.00 N ATOM 1457 CA ALA A 91 9.032 -6.238 -5.581 1.00 0.00 C ATOM 1458 C ALA A 91 9.887 -6.633 -4.380 1.00 0.00 C ATOM 1459 O ALA A 91 9.397 -7.254 -3.437 1.00 0.00 O ATOM 1460 CB ALA A 91 9.514 -6.956 -6.831 1.00 0.00 C ATOM 0 H ALA A 91 9.558 -4.494 -6.622 1.00 0.00 H new ATOM 0 HA ALA A 91 8.005 -6.537 -5.371 1.00 0.00 H new ATOM 0 HB1 ALA A 91 9.501 -8.032 -6.660 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.857 -6.714 -7.666 1.00 0.00 H new ATOM 0 HB3 ALA A 91 10.530 -6.638 -7.065 1.00 0.00 H new ATOM 1466 N ALA A 92 11.165 -6.273 -4.422 1.00 0.00 N ATOM 1467 CA ALA A 92 12.085 -6.598 -3.337 1.00 0.00 C ATOM 1468 C ALA A 92 11.753 -5.811 -2.076 1.00 0.00 C ATOM 1469 O ALA A 92 12.036 -6.254 -0.963 1.00 0.00 O ATOM 1470 CB ALA A 92 13.520 -6.328 -3.764 1.00 0.00 C ATOM 0 H ALA A 92 11.587 -5.757 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 92 11.975 -7.658 -3.110 1.00 0.00 H new ATOM 0 HB1 ALA A 92 14.196 -6.575 -2.945 1.00 0.00 H new ATOM 0 HB2 ALA A 92 13.763 -6.941 -4.632 1.00 0.00 H new ATOM 0 HB3 ALA A 92 13.631 -5.275 -4.021 1.00 0.00 H new ATOM 1476 N PHE A 93 11.150 -4.640 -2.257 1.00 0.00 N ATOM 1477 CA PHE A 93 10.783 -3.789 -1.131 1.00 0.00 C ATOM 1478 C PHE A 93 9.656 -4.415 -0.314 1.00 0.00 C ATOM 1479 O PHE A 93 9.776 -4.574 0.899 1.00 0.00 O ATOM 1480 CB PHE A 93 10.364 -2.403 -1.628 1.00 0.00 C ATOM 1481 CG PHE A 93 9.872 -1.500 -0.533 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.737 -1.047 0.450 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.543 -1.109 -0.484 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.286 -0.220 1.461 1.00 0.00 C ATOM 1485 CE2 PHE A 93 8.087 -0.280 0.524 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.960 0.163 1.499 1.00 0.00 C ATOM 0 H PHE A 93 10.906 -4.259 -3.171 1.00 0.00 H new ATOM 0 HA PHE A 93 11.656 -3.688 -0.486 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.212 -1.931 -2.124 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.579 -2.515 -2.376 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.775 -1.344 0.426 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.856 -1.456 -1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.970 0.127 2.221 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.050 0.021 0.549 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.606 0.808 2.290 1.00 0.00 H new ATOM 1496 N THR A 94 8.565 -4.765 -0.987 1.00 0.00 N ATOM 1497 CA THR A 94 7.417 -5.370 -0.322 1.00 0.00 C ATOM 1498 C THR A 94 7.793 -6.682 0.357 1.00 0.00 C ATOM 1499 O THR A 94 7.328 -6.975 1.458 1.00 0.00 O ATOM 1500 CB THR A 94 6.264 -5.626 -1.311 1.00 0.00 C ATOM 1501 OG1 THR A 94 6.743 -6.365 -2.441 1.00 0.00 O ATOM 1502 CG2 THR A 94 5.653 -4.314 -1.777 1.00 0.00 C ATOM 0 H THR A 94 8.452 -4.640 -1.993 1.00 0.00 H new ATOM 0 HA THR A 94 7.086 -4.660 0.436 1.00 0.00 H new ATOM 0 HB THR A 94 5.495 -6.205 -0.799 1.00 0.00 H new ATOM 0 HG1 THR A 94 7.116 -5.746 -3.102 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.841 -4.518 -2.475 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.264 -3.768 -0.917 1.00 0.00 H new ATOM 0 HG23 THR A 94 6.415 -3.714 -2.274 1.00 0.00 H new ATOM 1510 N THR A 95 8.636 -7.470 -0.304 1.00 0.00 N ATOM 1511 CA THR A 95 9.072 -8.749 0.243 1.00 0.00 C ATOM 1512 C THR A 95 9.809 -8.552 1.564 1.00 0.00 C ATOM 1513 O THR A 95 9.468 -9.166 2.575 1.00 0.00 O ATOM 1514 CB THR A 95 9.992 -9.499 -0.740 1.00 0.00 C ATOM 1515 OG1 THR A 95 9.328 -9.671 -1.997 1.00 0.00 O ATOM 1516 CG2 THR A 95 10.389 -10.859 -0.184 1.00 0.00 C ATOM 0 H THR A 95 9.030 -7.245 -1.218 1.00 0.00 H new ATOM 0 HA THR A 95 8.176 -9.346 0.412 1.00 0.00 H new ATOM 0 HB THR A 95 10.894 -8.904 -0.881 1.00 0.00 H new ATOM 0 HG1 THR A 95 9.351 -8.829 -2.497 1.00 0.00 H new ATOM 0 HG21 THR A 95 11.038 -11.368 -0.897 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.919 -10.726 0.759 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.494 -11.459 -0.016 1.00 0.00 H new ATOM 1524 N THR A 96 10.819 -7.689 1.545 1.00 0.00 N ATOM 1525 CA THR A 96 11.609 -7.404 2.736 1.00 0.00 C ATOM 1526 C THR A 96 10.767 -6.706 3.800 1.00 0.00 C ATOM 1527 O THR A 96 11.028 -6.841 4.993 1.00 0.00 O ATOM 1528 CB THR A 96 12.828 -6.524 2.402 1.00 0.00 C ATOM 1529 OG1 THR A 96 13.543 -7.078 1.290 1.00 0.00 O ATOM 1530 CG2 THR A 96 13.760 -6.411 3.600 1.00 0.00 C ATOM 0 H THR A 96 11.110 -7.173 0.714 1.00 0.00 H new ATOM 0 HA THR A 96 11.957 -8.362 3.123 1.00 0.00 H new ATOM 0 HB THR A 96 12.468 -5.528 2.145 1.00 0.00 H new ATOM 0 HG1 THR A 96 13.086 -6.841 0.456 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.613 -5.785 3.339 1.00 0.00 H new ATOM 0 HG22 THR A 96 13.224 -5.964 4.437 1.00 0.00 H new ATOM 0 HG23 THR A 96 14.111 -7.403 3.883 1.00 0.00 H new ATOM 1538 N LEU A 97 9.760 -5.958 3.357 1.00 0.00 N ATOM 1539 CA LEU A 97 8.881 -5.234 4.272 1.00 0.00 C ATOM 1540 C LEU A 97 8.102 -6.199 5.161 1.00 0.00 C ATOM 1541 O LEU A 97 8.063 -6.036 6.382 1.00 0.00 O ATOM 1542 CB LEU A 97 7.910 -4.349 3.486 1.00 0.00 C ATOM 1543 CG LEU A 97 7.571 -3.004 4.140 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.697 -2.169 3.218 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.881 -3.216 5.479 1.00 0.00 C ATOM 0 H LEU A 97 9.532 -5.837 2.370 1.00 0.00 H new ATOM 0 HA LEU A 97 9.502 -4.605 4.909 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.335 -4.158 2.501 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.984 -4.903 3.332 1.00 0.00 H new ATOM 0 HG LEU A 97 8.502 -2.465 4.316 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.466 -1.218 3.698 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.226 -1.984 2.283 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.771 -2.705 3.011 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.649 -2.249 5.926 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.958 -3.777 5.328 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.540 -3.774 6.144 1.00 0.00 H new ATOM 1557 N GLN A 98 7.486 -7.206 4.542 1.00 0.00 N ATOM 1558 CA GLN A 98 6.706 -8.199 5.278 1.00 0.00 C ATOM 1559 C GLN A 98 7.522 -8.788 6.425 1.00 0.00 C ATOM 1560 O GLN A 98 6.974 -9.166 7.461 1.00 0.00 O ATOM 1561 CB GLN A 98 6.238 -9.313 4.339 1.00 0.00 C ATOM 1562 CG GLN A 98 5.275 -8.836 3.263 1.00 0.00 C ATOM 1563 CD GLN A 98 4.834 -9.951 2.335 1.00 0.00 C ATOM 1564 OE1 GLN A 98 3.842 -10.631 2.591 1.00 0.00 O ATOM 1565 NE2 GLN A 98 5.570 -10.141 1.247 1.00 0.00 N ATOM 0 H GLN A 98 7.512 -7.355 3.533 1.00 0.00 H new ATOM 0 HA GLN A 98 5.832 -7.701 5.697 1.00 0.00 H new ATOM 0 HB2 GLN A 98 7.108 -9.765 3.862 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.755 -10.094 4.927 1.00 0.00 H new ATOM 0 HG2 GLN A 98 4.398 -8.395 3.736 1.00 0.00 H new ATOM 0 HG3 GLN A 98 5.751 -8.049 2.678 1.00 0.00 H new ATOM 0 HE21 GLN A 98 6.385 -9.553 1.074 1.00 0.00 H new ATOM 0 HE22 GLN A 98 5.320 -10.875 0.584 1.00 0.00 H new ATOM 1574 N HIS A 99 8.833 -8.863 6.229 1.00 0.00 N ATOM 1575 CA HIS A 99 9.732 -9.389 7.248 1.00 0.00 C ATOM 1576 C HIS A 99 10.137 -8.280 8.213 1.00 0.00 C ATOM 1577 O HIS A 99 10.235 -8.492 9.424 1.00 0.00 O ATOM 1578 CB HIS A 99 10.974 -9.998 6.590 1.00 0.00 C ATOM 1579 CG HIS A 99 12.049 -10.379 7.561 1.00 0.00 C ATOM 1580 ND1 HIS A 99 11.921 -11.413 8.464 1.00 0.00 N ATOM 1581 CD2 HIS A 99 13.280 -9.853 7.767 1.00 0.00 C ATOM 1582 CE1 HIS A 99 13.025 -11.505 9.184 1.00 0.00 C ATOM 1583 NE2 HIS A 99 13.865 -10.571 8.779 1.00 0.00 N ATOM 0 H HIS A 99 9.298 -8.565 5.371 1.00 0.00 H new ATOM 0 HA HIS A 99 9.214 -10.168 7.807 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.678 -10.882 6.025 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.381 -9.284 5.874 1.00 0.00 H new ATOM 0 HD2 HIS A 99 13.719 -9.023 7.234 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.209 -12.222 9.970 1.00 0.00 H new ATOM 0 HE2 HIS A 99 14.798 -10.409 9.157 1.00 0.00 H new ATOM 1592 N HIS A 100 10.353 -7.091 7.662 1.00 0.00 N ATOM 1593 CA HIS A 100 10.748 -5.937 8.456 1.00 0.00 C ATOM 1594 C HIS A 100 9.614 -5.507 9.381 1.00 0.00 C ATOM 1595 O HIS A 100 9.782 -4.610 10.206 1.00 0.00 O ATOM 1596 CB HIS A 100 11.150 -4.779 7.543 1.00 0.00 C ATOM 1597 CG HIS A 100 11.947 -3.719 8.239 1.00 0.00 C ATOM 1598 ND1 HIS A 100 11.375 -2.612 8.830 1.00 0.00 N ATOM 1599 CD2 HIS A 100 13.282 -3.602 8.440 1.00 0.00 C ATOM 1600 CE1 HIS A 100 12.324 -1.860 9.363 1.00 0.00 C ATOM 1601 NE2 HIS A 100 13.489 -2.440 9.140 1.00 0.00 N ATOM 0 H HIS A 100 10.260 -6.902 6.664 1.00 0.00 H new ATOM 0 HA HIS A 100 11.605 -6.218 9.068 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.731 -5.170 6.708 1.00 0.00 H new ATOM 0 HB3 HIS A 100 10.251 -4.329 7.123 1.00 0.00 H new ATOM 0 HD2 HIS A 100 14.042 -4.295 8.110 1.00 0.00 H new ATOM 0 HE1 HIS A 100 12.172 -0.930 9.891 1.00 0.00 H new ATOM 0 HE2 HIS A 100 14.396 -2.082 9.440 1.00 0.00 H new ATOM 1610 N LYS A 101 8.457 -6.150 9.230 1.00 0.00 N ATOM 1611 CA LYS A 101 7.297 -5.846 10.061 1.00 0.00 C ATOM 1612 C LYS A 101 7.630 -6.023 11.536 1.00 0.00 C ATOM 1613 O LYS A 101 6.954 -5.472 12.406 1.00 0.00 O ATOM 1614 CB LYS A 101 6.116 -6.743 9.684 1.00 0.00 C ATOM 1615 CG LYS A 101 5.578 -6.490 8.285 1.00 0.00 C ATOM 1616 CD LYS A 101 4.399 -7.398 7.965 1.00 0.00 C ATOM 1617 CE LYS A 101 3.199 -7.101 8.852 1.00 0.00 C ATOM 1618 NZ LYS A 101 2.048 -7.994 8.542 1.00 0.00 N ATOM 0 H LYS A 101 8.300 -6.884 8.540 1.00 0.00 H new ATOM 0 HA LYS A 101 7.021 -4.806 9.886 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.424 -7.786 9.762 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.313 -6.593 10.405 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.270 -5.448 8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 101 6.371 -6.652 7.555 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.118 -7.273 6.919 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.697 -8.439 8.093 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.481 -7.222 9.898 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.898 -6.062 8.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.250 -7.761 9.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.762 -7.861 7.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.327 -8.985 8.692 1.00 0.00 H new ATOM 1632 N ASP A 102 8.679 -6.794 11.814 1.00 0.00 N ATOM 1633 CA ASP A 102 9.102 -7.042 13.188 1.00 0.00 C ATOM 1634 C ASP A 102 9.678 -5.776 13.820 1.00 0.00 C ATOM 1635 O ASP A 102 10.034 -5.765 14.998 1.00 0.00 O ATOM 1636 CB ASP A 102 10.137 -8.169 13.225 1.00 0.00 C ATOM 1637 CG ASP A 102 10.468 -8.611 14.638 1.00 0.00 C ATOM 1638 OD1 ASP A 102 9.764 -9.501 15.161 1.00 0.00 O ATOM 1639 OD2 ASP A 102 11.429 -8.068 15.222 1.00 0.00 O ATOM 0 H ASP A 102 9.250 -7.257 11.107 1.00 0.00 H new ATOM 0 HA ASP A 102 8.228 -7.343 13.765 1.00 0.00 H new ATOM 0 HB2 ASP A 102 9.760 -9.022 12.660 1.00 0.00 H new ATOM 0 HB3 ASP A 102 11.049 -7.836 12.729 1.00 0.00 H new ATOM 1644 N GLU A 103 9.762 -4.709 13.028 1.00 0.00 N ATOM 1645 CA GLU A 103 10.294 -3.438 13.509 1.00 0.00 C ATOM 1646 C GLU A 103 9.370 -2.280 13.140 1.00 0.00 C ATOM 1647 O GLU A 103 8.883 -1.562 14.015 1.00 0.00 O ATOM 1648 CB GLU A 103 11.690 -3.195 12.933 1.00 0.00 C ATOM 1649 CG GLU A 103 12.335 -1.907 13.421 1.00 0.00 C ATOM 1650 CD GLU A 103 12.542 -1.889 14.923 1.00 0.00 C ATOM 1651 OE1 GLU A 103 13.604 -2.359 15.382 1.00 0.00 O ATOM 1652 OE2 GLU A 103 11.641 -1.404 15.640 1.00 0.00 O ATOM 0 H GLU A 103 9.468 -4.700 12.051 1.00 0.00 H new ATOM 0 HA GLU A 103 10.359 -3.491 14.596 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.333 -4.035 13.195 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.626 -3.170 11.845 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.296 -1.776 12.924 1.00 0.00 H new ATOM 0 HG3 GLU A 103 11.710 -1.061 13.134 1.00 0.00 H new ATOM 1659 N VAL A 104 9.132 -2.100 11.841 1.00 0.00 N ATOM 1660 CA VAL A 104 8.268 -1.023 11.364 1.00 0.00 C ATOM 1661 C VAL A 104 6.856 -1.169 11.923 1.00 0.00 C ATOM 1662 O VAL A 104 6.463 -2.249 12.367 1.00 0.00 O ATOM 1663 CB VAL A 104 8.204 -0.986 9.822 1.00 0.00 C ATOM 1664 CG1 VAL A 104 7.320 -2.104 9.288 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.711 0.369 9.338 1.00 0.00 C ATOM 0 H VAL A 104 9.524 -2.685 11.103 1.00 0.00 H new ATOM 0 HA VAL A 104 8.702 -0.088 11.718 1.00 0.00 H new ATOM 0 HB VAL A 104 9.212 -1.141 9.437 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.291 -2.057 8.199 1.00 0.00 H new ATOM 0 HG12 VAL A 104 7.724 -3.067 9.599 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.311 -1.990 9.683 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.673 0.375 8.249 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.714 0.557 9.737 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.392 1.148 9.681 1.00 0.00 H new ATOM 1675 N ALA A 105 6.098 -0.079 11.897 1.00 0.00 N ATOM 1676 CA ALA A 105 4.732 -0.092 12.402 1.00 0.00 C ATOM 1677 C ALA A 105 3.850 -1.025 11.582 1.00 0.00 C ATOM 1678 O ALA A 105 3.489 -0.720 10.443 1.00 0.00 O ATOM 1679 CB ALA A 105 4.159 1.317 12.403 1.00 0.00 C ATOM 0 H ALA A 105 6.406 0.822 11.532 1.00 0.00 H new ATOM 0 HA ALA A 105 4.753 -0.466 13.426 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.137 1.294 12.783 1.00 0.00 H new ATOM 0 HB2 ALA A 105 4.769 1.957 13.040 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.160 1.711 11.387 1.00 0.00 H new ATOM 1685 N GLY A 106 3.505 -2.165 12.172 1.00 0.00 N ATOM 1686 CA GLY A 106 2.663 -3.130 11.490 1.00 0.00 C ATOM 1687 C GLY A 106 1.292 -2.567 11.175 1.00 0.00 C ATOM 1688 O GLY A 106 0.669 -2.947 10.183 1.00 0.00 O ATOM 0 H GLY A 106 3.794 -2.438 13.111 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.147 -3.443 10.565 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.555 -4.020 12.111 1.00 0.00 H new ATOM 1692 N ASP A 107 0.824 -1.659 12.026 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.481 -1.035 11.843 1.00 0.00 C ATOM 1694 C ASP A 107 -0.505 -0.171 10.584 1.00 0.00 C ATOM 1695 O ASP A 107 -1.538 -0.054 9.925 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.836 -0.184 13.065 1.00 0.00 C ATOM 1697 CG ASP A 107 0.135 0.961 13.275 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -0.094 2.047 12.703 1.00 0.00 O ATOM 1699 OD2 ASP A 107 1.125 0.772 14.013 1.00 0.00 O ATOM 0 H ASP A 107 1.331 -1.339 12.851 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.221 -1.828 11.730 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.843 0.215 12.946 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -0.846 -0.816 13.953 1.00 0.00 H new ATOM 1704 N ILE A 108 0.636 0.432 10.256 1.00 0.00 N ATOM 1705 CA ILE A 108 0.729 1.284 9.074 1.00 0.00 C ATOM 1706 C ILE A 108 0.728 0.450 7.797 1.00 0.00 C ATOM 1707 O ILE A 108 -0.040 0.720 6.873 1.00 0.00 O ATOM 1708 CB ILE A 108 1.996 2.162 9.104 1.00 0.00 C ATOM 1709 CG1 ILE A 108 1.966 3.092 10.320 1.00 0.00 C ATOM 1710 CG2 ILE A 108 2.119 2.965 7.814 1.00 0.00 C ATOM 1711 CD1 ILE A 108 3.188 3.979 10.443 1.00 0.00 C ATOM 0 H ILE A 108 1.502 0.347 10.788 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.147 1.933 9.084 1.00 0.00 H new ATOM 0 HB ILE A 108 2.869 1.514 9.186 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.077 3.720 10.263 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.873 2.490 11.224 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.019 3.579 7.852 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.181 2.283 6.966 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.246 3.607 7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 108 3.093 4.608 11.328 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.080 3.359 10.533 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.271 4.609 9.557 1.00 0.00 H new ATOM 1723 N PHE A 109 1.583 -0.568 7.750 1.00 0.00 N ATOM 1724 CA PHE A 109 1.656 -1.431 6.578 1.00 0.00 C ATOM 1725 C PHE A 109 0.367 -2.226 6.413 1.00 0.00 C ATOM 1726 O PHE A 109 -0.011 -2.580 5.298 1.00 0.00 O ATOM 1727 CB PHE A 109 2.854 -2.380 6.653 1.00 0.00 C ATOM 1728 CG PHE A 109 2.955 -3.299 5.465 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.915 -2.791 4.174 1.00 0.00 C ATOM 1730 CD2 PHE A 109 3.080 -4.667 5.639 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.997 -3.632 3.079 1.00 0.00 C ATOM 1732 CE2 PHE A 109 3.165 -5.513 4.549 1.00 0.00 C ATOM 1733 CZ PHE A 109 3.123 -4.995 3.268 1.00 0.00 C ATOM 0 H PHE A 109 2.228 -0.813 8.502 1.00 0.00 H new ATOM 0 HA PHE A 109 1.788 -0.788 5.708 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.770 -1.794 6.730 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.780 -2.977 7.562 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.819 -1.726 4.023 1.00 0.00 H new ATOM 0 HD2 PHE A 109 3.111 -5.078 6.637 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.963 -3.225 2.079 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.264 -6.578 4.698 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.189 -5.655 2.416 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.304 -2.501 7.531 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.552 -3.261 7.512 1.00 0.00 C ATOM 1745 C ASP A 110 -2.505 -2.708 6.456 1.00 0.00 C ATOM 1746 O ASP A 110 -3.335 -3.438 5.913 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.218 -3.221 8.889 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.523 -3.992 8.929 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -3.480 -5.221 9.144 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -4.587 -3.366 8.746 1.00 0.00 O ATOM 0 H ASP A 110 -0.004 -2.209 8.461 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.318 -4.295 7.260 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.534 -3.633 9.631 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.404 -2.184 9.168 1.00 0.00 H new ATOM 1755 N MET A 111 -2.378 -1.416 6.171 1.00 0.00 N ATOM 1756 CA MET A 111 -3.211 -0.771 5.165 1.00 0.00 C ATOM 1757 C MET A 111 -2.785 -1.218 3.770 1.00 0.00 C ATOM 1758 O MET A 111 -3.603 -1.672 2.969 1.00 0.00 O ATOM 1759 CB MET A 111 -3.099 0.750 5.282 1.00 0.00 C ATOM 1760 CG MET A 111 -3.919 1.505 4.249 1.00 0.00 C ATOM 1761 SD MET A 111 -3.579 3.276 4.252 1.00 0.00 S ATOM 1762 CE MET A 111 -1.855 3.289 3.763 1.00 0.00 C ATOM 0 H MET A 111 -1.706 -0.796 6.623 1.00 0.00 H new ATOM 0 HA MET A 111 -4.249 -1.061 5.330 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.419 1.053 6.279 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.052 1.037 5.182 1.00 0.00 H new ATOM 0 HG2 MET A 111 -3.710 1.101 3.259 1.00 0.00 H new ATOM 0 HG3 MET A 111 -4.979 1.342 4.443 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.690 4.080 3.031 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.230 3.468 4.638 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.595 2.327 3.322 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.490 -1.092 3.497 1.00 0.00 N ATOM 1773 CA LEU A 112 -0.929 -1.477 2.209 1.00 0.00 C ATOM 1774 C LEU A 112 -1.027 -2.985 2.007 1.00 0.00 C ATOM 1775 O LEU A 112 -1.026 -3.472 0.878 1.00 0.00 O ATOM 1776 CB LEU A 112 0.531 -1.027 2.110 1.00 0.00 C ATOM 1777 CG LEU A 112 0.767 0.473 2.304 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.254 0.789 2.279 1.00 0.00 C ATOM 1779 CD2 LEU A 112 0.036 1.274 1.236 1.00 0.00 C ATOM 0 H LEU A 112 -0.806 -0.723 4.157 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.505 -0.985 1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.113 -1.569 2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.918 -1.316 1.133 1.00 0.00 H new ATOM 0 HG LEU A 112 0.371 0.757 3.279 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.401 1.860 2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.755 0.247 3.081 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.674 0.487 1.320 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.217 2.338 1.392 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.401 0.984 0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.034 1.074 1.300 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.125 -3.715 3.113 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.217 -5.171 3.076 1.00 0.00 C ATOM 1793 C LEU A 113 -2.305 -5.623 2.108 1.00 0.00 C ATOM 1794 O LEU A 113 -2.240 -6.722 1.557 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.495 -5.722 4.478 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.589 -7.248 4.573 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.307 -7.899 4.074 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -1.876 -7.671 6.005 1.00 0.00 C ATOM 0 H LEU A 113 -1.143 -3.319 4.053 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.262 -5.563 2.725 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.706 -5.380 5.148 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.429 -5.293 4.841 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.410 -7.581 3.939 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.396 -8.983 4.150 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.139 -7.621 3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.533 -7.560 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.940 -8.758 6.057 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.073 -7.323 6.655 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.821 -7.236 6.331 1.00 0.00 H new ATOM 1810 N THR A 114 -3.307 -4.771 1.910 1.00 0.00 N ATOM 1811 CA THR A 114 -4.412 -5.078 1.005 1.00 0.00 C ATOM 1812 C THR A 114 -3.926 -5.332 -0.425 1.00 0.00 C ATOM 1813 O THR A 114 -4.731 -5.585 -1.321 1.00 0.00 O ATOM 1814 CB THR A 114 -5.446 -3.938 0.982 1.00 0.00 C ATOM 1815 OG1 THR A 114 -4.831 -2.728 0.525 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.043 -3.718 2.364 1.00 0.00 C ATOM 0 H THR A 114 -3.377 -3.861 2.365 1.00 0.00 H new ATOM 0 HA THR A 114 -4.877 -5.987 1.386 1.00 0.00 H new ATOM 0 HB THR A 114 -6.247 -4.219 0.299 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.370 -2.293 1.272 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.771 -2.907 2.321 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.536 -4.631 2.697 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.250 -3.457 3.065 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.612 -5.263 -0.636 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.037 -5.495 -1.959 1.00 0.00 C ATOM 1826 C PHE A 115 -2.278 -6.932 -2.410 1.00 0.00 C ATOM 1827 O PHE A 115 -2.164 -7.247 -3.594 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.528 -5.209 -1.953 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.170 -3.749 -2.052 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -0.854 -2.906 -2.916 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.862 -3.221 -1.287 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.519 -1.569 -3.013 1.00 0.00 C ATOM 1833 CE2 PHE A 115 1.199 -1.884 -1.381 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.509 -1.058 -2.245 1.00 0.00 C ATOM 0 H PHE A 115 -1.928 -5.049 0.090 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.527 -4.816 -2.657 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.097 -5.615 -1.037 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.067 -5.741 -2.785 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.658 -3.300 -3.520 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.407 -3.863 -0.611 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.061 -0.924 -3.689 1.00 0.00 H new ATOM 0 HE2 PHE A 115 2.002 -1.486 -0.779 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.773 -0.013 -2.320 1.00 0.00 H new ATOM 1844 N THR A 116 -2.612 -7.801 -1.459 1.00 0.00 N ATOM 1845 CA THR A 116 -2.864 -9.204 -1.764 1.00 0.00 C ATOM 1846 C THR A 116 -3.828 -9.829 -0.761 1.00 0.00 C ATOM 1847 O THR A 116 -4.535 -10.786 -1.082 1.00 0.00 O ATOM 1848 CB THR A 116 -1.558 -10.020 -1.775 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.842 -11.397 -2.057 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.838 -9.909 -0.441 1.00 0.00 C ATOM 0 H THR A 116 -2.714 -7.558 -0.474 1.00 0.00 H new ATOM 0 HA THR A 116 -3.313 -9.230 -2.757 1.00 0.00 H new ATOM 0 HB THR A 116 -0.911 -9.616 -2.553 1.00 0.00 H new ATOM 0 HG1 THR A 116 -1.006 -11.909 -2.064 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.081 -10.494 -0.474 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.597 -8.865 -0.244 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.482 -10.289 0.353 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.856 -9.287 0.454 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.736 -9.805 1.496 1.00 0.00 C ATOM 1860 C ASP A 117 -6.185 -9.415 1.223 1.00 0.00 C ATOM 1861 O ASP A 117 -6.665 -8.386 1.701 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.301 -9.292 2.870 1.00 0.00 C ATOM 1863 CG ASP A 117 -4.871 -10.124 4.001 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -4.253 -11.150 4.353 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -5.936 -9.751 4.535 1.00 0.00 O ATOM 0 H ASP A 117 -3.282 -8.493 0.740 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.664 -10.893 1.490 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.213 -9.298 2.930 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.621 -8.256 2.987 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.874 -10.247 0.448 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.268 -10.001 0.095 1.00 0.00 C ATOM 1872 C PHE A 118 -9.150 -9.928 1.338 1.00 0.00 C ATOM 1873 O PHE A 118 -10.177 -9.248 1.342 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.773 -11.102 -0.840 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.158 -10.861 -1.365 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.370 -9.995 -2.426 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.249 -11.504 -0.801 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.644 -9.774 -2.914 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.524 -11.285 -1.284 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.722 -10.419 -2.341 1.00 0.00 C ATOM 0 H PHE A 118 -6.487 -11.103 0.050 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.322 -9.039 -0.415 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -8.086 -11.195 -1.681 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.756 -12.053 -0.308 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.530 -9.487 -2.877 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -11.100 -12.184 0.025 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.796 -9.098 -3.742 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.366 -11.791 -0.835 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.719 -10.246 -2.719 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.744 -10.630 2.391 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.503 -10.645 3.637 1.00 0.00 C ATOM 1892 C LEU A 119 -9.531 -9.258 4.271 1.00 0.00 C ATOM 1893 O LEU A 119 -10.549 -8.837 4.821 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.903 -11.658 4.620 1.00 0.00 C ATOM 1895 CG LEU A 119 -9.147 -13.136 4.283 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -10.636 -13.424 4.160 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -8.419 -13.528 3.005 1.00 0.00 C ATOM 0 H LEU A 119 -7.895 -11.195 2.407 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.526 -10.942 3.405 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.828 -11.490 4.676 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.309 -11.459 5.612 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.749 -13.737 5.100 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.784 -14.477 3.921 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -11.130 -13.193 5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -11.061 -12.809 3.367 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.607 -14.579 2.787 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.780 -12.916 2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.348 -13.370 3.133 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.407 -8.552 4.190 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.303 -7.212 4.756 1.00 0.00 C ATOM 1911 C ALA A 120 -9.015 -6.193 3.876 1.00 0.00 C ATOM 1912 O ALA A 120 -9.537 -5.193 4.367 1.00 0.00 O ATOM 1913 CB ALA A 120 -6.843 -6.828 4.938 1.00 0.00 C ATOM 0 H ALA A 120 -7.556 -8.886 3.738 1.00 0.00 H new ATOM 0 HA ALA A 120 -8.789 -7.215 5.732 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.780 -5.825 5.361 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.362 -7.537 5.612 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.339 -6.846 3.972 1.00 0.00 H new ATOM 1919 N PHE A 121 -9.033 -6.456 2.575 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.679 -5.566 1.616 1.00 0.00 C ATOM 1921 C PHE A 121 -11.174 -5.452 1.907 1.00 0.00 C ATOM 1922 O PHE A 121 -11.706 -4.352 2.088 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.453 -6.094 0.195 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.697 -5.081 -0.889 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.063 -3.849 -0.862 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.552 -5.368 -1.941 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.279 -2.922 -1.864 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.770 -4.445 -2.947 1.00 0.00 C ATOM 1929 CZ PHE A 121 -10.134 -3.220 -2.907 1.00 0.00 C ATOM 0 H PHE A 121 -8.605 -7.283 2.157 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.240 -4.572 1.706 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.428 -6.456 0.113 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.107 -6.950 0.030 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.393 -3.611 -0.049 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -11.054 -6.324 -1.975 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.779 -1.965 -1.831 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.437 -4.682 -3.763 1.00 0.00 H new ATOM 0 HZ PHE A 121 -10.305 -2.496 -3.690 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.843 -6.599 1.966 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.275 -6.638 2.239 1.00 0.00 C ATOM 1941 C LYS A 122 -13.566 -6.127 3.646 1.00 0.00 C ATOM 1942 O LYS A 122 -14.420 -5.262 3.838 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.805 -8.065 2.077 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.296 -8.201 2.342 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.721 -9.659 2.384 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.213 -9.801 2.637 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.619 -11.227 2.782 1.00 0.00 N ATOM 0 H LYS A 122 -11.416 -7.515 1.828 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.781 -5.990 1.523 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.593 -8.408 1.064 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.263 -8.723 2.757 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.544 -7.721 3.289 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.854 -7.680 1.564 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.464 -10.141 1.440 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.168 -10.177 3.167 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.482 -9.253 3.540 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.765 -9.348 1.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.643 -11.281 2.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.386 -11.745 1.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.111 -11.653 3.584 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.844 -6.666 4.626 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.023 -6.268 6.018 1.00 0.00 C ATOM 1963 C GLU A 123 -12.809 -4.766 6.189 1.00 0.00 C ATOM 1964 O GLU A 123 -13.388 -4.147 7.081 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.056 -7.038 6.918 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.224 -6.730 8.397 1.00 0.00 C ATOM 1967 CD GLU A 123 -11.308 -7.558 9.276 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -10.156 -7.131 9.502 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -11.740 -8.635 9.737 1.00 0.00 O ATOM 0 H GLU A 123 -12.130 -7.380 4.481 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.047 -6.505 6.308 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.199 -8.107 6.760 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.033 -6.806 6.621 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.026 -5.672 8.568 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.259 -6.911 8.686 1.00 0.00 H new ATOM 1976 N MET A 124 -11.974 -4.187 5.331 1.00 0.00 N ATOM 1977 CA MET A 124 -11.690 -2.758 5.395 1.00 0.00 C ATOM 1978 C MET A 124 -12.923 -1.943 5.026 1.00 0.00 C ATOM 1979 O MET A 124 -13.281 -0.993 5.724 1.00 0.00 O ATOM 1980 CB MET A 124 -10.533 -2.395 4.461 1.00 0.00 C ATOM 1981 CG MET A 124 -10.167 -0.919 4.492 1.00 0.00 C ATOM 1982 SD MET A 124 -8.782 -0.523 3.406 1.00 0.00 S ATOM 1983 CE MET A 124 -9.441 -1.022 1.816 1.00 0.00 C ATOM 0 H MET A 124 -11.484 -4.683 4.586 1.00 0.00 H new ATOM 0 HA MET A 124 -11.406 -2.520 6.420 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.658 -2.984 4.735 1.00 0.00 H new ATOM 0 HB3 MET A 124 -10.799 -2.674 3.441 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.034 -0.327 4.199 1.00 0.00 H new ATOM 0 HG3 MET A 124 -9.916 -0.632 5.513 1.00 0.00 H new ATOM 0 HE1 MET A 124 -8.880 -0.532 1.020 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.354 -2.103 1.709 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.490 -0.735 1.751 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.569 -2.317 3.926 1.00 0.00 N ATOM 1994 CA PHE A 125 -14.763 -1.613 3.472 1.00 0.00 C ATOM 1995 C PHE A 125 -15.899 -1.741 4.483 1.00 0.00 C ATOM 1996 O PHE A 125 -16.574 -0.760 4.795 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.209 -2.136 2.106 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.253 -1.795 0.999 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.909 -0.476 0.744 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.696 -2.792 0.216 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.027 -0.160 -0.271 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.814 -2.482 -0.800 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.479 -1.164 -1.044 1.00 0.00 C ATOM 0 H PHE A 125 -13.288 -3.099 3.335 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.510 -0.557 3.378 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.322 -3.219 2.158 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.190 -1.724 1.869 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.335 0.313 1.346 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.954 -3.824 0.402 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.766 0.871 -0.460 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.386 -3.269 -1.403 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.789 -0.920 -1.838 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.108 -2.952 4.992 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.163 -3.192 5.971 1.00 0.00 C ATOM 2015 C LEU A 126 -16.943 -2.346 7.221 1.00 0.00 C ATOM 2016 O LEU A 126 -17.895 -1.833 7.811 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.225 -4.675 6.344 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.068 -5.547 5.408 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.473 -5.571 4.008 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.186 -6.960 5.962 1.00 0.00 C ATOM 0 H LEU A 126 -15.564 -3.778 4.744 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.113 -2.905 5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.210 -5.070 6.367 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.624 -4.763 7.354 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.066 -5.114 5.345 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.089 -6.196 3.362 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.441 -4.557 3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.462 -5.977 4.049 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.788 -7.567 5.286 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.192 -7.398 6.056 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.662 -6.928 6.942 1.00 0.00 H new ATOM 2032 N ASP A 127 -15.683 -2.205 7.620 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.338 -1.412 8.794 1.00 0.00 C ATOM 2034 C ASP A 127 -15.680 0.057 8.564 1.00 0.00 C ATOM 2035 O ASP A 127 -16.176 0.740 9.462 1.00 0.00 O ATOM 2036 CB ASP A 127 -13.850 -1.558 9.121 1.00 0.00 C ATOM 2037 CG ASP A 127 -13.463 -0.833 10.395 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -13.150 0.373 10.320 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.474 -1.473 11.468 1.00 0.00 O ATOM 0 H ASP A 127 -14.885 -2.629 7.148 1.00 0.00 H new ATOM 0 HA ASP A 127 -15.920 -1.780 9.639 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.605 -2.615 9.219 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.259 -1.170 8.292 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.409 0.535 7.352 1.00 0.00 N ATOM 2045 CA TYR A 128 -15.693 1.919 6.993 1.00 0.00 C ATOM 2046 C TYR A 128 -17.185 2.203 7.112 1.00 0.00 C ATOM 2047 O TYR A 128 -17.591 3.266 7.581 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.217 2.204 5.565 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.453 3.628 5.112 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -14.579 4.646 5.471 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.549 3.952 4.322 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -14.789 5.947 5.057 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -16.766 5.251 3.902 1.00 0.00 C ATOM 2054 CZ TYR A 128 -15.884 6.244 4.273 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.097 7.538 3.856 1.00 0.00 O ATOM 0 H TYR A 128 -14.993 -0.017 6.602 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.157 2.572 7.681 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.152 1.983 5.497 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.727 1.526 4.881 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -13.720 4.416 6.084 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.242 3.177 4.031 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.100 6.727 5.346 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.622 5.487 3.287 1.00 0.00 H new ATOM 0 HH TYR A 128 -16.911 7.576 3.311 1.00 0.00 H new ATOM 2065 N ARG A 129 -17.996 1.240 6.686 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.446 1.375 6.744 1.00 0.00 C ATOM 2067 C ARG A 129 -19.909 1.555 8.186 1.00 0.00 C ATOM 2068 O ARG A 129 -20.761 2.398 8.473 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.113 0.145 6.118 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.633 0.195 6.126 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.210 -0.482 7.360 1.00 0.00 C ATOM 2072 NE ARG A 129 -23.670 -0.489 7.345 1.00 0.00 N ATOM 2073 CZ ARG A 129 -24.413 -1.193 8.195 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.834 -1.947 9.120 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -25.735 -1.142 8.118 1.00 0.00 N ATOM 0 H ARG A 129 -17.672 0.355 6.296 1.00 0.00 H new ATOM 0 HA ARG A 129 -19.738 2.260 6.178 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.768 0.042 5.089 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -19.786 -0.746 6.655 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -21.963 1.233 6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -22.018 -0.292 5.230 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -21.843 -1.507 7.417 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -21.859 0.033 8.254 1.00 0.00 H new ATOM 0 HE ARG A 129 -24.147 0.078 6.644 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.817 -1.988 9.181 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.406 -2.486 9.770 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -26.183 -0.563 7.407 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -26.305 -1.682 8.769 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.344 0.758 9.088 1.00 0.00 N ATOM 2090 CA ALA A 130 -19.697 0.831 10.500 1.00 0.00 C ATOM 2091 C ALA A 130 -19.357 2.202 11.078 1.00 0.00 C ATOM 2092 O ALA A 130 -20.044 2.697 11.971 1.00 0.00 O ATOM 2093 CB ALA A 130 -18.985 -0.264 11.280 1.00 0.00 C ATOM 0 H ALA A 130 -18.640 0.054 8.865 1.00 0.00 H new ATOM 0 HA ALA A 130 -20.773 0.683 10.589 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -19.258 -0.197 12.333 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -19.279 -1.238 10.890 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -17.907 -0.142 11.176 1.00 0.00 H new ATOM 2099 N GLU A 131 -18.292 2.809 10.563 1.00 0.00 N ATOM 2100 CA GLU A 131 -17.860 4.123 11.026 1.00 0.00 C ATOM 2101 C GLU A 131 -18.770 5.219 10.479 1.00 0.00 C ATOM 2102 O GLU A 131 -18.868 6.304 11.054 1.00 0.00 O ATOM 2103 CB GLU A 131 -16.413 4.384 10.605 1.00 0.00 C ATOM 2104 CG GLU A 131 -15.813 5.635 11.226 1.00 0.00 C ATOM 2105 CD GLU A 131 -14.376 5.863 10.801 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -13.472 5.263 11.420 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.154 6.642 9.851 1.00 0.00 O ATOM 0 H GLU A 131 -17.712 2.411 9.824 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.921 4.137 12.114 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.803 3.524 10.880 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.370 4.471 9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.413 6.500 10.944 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.859 5.555 12.312 1.00 0.00 H new ATOM 2114 N LYS A 132 -19.437 4.927 9.366 1.00 0.00 N ATOM 2115 CA LYS A 132 -20.339 5.886 8.737 1.00 0.00 C ATOM 2116 C LYS A 132 -21.649 5.998 9.512 1.00 0.00 C ATOM 2117 O LYS A 132 -22.547 6.747 9.127 1.00 0.00 O ATOM 2118 CB LYS A 132 -20.618 5.477 7.289 1.00 0.00 C ATOM 2119 CG LYS A 132 -19.396 5.561 6.387 1.00 0.00 C ATOM 2120 CD LYS A 132 -19.049 7.005 6.052 1.00 0.00 C ATOM 2121 CE LYS A 132 -19.960 7.560 4.969 1.00 0.00 C ATOM 2122 NZ LYS A 132 -19.724 6.904 3.654 1.00 0.00 N ATOM 0 H LYS A 132 -19.369 4.032 8.881 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.854 6.862 8.745 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -21.000 4.456 7.276 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.403 6.116 6.884 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -18.547 5.086 6.878 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -19.583 5.008 5.467 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -19.133 7.618 6.949 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -18.012 7.064 5.722 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -21.000 7.420 5.263 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -19.798 8.634 4.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -19.418 7.616 2.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -18.985 6.179 3.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -20.604 6.457 3.326 1.00 0.00 H new ATOM 2136 N GLU A 133 -21.750 5.248 10.605 1.00 0.00 N ATOM 2137 CA GLU A 133 -22.947 5.266 11.436 1.00 0.00 C ATOM 2138 C GLU A 133 -22.852 6.362 12.495 1.00 0.00 C ATOM 2139 O GLU A 133 -23.837 6.683 13.161 1.00 0.00 O ATOM 2140 CB GLU A 133 -23.156 3.897 12.091 1.00 0.00 C ATOM 2141 CG GLU A 133 -22.655 3.821 13.520 1.00 0.00 C ATOM 2142 CD GLU A 133 -22.960 2.490 14.178 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -24.070 2.343 14.732 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -22.091 1.595 14.139 1.00 0.00 O ATOM 0 H GLU A 133 -21.017 4.620 10.935 1.00 0.00 H new ATOM 0 HA GLU A 133 -23.807 5.483 10.802 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -24.219 3.655 12.075 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -22.647 3.138 11.496 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -21.578 3.989 13.532 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -23.109 4.622 14.103 1.00 0.00 H new ATOM 2151 N GLY A 134 -21.660 6.932 12.643 1.00 0.00 N ATOM 2152 CA GLY A 134 -21.454 7.984 13.622 1.00 0.00 C ATOM 2153 C GLY A 134 -20.367 7.641 14.620 1.00 0.00 C ATOM 2154 O GLY A 134 -19.318 8.285 14.653 1.00 0.00 O ATOM 0 H GLY A 134 -20.832 6.684 12.102 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -21.192 8.909 13.108 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -22.387 8.169 14.155 1.00 0.00 H new ATOM 2158 N ARG A 135 -20.619 6.622 15.436 1.00 0.00 N ATOM 2159 CA ARG A 135 -19.656 6.189 16.442 1.00 0.00 C ATOM 2160 C ARG A 135 -20.017 4.810 16.982 1.00 0.00 C ATOM 2161 O ARG A 135 -21.194 4.466 17.095 1.00 0.00 O ATOM 2162 CB ARG A 135 -19.592 7.202 17.588 1.00 0.00 C ATOM 2163 CG ARG A 135 -20.926 7.424 18.282 1.00 0.00 C ATOM 2164 CD ARG A 135 -20.832 8.523 19.329 1.00 0.00 C ATOM 2165 NE ARG A 135 -22.105 8.737 20.012 1.00 0.00 N ATOM 2166 CZ ARG A 135 -22.412 9.854 20.667 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -21.543 10.854 20.726 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -23.590 9.969 21.264 1.00 0.00 N ATOM 0 H ARG A 135 -21.483 6.080 15.420 1.00 0.00 H new ATOM 0 HA ARG A 135 -18.676 6.127 15.969 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -18.863 6.861 18.323 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -19.232 8.155 17.200 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -21.683 7.688 17.543 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -21.251 6.497 18.754 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -20.067 8.263 20.061 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -20.515 9.451 18.853 1.00 0.00 H new ATOM 0 HE ARG A 135 -22.797 7.989 19.986 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -20.635 10.769 20.268 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -21.782 11.708 21.229 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -24.261 9.202 21.221 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -23.826 10.825 21.766 1.00 0.00 H new ATOM 2182 N GLY A 136 -18.998 4.024 17.312 1.00 0.00 N ATOM 2183 CA GLY A 136 -19.226 2.689 17.833 1.00 0.00 C ATOM 2184 C GLY A 136 -18.858 2.565 19.299 1.00 0.00 C ATOM 2185 O GLY A 136 -18.970 3.575 20.026 1.00 0.00 O ATOM 2186 OXT GLY A 136 -18.460 1.459 19.719 1.00 0.00 O ATOM 0 H GLY A 136 -18.016 4.288 17.228 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -20.276 2.426 17.702 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -18.643 1.972 17.254 1.00 0.00 H new TER 2190 GLY A 136