USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1106 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 27 THR OG1 : rot 80:sc= 0.455 USER MOD Set 1.2: A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.0306 K(o=-0.031,f=-1.3!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 159:sc= -0.0397 (180deg=-0.3) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 31 MET CE :methyl 173:sc= -5.89! (180deg=-6.17!) USER MOD Single : A 32 ASN : amide:sc= -0.461 X(o=-0.46,f=-0.071) USER MOD Single : A 36 SER OG : rot 180:sc= -0.0133 USER MOD Single : A 37 LYS NZ :NH3+ -141:sc= -0.173 (180deg=-1.49!) USER MOD Single : A 38 MET CE :methyl 136:sc= -6.7! (180deg=-7.35!) USER MOD Single : A 43 MET CE :methyl 159:sc= 0 (180deg=-0.165) USER MOD Single : A 44 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.41) USER MOD Single : A 45 LYS NZ :NH3+ -179:sc= 1.32 (180deg=1.31) USER MOD Single : A 46 SER OG : rot 30:sc= -0.63 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 160:sc= -0.223 USER MOD Single : A 53 ASN : amide:sc= -0.653 X(o=-0.65,f=-0.15) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.397 X(o=-0.4,f=-0.4) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.611 K(o=-0.61,f=-1.9) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0117) USER MOD Single : A 80 THR OG1 : rot 156:sc= 2.07 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.391 USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.117 K(o=-0.12,f=-6.3!) USER MOD Single : A 100 SER OG : rot 102:sc= 0.0653 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 76:sc= -1.75 USER MOD Single : A 110 HIS : no HD1:sc= -0.362 X(o=-0.36,f=-0.77) USER MOD Single : A 119 CYS SG : rot 121:sc= -0.542 USER MOD Single : A 123 THR OG1 : rot -42:sc= 0.0902! USER MOD Single : A 125 TYR OH : rot 15:sc= -0.122 USER MOD Single : A 126 TYR OH : rot -71:sc= -0.699 USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 7.656 -2.408 -2.392 1.00 20.31 N ATOM 45 CA ILE A 4 8.148 -2.994 -1.151 1.00 62.23 C ATOM 46 C ILE A 4 9.102 -4.151 -1.430 1.00 74.21 C ATOM 47 O ILE A 4 9.116 -4.706 -2.529 1.00 35.53 O ATOM 48 CB ILE A 4 6.991 -3.498 -0.269 1.00 21.41 C ATOM 49 CG1 ILE A 4 5.859 -4.047 -1.139 1.00 72.34 C ATOM 50 CG2 ILE A 4 6.482 -2.380 0.628 1.00 44.31 C ATOM 51 CD1 ILE A 4 6.283 -5.194 -2.030 1.00 33.44 C ATOM 0 HA ILE A 4 8.682 -2.206 -0.620 1.00 62.23 H new ATOM 0 HB ILE A 4 7.362 -4.304 0.364 1.00 21.41 H new ATOM 0 HG12 ILE A 4 5.045 -4.380 -0.495 1.00 72.34 H new ATOM 0 HG13 ILE A 4 5.465 -3.242 -1.759 1.00 72.34 H new ATOM 0 HG21 ILE A 4 5.664 -2.752 1.245 1.00 44.31 H new ATOM 0 HG22 ILE A 4 7.291 -2.031 1.270 1.00 44.31 H new ATOM 0 HG23 ILE A 4 6.125 -1.554 0.013 1.00 44.31 H new ATOM 0 HD11 ILE A 4 5.430 -5.533 -2.618 1.00 33.44 H new ATOM 0 HD12 ILE A 4 7.076 -4.861 -2.700 1.00 33.44 H new ATOM 0 HD13 ILE A 4 6.649 -6.016 -1.415 1.00 33.44 H new ATOM 63 N ARG A 5 9.896 -4.511 -0.427 1.00 42.33 N ATOM 64 CA ARG A 5 10.853 -5.602 -0.564 1.00 33.50 C ATOM 65 C ARG A 5 10.210 -6.937 -0.197 1.00 24.11 C ATOM 66 O ARG A 5 9.120 -6.976 0.373 1.00 32.04 O ATOM 67 CB ARG A 5 12.075 -5.352 0.321 1.00 10.11 C ATOM 68 CG ARG A 5 11.987 -6.019 1.684 1.00 63.52 C ATOM 69 CD ARG A 5 13.211 -5.714 2.534 1.00 53.23 C ATOM 70 NE ARG A 5 13.333 -4.288 2.824 1.00 43.34 N ATOM 71 CZ ARG A 5 12.521 -3.632 3.645 1.00 20.33 C ATOM 72 NH1 ARG A 5 11.533 -4.272 4.255 1.00 12.25 N ATOM 73 NH2 ARG A 5 12.697 -2.334 3.858 1.00 32.43 N ATOM 0 H ARG A 5 9.895 -4.063 0.489 1.00 42.33 H new ATOM 0 HA ARG A 5 11.171 -5.645 -1.606 1.00 33.50 H new ATOM 0 HB2 ARG A 5 12.966 -5.713 -0.194 1.00 10.11 H new ATOM 0 HB3 ARG A 5 12.199 -4.278 0.459 1.00 10.11 H new ATOM 0 HG2 ARG A 5 11.090 -5.677 2.200 1.00 63.52 H new ATOM 0 HG3 ARG A 5 11.890 -7.097 1.557 1.00 63.52 H new ATOM 0 HD2 ARG A 5 13.151 -6.270 3.469 1.00 53.23 H new ATOM 0 HD3 ARG A 5 14.107 -6.057 2.016 1.00 53.23 H new ATOM 0 HE ARG A 5 14.084 -3.767 2.371 1.00 43.34 H new ATOM 0 HH11 ARG A 5 11.396 -5.270 4.094 1.00 12.25 H new ATOM 0 HH12 ARG A 5 10.910 -3.767 4.885 1.00 12.25 H new ATOM 0 HH21 ARG A 5 13.457 -1.839 3.391 1.00 32.43 H new ATOM 0 HH22 ARG A 5 12.073 -1.831 4.489 1.00 32.43 H new ATOM 87 N ILE A 6 10.894 -8.027 -0.528 1.00 74.51 N ATOM 88 CA ILE A 6 10.390 -9.363 -0.233 1.00 30.03 C ATOM 89 C ILE A 6 11.143 -9.988 0.937 1.00 74.10 C ATOM 90 O ILE A 6 10.588 -10.789 1.690 1.00 54.33 O ATOM 91 CB ILE A 6 10.504 -10.291 -1.457 1.00 32.05 C ATOM 92 CG1 ILE A 6 10.085 -9.549 -2.727 1.00 50.14 C ATOM 93 CG2 ILE A 6 9.652 -11.536 -1.258 1.00 52.24 C ATOM 94 CD1 ILE A 6 11.211 -8.772 -3.372 1.00 41.50 C ATOM 0 H ILE A 6 11.798 -8.012 -1.000 1.00 74.51 H new ATOM 0 HA ILE A 6 9.338 -9.253 0.032 1.00 30.03 H new ATOM 0 HB ILE A 6 11.544 -10.600 -1.566 1.00 32.05 H new ATOM 0 HG12 ILE A 6 9.693 -10.268 -3.446 1.00 50.14 H new ATOM 0 HG13 ILE A 6 9.273 -8.863 -2.486 1.00 50.14 H new ATOM 0 HG21 ILE A 6 9.743 -12.182 -2.131 1.00 52.24 H new ATOM 0 HG22 ILE A 6 9.993 -12.072 -0.372 1.00 52.24 H new ATOM 0 HG23 ILE A 6 8.609 -11.246 -1.128 1.00 52.24 H new ATOM 0 HD11 ILE A 6 10.842 -8.271 -4.267 1.00 41.50 H new ATOM 0 HD12 ILE A 6 11.589 -8.029 -2.670 1.00 41.50 H new ATOM 0 HD13 ILE A 6 12.015 -9.455 -3.644 1.00 41.50 H new ATOM 106 N VAL A 7 12.410 -9.616 1.085 1.00 40.40 N ATOM 107 CA VAL A 7 13.239 -10.137 2.165 1.00 30.11 C ATOM 108 C VAL A 7 14.283 -9.115 2.599 1.00 2.32 C ATOM 109 O VAL A 7 15.165 -8.727 1.832 1.00 13.23 O ATOM 110 CB VAL A 7 13.952 -11.437 1.748 1.00 71.12 C ATOM 111 CG1 VAL A 7 12.944 -12.558 1.547 1.00 73.24 C ATOM 112 CG2 VAL A 7 14.772 -11.213 0.486 1.00 33.41 C ATOM 0 H VAL A 7 12.885 -8.955 0.470 1.00 40.40 H new ATOM 0 HA VAL A 7 12.573 -10.349 3.001 1.00 30.11 H new ATOM 0 HB VAL A 7 14.631 -11.731 2.548 1.00 71.12 H new ATOM 0 HG11 VAL A 7 13.466 -13.468 1.253 1.00 73.24 H new ATOM 0 HG12 VAL A 7 12.405 -12.734 2.478 1.00 73.24 H new ATOM 0 HG13 VAL A 7 12.238 -12.276 0.766 1.00 73.24 H new ATOM 0 HG21 VAL A 7 15.269 -12.142 0.205 1.00 33.41 H new ATOM 0 HG22 VAL A 7 14.115 -10.894 -0.323 1.00 33.41 H new ATOM 0 HG23 VAL A 7 15.520 -10.442 0.670 1.00 33.41 H new ATOM 122 N PRO A 8 14.184 -8.666 3.860 1.00 61.55 N ATOM 123 CA PRO A 8 15.113 -7.683 4.425 1.00 33.44 C ATOM 124 C PRO A 8 16.509 -8.259 4.636 1.00 71.01 C ATOM 125 O PRO A 8 16.824 -9.341 4.141 1.00 5.15 O ATOM 126 CB PRO A 8 14.474 -7.325 5.769 1.00 11.34 C ATOM 127 CG PRO A 8 13.655 -8.516 6.129 1.00 11.15 C ATOM 128 CD PRO A 8 13.158 -9.085 4.829 1.00 23.44 C ATOM 0 HA PRO A 8 15.255 -6.829 3.763 1.00 33.44 H new ATOM 0 HB2 PRO A 8 15.232 -7.122 6.526 1.00 11.34 H new ATOM 0 HB3 PRO A 8 13.857 -6.430 5.688 1.00 11.34 H new ATOM 0 HG2 PRO A 8 14.250 -9.249 6.674 1.00 11.15 H new ATOM 0 HG3 PRO A 8 12.823 -8.237 6.776 1.00 11.15 H new ATOM 0 HD2 PRO A 8 13.067 -10.170 4.874 1.00 23.44 H new ATOM 0 HD3 PRO A 8 12.175 -8.693 4.568 1.00 23.44 H new ATOM 136 N GLN A 9 17.340 -7.529 5.373 1.00 60.03 N ATOM 137 CA GLN A 9 18.703 -7.968 5.648 1.00 71.42 C ATOM 138 C GLN A 9 18.772 -8.739 6.962 1.00 13.54 C ATOM 139 O GLN A 9 17.861 -8.660 7.787 1.00 13.01 O ATOM 140 CB GLN A 9 19.648 -6.767 5.697 1.00 45.02 C ATOM 141 CG GLN A 9 19.341 -5.796 6.826 1.00 71.35 C ATOM 142 CD GLN A 9 20.101 -4.491 6.696 1.00 20.12 C ATOM 143 OE1 GLN A 9 20.609 -4.159 5.625 1.00 43.21 O ATOM 144 NE2 GLN A 9 20.183 -3.742 7.790 1.00 72.42 N ATOM 0 H GLN A 9 17.093 -6.631 5.790 1.00 60.03 H new ATOM 0 HA GLN A 9 19.013 -8.632 4.842 1.00 71.42 H new ATOM 0 HB2 GLN A 9 20.672 -7.125 5.805 1.00 45.02 H new ATOM 0 HB3 GLN A 9 19.595 -6.235 4.747 1.00 45.02 H new ATOM 0 HG2 GLN A 9 18.271 -5.589 6.841 1.00 71.35 H new ATOM 0 HG3 GLN A 9 19.589 -6.263 7.779 1.00 71.35 H new ATOM 0 HE21 GLN A 9 19.747 -4.056 8.657 1.00 72.42 H new ATOM 0 HE22 GLN A 9 20.682 -2.853 7.763 1.00 72.42 H new ATOM 153 N ILE A 10 19.857 -9.482 7.151 1.00 74.14 N ATOM 154 CA ILE A 10 20.044 -10.266 8.365 1.00 12.34 C ATOM 155 C ILE A 10 21.193 -9.715 9.203 1.00 60.20 C ATOM 156 O ILE A 10 22.274 -9.432 8.685 1.00 21.33 O ATOM 157 CB ILE A 10 20.321 -11.746 8.043 1.00 2.14 C ATOM 158 CG1 ILE A 10 21.437 -11.864 7.003 1.00 2.32 C ATOM 159 CG2 ILE A 10 19.054 -12.427 7.548 1.00 0.30 C ATOM 160 CD1 ILE A 10 21.810 -13.293 6.676 1.00 11.21 C ATOM 0 H ILE A 10 20.620 -9.557 6.479 1.00 74.14 H new ATOM 0 HA ILE A 10 19.116 -10.195 8.933 1.00 12.34 H new ATOM 0 HB ILE A 10 20.646 -12.246 8.955 1.00 2.14 H new ATOM 0 HG12 ILE A 10 21.125 -11.360 6.088 1.00 2.32 H new ATOM 0 HG13 ILE A 10 22.321 -11.341 7.369 1.00 2.32 H new ATOM 0 HG21 ILE A 10 19.266 -13.473 7.325 1.00 0.30 H new ATOM 0 HG22 ILE A 10 18.285 -12.369 8.319 1.00 0.30 H new ATOM 0 HG23 ILE A 10 18.701 -11.928 6.646 1.00 0.30 H new ATOM 0 HD11 ILE A 10 22.607 -13.300 5.932 1.00 11.21 H new ATOM 0 HD12 ILE A 10 22.153 -13.795 7.580 1.00 11.21 H new ATOM 0 HD13 ILE A 10 20.939 -13.815 6.279 1.00 11.21 H new ATOM 172 N THR A 11 20.953 -9.567 10.502 1.00 2.22 N ATOM 173 CA THR A 11 21.968 -9.051 11.413 1.00 74.13 C ATOM 174 C THR A 11 22.553 -10.166 12.272 1.00 44.14 C ATOM 175 O THR A 11 22.288 -11.346 12.040 1.00 42.43 O ATOM 176 CB THR A 11 21.393 -7.958 12.333 1.00 51.41 C ATOM 177 OG1 THR A 11 20.126 -7.514 11.834 1.00 1.24 O ATOM 178 CG2 THR A 11 22.347 -6.777 12.431 1.00 11.32 C ATOM 0 H THR A 11 20.065 -9.797 10.947 1.00 2.22 H new ATOM 0 HA THR A 11 22.756 -8.619 10.796 1.00 74.13 H new ATOM 0 HB THR A 11 21.262 -8.383 13.328 1.00 51.41 H new ATOM 0 HG1 THR A 11 19.766 -6.820 12.426 1.00 1.24 H new ATOM 0 HG21 THR A 11 21.920 -6.018 13.086 1.00 11.32 H new ATOM 0 HG22 THR A 11 23.301 -7.113 12.838 1.00 11.32 H new ATOM 0 HG23 THR A 11 22.505 -6.354 11.439 1.00 11.32 H new ATOM 186 N ASP A 12 23.350 -9.785 13.264 1.00 61.20 N ATOM 187 CA ASP A 12 23.972 -10.753 14.159 1.00 24.54 C ATOM 188 C ASP A 12 22.916 -11.603 14.860 1.00 3.30 C ATOM 189 O ASP A 12 23.204 -12.702 15.332 1.00 0.25 O ATOM 190 CB ASP A 12 24.839 -10.038 15.196 1.00 2.44 C ATOM 191 CG ASP A 12 26.068 -10.840 15.577 1.00 42.22 C ATOM 192 OD1 ASP A 12 26.937 -11.043 14.704 1.00 42.15 O ATOM 193 OD2 ASP A 12 26.161 -11.265 16.748 1.00 75.25 O ATOM 0 H ASP A 12 23.580 -8.813 13.469 1.00 61.20 H new ATOM 0 HA ASP A 12 24.603 -11.410 13.560 1.00 24.54 H new ATOM 0 HB2 ASP A 12 25.149 -9.070 14.801 1.00 2.44 H new ATOM 0 HB3 ASP A 12 24.245 -9.843 16.089 1.00 2.44 H new ATOM 198 N GLU A 13 21.694 -11.084 14.924 1.00 71.14 N ATOM 199 CA GLU A 13 20.596 -11.795 15.569 1.00 40.24 C ATOM 200 C GLU A 13 20.163 -12.998 14.736 1.00 40.01 C ATOM 201 O GLU A 13 19.675 -13.992 15.271 1.00 35.34 O ATOM 202 CB GLU A 13 19.408 -10.855 15.784 1.00 75.33 C ATOM 203 CG GLU A 13 19.794 -9.510 16.373 1.00 5.54 C ATOM 204 CD GLU A 13 18.593 -8.706 16.831 1.00 32.04 C ATOM 205 OE1 GLU A 13 17.458 -9.071 16.457 1.00 44.21 O ATOM 206 OE2 GLU A 13 18.786 -7.713 17.563 1.00 22.13 O ATOM 0 H GLU A 13 21.439 -10.175 14.538 1.00 71.14 H new ATOM 0 HA GLU A 13 20.947 -12.153 16.537 1.00 40.24 H new ATOM 0 HB2 GLU A 13 18.906 -10.694 14.830 1.00 75.33 H new ATOM 0 HB3 GLU A 13 18.688 -11.338 16.445 1.00 75.33 H new ATOM 0 HG2 GLU A 13 20.465 -9.667 17.218 1.00 5.54 H new ATOM 0 HG3 GLU A 13 20.347 -8.937 15.629 1.00 5.54 H new ATOM 213 N GLU A 14 20.346 -12.898 13.423 1.00 71.31 N ATOM 214 CA GLU A 14 19.973 -13.978 12.516 1.00 12.32 C ATOM 215 C GLU A 14 21.200 -14.778 12.090 1.00 72.53 C ATOM 216 O GLU A 14 21.183 -16.010 12.091 1.00 11.55 O ATOM 217 CB GLU A 14 19.263 -13.415 11.283 1.00 63.22 C ATOM 218 CG GLU A 14 18.056 -12.555 11.615 1.00 52.33 C ATOM 219 CD GLU A 14 16.748 -13.311 11.486 1.00 14.41 C ATOM 220 OE1 GLU A 14 16.558 -14.297 12.228 1.00 32.03 O ATOM 221 OE2 GLU A 14 15.914 -12.916 10.644 1.00 63.50 O ATOM 0 H GLU A 14 20.750 -12.081 12.964 1.00 71.31 H new ATOM 0 HA GLU A 14 19.292 -14.645 13.045 1.00 12.32 H new ATOM 0 HB2 GLU A 14 19.972 -12.823 10.705 1.00 63.22 H new ATOM 0 HB3 GLU A 14 18.946 -14.242 10.648 1.00 63.22 H new ATOM 0 HG2 GLU A 14 18.153 -12.176 12.632 1.00 52.33 H new ATOM 0 HG3 GLU A 14 18.038 -11.689 10.953 1.00 52.33 H new ATOM 228 N PHE A 15 22.263 -14.070 11.724 1.00 63.40 N ATOM 229 CA PHE A 15 23.499 -14.714 11.293 1.00 31.02 C ATOM 230 C PHE A 15 24.004 -15.687 12.355 1.00 42.24 C ATOM 231 O PHE A 15 24.566 -16.735 12.036 1.00 32.10 O ATOM 232 CB PHE A 15 24.570 -13.662 10.998 1.00 64.54 C ATOM 233 CG PHE A 15 25.964 -14.220 10.963 1.00 64.55 C ATOM 234 CD1 PHE A 15 26.722 -14.300 12.120 1.00 61.31 C ATOM 235 CD2 PHE A 15 26.517 -14.666 9.773 1.00 50.35 C ATOM 236 CE1 PHE A 15 28.005 -14.813 12.090 1.00 3.42 C ATOM 237 CE2 PHE A 15 27.800 -15.179 9.737 1.00 73.53 C ATOM 238 CZ PHE A 15 28.544 -15.254 10.897 1.00 4.14 C ATOM 0 H PHE A 15 22.294 -13.050 11.717 1.00 63.40 H new ATOM 0 HA PHE A 15 23.290 -15.275 10.382 1.00 31.02 H new ATOM 0 HB2 PHE A 15 24.351 -13.191 10.040 1.00 64.54 H new ATOM 0 HB3 PHE A 15 24.519 -12.880 11.756 1.00 64.54 H new ATOM 0 HD1 PHE A 15 26.306 -13.958 13.056 1.00 61.31 H new ATOM 0 HD2 PHE A 15 25.938 -14.612 8.863 1.00 50.35 H new ATOM 0 HE1 PHE A 15 28.586 -14.869 12.999 1.00 3.42 H new ATOM 0 HE2 PHE A 15 28.220 -15.521 8.802 1.00 73.53 H new ATOM 0 HZ PHE A 15 29.546 -15.657 10.872 1.00 4.14 H new ATOM 248 N LYS A 16 23.801 -15.332 13.619 1.00 51.43 N ATOM 249 CA LYS A 16 24.234 -16.171 14.729 1.00 22.41 C ATOM 250 C LYS A 16 23.373 -17.426 14.831 1.00 72.24 C ATOM 251 O LYS A 16 23.735 -18.388 15.509 1.00 64.13 O ATOM 252 CB LYS A 16 24.170 -15.389 16.043 1.00 45.34 C ATOM 253 CG LYS A 16 22.764 -15.243 16.596 1.00 14.40 C ATOM 254 CD LYS A 16 22.513 -16.205 17.745 1.00 65.43 C ATOM 255 CE LYS A 16 23.177 -15.727 19.027 1.00 30.31 C ATOM 256 NZ LYS A 16 22.256 -14.896 19.851 1.00 24.14 N ATOM 0 H LYS A 16 23.339 -14.467 13.900 1.00 51.43 H new ATOM 0 HA LYS A 16 25.265 -16.472 14.542 1.00 22.41 H new ATOM 0 HB2 LYS A 16 24.793 -15.889 16.784 1.00 45.34 H new ATOM 0 HB3 LYS A 16 24.595 -14.397 15.887 1.00 45.34 H new ATOM 0 HG2 LYS A 16 22.611 -14.219 16.938 1.00 14.40 H new ATOM 0 HG3 LYS A 16 22.039 -15.426 15.803 1.00 14.40 H new ATOM 0 HD2 LYS A 16 21.440 -16.309 17.906 1.00 65.43 H new ATOM 0 HD3 LYS A 16 22.893 -17.193 17.484 1.00 65.43 H new ATOM 0 HE2 LYS A 16 23.507 -16.588 19.608 1.00 30.31 H new ATOM 0 HE3 LYS A 16 24.067 -15.148 18.781 1.00 30.31 H new ATOM 0 HZ1 LYS A 16 22.745 -14.589 20.716 1.00 24.14 H new ATOM 0 HZ2 LYS A 16 21.960 -14.061 19.306 1.00 24.14 H new ATOM 0 HZ3 LYS A 16 21.418 -15.456 20.107 1.00 24.14 H new ATOM 270 N THR A 17 22.230 -17.411 14.151 1.00 43.01 N ATOM 271 CA THR A 17 21.318 -18.547 14.164 1.00 32.23 C ATOM 272 C THR A 17 21.816 -19.663 13.254 1.00 61.44 C ATOM 273 O THR A 17 21.258 -20.761 13.239 1.00 21.01 O ATOM 274 CB THR A 17 19.901 -18.135 13.724 1.00 54.13 C ATOM 275 OG1 THR A 17 18.923 -18.865 14.473 1.00 12.32 O ATOM 276 CG2 THR A 17 19.701 -18.389 12.237 1.00 13.32 C ATOM 0 H THR A 17 21.915 -16.624 13.584 1.00 43.01 H new ATOM 0 HA THR A 17 21.280 -18.910 15.191 1.00 32.23 H new ATOM 0 HB THR A 17 19.782 -17.068 13.914 1.00 54.13 H new ATOM 0 HG1 THR A 17 18.025 -18.596 14.188 1.00 12.32 H new ATOM 0 HG21 THR A 17 18.693 -18.090 11.949 1.00 13.32 H new ATOM 0 HG22 THR A 17 20.428 -17.809 11.668 1.00 13.32 H new ATOM 0 HG23 THR A 17 19.839 -19.450 12.027 1.00 13.32 H new ATOM 284 N ILE A 18 22.869 -19.377 12.496 1.00 41.53 N ATOM 285 CA ILE A 18 23.443 -20.358 11.583 1.00 2.24 C ATOM 286 C ILE A 18 24.767 -20.896 12.117 1.00 53.35 C ATOM 287 O ILE A 18 25.698 -20.145 12.407 1.00 23.25 O ATOM 288 CB ILE A 18 23.672 -19.758 10.183 1.00 22.43 C ATOM 289 CG1 ILE A 18 22.349 -19.268 9.592 1.00 71.43 C ATOM 290 CG2 ILE A 18 24.320 -20.786 9.267 1.00 2.40 C ATOM 291 CD1 ILE A 18 22.289 -17.769 9.405 1.00 44.45 C ATOM 0 H ILE A 18 23.342 -18.473 12.496 1.00 41.53 H new ATOM 0 HA ILE A 18 22.726 -21.175 11.505 1.00 2.24 H new ATOM 0 HB ILE A 18 24.345 -18.905 10.274 1.00 22.43 H new ATOM 0 HG12 ILE A 18 22.189 -19.753 8.629 1.00 71.43 H new ATOM 0 HG13 ILE A 18 21.532 -19.578 10.244 1.00 71.43 H new ATOM 0 HG21 ILE A 18 24.476 -20.348 8.281 1.00 2.40 H new ATOM 0 HG22 ILE A 18 25.280 -21.091 9.684 1.00 2.40 H new ATOM 0 HG23 ILE A 18 23.669 -21.656 9.179 1.00 2.40 H new ATOM 0 HD11 ILE A 18 21.323 -17.493 8.982 1.00 44.45 H new ATOM 0 HD12 ILE A 18 22.417 -17.277 10.369 1.00 44.45 H new ATOM 0 HD13 ILE A 18 23.084 -17.455 8.729 1.00 44.45 H new ATOM 303 N PRO A 19 24.854 -22.228 12.247 1.00 45.22 N ATOM 304 CA PRO A 19 26.061 -22.897 12.743 1.00 13.22 C ATOM 305 C PRO A 19 27.216 -22.819 11.751 1.00 23.43 C ATOM 306 O PRO A 19 27.006 -22.782 10.539 1.00 41.42 O ATOM 307 CB PRO A 19 25.611 -24.348 12.928 1.00 73.32 C ATOM 308 CG PRO A 19 24.476 -24.517 11.977 1.00 11.25 C ATOM 309 CD PRO A 19 23.783 -23.183 11.919 1.00 21.41 C ATOM 0 HA PRO A 19 26.439 -22.434 13.655 1.00 13.22 H new ATOM 0 HB2 PRO A 19 26.420 -25.045 12.707 1.00 73.32 H new ATOM 0 HB3 PRO A 19 25.299 -24.538 13.955 1.00 73.32 H new ATOM 0 HG2 PRO A 19 24.834 -24.814 10.991 1.00 11.25 H new ATOM 0 HG3 PRO A 19 23.794 -25.297 12.317 1.00 11.25 H new ATOM 0 HD2 PRO A 19 23.362 -22.991 10.932 1.00 21.41 H new ATOM 0 HD3 PRO A 19 22.961 -23.126 12.633 1.00 21.41 H new ATOM 317 N LYS A 20 28.438 -22.797 12.274 1.00 53.52 N ATOM 318 CA LYS A 20 29.628 -22.725 11.435 1.00 61.53 C ATOM 319 C LYS A 20 29.640 -23.855 10.410 1.00 75.03 C ATOM 320 O LYS A 20 30.236 -23.730 9.340 1.00 5.32 O ATOM 321 CB LYS A 20 30.890 -22.793 12.298 1.00 42.23 C ATOM 322 CG LYS A 20 30.953 -24.022 13.188 1.00 44.21 C ATOM 323 CD LYS A 20 31.999 -23.866 14.280 1.00 72.33 C ATOM 324 CE LYS A 20 31.429 -23.161 15.501 1.00 52.02 C ATOM 325 NZ LYS A 20 30.441 -24.011 16.221 1.00 15.41 N ATOM 0 H LYS A 20 28.630 -22.828 13.275 1.00 53.52 H new ATOM 0 HA LYS A 20 29.610 -21.774 10.902 1.00 61.53 H new ATOM 0 HB2 LYS A 20 31.765 -22.780 11.648 1.00 42.23 H new ATOM 0 HB3 LYS A 20 30.942 -21.900 12.921 1.00 42.23 H new ATOM 0 HG2 LYS A 20 29.977 -24.195 13.640 1.00 44.21 H new ATOM 0 HG3 LYS A 20 31.185 -24.899 12.583 1.00 44.21 H new ATOM 0 HD2 LYS A 20 32.375 -24.848 14.568 1.00 72.33 H new ATOM 0 HD3 LYS A 20 32.847 -23.300 13.895 1.00 72.33 H new ATOM 0 HE2 LYS A 20 32.240 -22.894 16.178 1.00 52.02 H new ATOM 0 HE3 LYS A 20 30.952 -22.231 15.193 1.00 52.02 H new ATOM 0 HZ1 LYS A 20 30.343 -23.676 17.201 1.00 15.41 H new ATOM 0 HZ2 LYS A 20 29.520 -23.954 15.742 1.00 15.41 H new ATOM 0 HZ3 LYS A 20 30.769 -24.998 16.224 1.00 15.41 H new ATOM 339 N TYR A 21 28.975 -24.956 10.742 1.00 25.35 N ATOM 340 CA TYR A 21 28.910 -26.108 9.851 1.00 22.20 C ATOM 341 C TYR A 21 28.203 -25.749 8.548 1.00 74.31 C ATOM 342 O TYR A 21 28.356 -26.435 7.537 1.00 14.15 O ATOM 343 CB TYR A 21 28.185 -27.269 10.535 1.00 4.51 C ATOM 344 CG TYR A 21 28.672 -27.542 11.941 1.00 55.25 C ATOM 345 CD1 TYR A 21 29.988 -27.914 12.182 1.00 43.35 C ATOM 346 CD2 TYR A 21 27.814 -27.427 13.028 1.00 72.03 C ATOM 347 CE1 TYR A 21 30.436 -28.165 13.464 1.00 62.11 C ATOM 348 CE2 TYR A 21 28.253 -27.675 14.314 1.00 45.03 C ATOM 349 CZ TYR A 21 29.565 -28.044 14.527 1.00 63.24 C ATOM 350 OH TYR A 21 30.008 -28.292 15.806 1.00 60.34 O ATOM 0 H TYR A 21 28.473 -25.075 11.622 1.00 25.35 H new ATOM 0 HA TYR A 21 29.930 -26.413 9.618 1.00 22.20 H new ATOM 0 HB2 TYR A 21 27.117 -27.053 10.565 1.00 4.51 H new ATOM 0 HB3 TYR A 21 28.311 -28.170 9.934 1.00 4.51 H new ATOM 0 HD1 TYR A 21 30.673 -28.009 11.352 1.00 43.35 H new ATOM 0 HD2 TYR A 21 26.786 -27.139 12.865 1.00 72.03 H new ATOM 0 HE1 TYR A 21 31.463 -28.454 13.633 1.00 62.11 H new ATOM 0 HE2 TYR A 21 27.573 -27.581 15.148 1.00 45.03 H new ATOM 0 HH TYR A 21 29.271 -28.161 16.439 1.00 60.34 H new ATOM 360 N GLN A 22 27.428 -24.669 8.581 1.00 65.43 N ATOM 361 CA GLN A 22 26.697 -24.219 7.403 1.00 51.43 C ATOM 362 C GLN A 22 27.353 -22.984 6.794 1.00 64.14 C ATOM 363 O GLN A 22 27.366 -22.813 5.574 1.00 45.12 O ATOM 364 CB GLN A 22 25.243 -23.911 7.766 1.00 2.10 C ATOM 365 CG GLN A 22 24.527 -25.069 8.442 1.00 11.21 C ATOM 366 CD GLN A 22 23.918 -26.039 7.448 1.00 4.35 C ATOM 367 OE1 GLN A 22 24.604 -26.548 6.561 1.00 33.13 O ATOM 368 NE2 GLN A 22 22.624 -26.300 7.592 1.00 3.32 N ATOM 0 H GLN A 22 27.291 -24.091 9.410 1.00 65.43 H new ATOM 0 HA GLN A 22 26.718 -25.021 6.665 1.00 51.43 H new ATOM 0 HB2 GLN A 22 25.218 -23.044 8.426 1.00 2.10 H new ATOM 0 HB3 GLN A 22 24.701 -23.638 6.861 1.00 2.10 H new ATOM 0 HG2 GLN A 22 25.231 -25.603 9.081 1.00 11.21 H new ATOM 0 HG3 GLN A 22 23.742 -24.678 9.090 1.00 11.21 H new ATOM 0 HE21 GLN A 22 22.094 -25.855 8.342 1.00 3.32 H new ATOM 0 HE22 GLN A 22 22.160 -26.945 6.953 1.00 3.32 H new ATOM 377 N LEU A 23 27.897 -22.126 7.650 1.00 60.13 N ATOM 378 CA LEU A 23 28.556 -20.906 7.196 1.00 73.10 C ATOM 379 C LEU A 23 29.738 -21.231 6.289 1.00 3.30 C ATOM 380 O LEU A 23 29.777 -20.818 5.131 1.00 42.32 O ATOM 381 CB LEU A 23 29.029 -20.082 8.395 1.00 72.40 C ATOM 382 CG LEU A 23 27.941 -19.626 9.367 1.00 35.24 C ATOM 383 CD1 LEU A 23 28.538 -18.771 10.474 1.00 31.32 C ATOM 384 CD2 LEU A 23 26.852 -18.861 8.629 1.00 72.41 C ATOM 0 H LEU A 23 27.895 -22.252 8.662 1.00 60.13 H new ATOM 0 HA LEU A 23 27.834 -20.323 6.625 1.00 73.10 H new ATOM 0 HB2 LEU A 23 29.760 -20.671 8.949 1.00 72.40 H new ATOM 0 HB3 LEU A 23 29.548 -19.199 8.022 1.00 72.40 H new ATOM 0 HG LEU A 23 27.493 -20.510 9.820 1.00 35.24 H new ATOM 0 HD11 LEU A 23 27.748 -18.456 11.156 1.00 31.32 H new ATOM 0 HD12 LEU A 23 29.280 -19.351 11.022 1.00 31.32 H new ATOM 0 HD13 LEU A 23 29.014 -17.892 10.039 1.00 31.32 H new ATOM 0 HD21 LEU A 23 26.086 -18.544 9.337 1.00 72.41 H new ATOM 0 HD22 LEU A 23 27.286 -17.985 8.147 1.00 72.41 H new ATOM 0 HD23 LEU A 23 26.403 -19.505 7.873 1.00 72.41 H new ATOM 396 N GLY A 24 30.701 -21.976 6.824 1.00 1.40 N ATOM 397 CA GLY A 24 31.871 -22.345 6.048 1.00 33.15 C ATOM 398 C GLY A 24 32.688 -21.142 5.623 1.00 3.43 C ATOM 399 O GLY A 24 32.697 -20.772 4.449 1.00 14.11 O ATOM 0 H GLY A 24 30.692 -22.330 7.780 1.00 1.40 H new ATOM 0 HA2 GLY A 24 32.497 -23.016 6.637 1.00 33.15 H new ATOM 0 HA3 GLY A 24 31.556 -22.898 5.163 1.00 33.15 H new ATOM 403 N ARG A 25 33.376 -20.528 6.580 1.00 4.43 N ATOM 404 CA ARG A 25 34.198 -19.357 6.299 1.00 5.12 C ATOM 405 C ARG A 25 33.331 -18.166 5.904 1.00 52.41 C ATOM 406 O ARG A 25 33.835 -17.148 5.427 1.00 12.31 O ATOM 407 CB ARG A 25 35.199 -19.666 5.184 1.00 54.45 C ATOM 408 CG ARG A 25 35.875 -21.019 5.330 1.00 44.45 C ATOM 409 CD ARG A 25 36.678 -21.104 6.619 1.00 73.04 C ATOM 410 NE ARG A 25 37.686 -22.159 6.567 1.00 71.31 N ATOM 411 CZ ARG A 25 37.402 -23.453 6.671 1.00 51.22 C ATOM 412 NH1 ARG A 25 36.147 -23.849 6.831 1.00 54.54 N ATOM 413 NH2 ARG A 25 38.375 -24.353 6.614 1.00 33.52 N ATOM 0 H ARG A 25 33.381 -20.822 7.557 1.00 4.43 H new ATOM 0 HA ARG A 25 34.744 -19.101 7.207 1.00 5.12 H new ATOM 0 HB2 ARG A 25 34.684 -19.629 4.224 1.00 54.45 H new ATOM 0 HB3 ARG A 25 35.962 -18.888 5.167 1.00 54.45 H new ATOM 0 HG2 ARG A 25 35.122 -21.807 5.317 1.00 44.45 H new ATOM 0 HG3 ARG A 25 36.533 -21.192 4.478 1.00 44.45 H new ATOM 0 HD2 ARG A 25 37.164 -20.147 6.807 1.00 73.04 H new ATOM 0 HD3 ARG A 25 36.003 -21.288 7.455 1.00 73.04 H new ATOM 0 HE ARG A 25 38.662 -21.888 6.444 1.00 71.31 H new ATOM 0 HH11 ARG A 25 35.396 -23.160 6.875 1.00 54.54 H new ATOM 0 HH12 ARG A 25 35.932 -24.843 6.911 1.00 54.54 H new ATOM 0 HH21 ARG A 25 39.342 -24.052 6.490 1.00 33.52 H new ATOM 0 HH22 ARG A 25 38.156 -25.346 6.694 1.00 33.52 H new ATOM 427 N LEU A 26 32.025 -18.299 6.104 1.00 35.44 N ATOM 428 CA LEU A 26 31.086 -17.234 5.769 1.00 72.43 C ATOM 429 C LEU A 26 31.090 -16.147 6.839 1.00 62.33 C ATOM 430 O LEU A 26 31.623 -16.339 7.932 1.00 13.05 O ATOM 431 CB LEU A 26 29.675 -17.803 5.609 1.00 73.00 C ATOM 432 CG LEU A 26 29.195 -18.014 4.173 1.00 73.14 C ATOM 433 CD1 LEU A 26 27.938 -18.870 4.150 1.00 12.12 C ATOM 434 CD2 LEU A 26 28.944 -16.676 3.492 1.00 34.32 C ATOM 0 H LEU A 26 31.591 -19.135 6.497 1.00 35.44 H new ATOM 0 HA LEU A 26 31.401 -16.789 4.825 1.00 72.43 H new ATOM 0 HB2 LEU A 26 29.629 -18.759 6.130 1.00 73.00 H new ATOM 0 HB3 LEU A 26 28.976 -17.133 6.110 1.00 73.00 H new ATOM 0 HG LEU A 26 29.977 -18.538 3.623 1.00 73.14 H new ATOM 0 HD11 LEU A 26 27.611 -19.009 3.119 1.00 12.12 H new ATOM 0 HD12 LEU A 26 28.151 -19.841 4.598 1.00 12.12 H new ATOM 0 HD13 LEU A 26 27.150 -18.374 4.717 1.00 12.12 H new ATOM 0 HD21 LEU A 26 28.603 -16.846 2.471 1.00 34.32 H new ATOM 0 HD22 LEU A 26 28.181 -16.125 4.042 1.00 34.32 H new ATOM 0 HD23 LEU A 26 29.868 -16.098 3.475 1.00 34.32 H new ATOM 446 N THR A 27 30.491 -15.005 6.517 1.00 40.10 N ATOM 447 CA THR A 27 30.425 -13.887 7.450 1.00 33.52 C ATOM 448 C THR A 27 29.142 -13.086 7.258 1.00 21.44 C ATOM 449 O THR A 27 28.514 -13.145 6.201 1.00 52.44 O ATOM 450 CB THR A 27 31.633 -12.947 7.287 1.00 44.42 C ATOM 451 OG1 THR A 27 32.101 -12.980 5.934 1.00 71.03 O ATOM 452 CG2 THR A 27 32.760 -13.345 8.228 1.00 42.10 C ATOM 0 H THR A 27 30.044 -14.830 5.617 1.00 40.10 H new ATOM 0 HA THR A 27 30.438 -14.312 8.454 1.00 33.52 H new ATOM 0 HB THR A 27 31.313 -11.935 7.536 1.00 44.42 H new ATOM 0 HG1 THR A 27 31.530 -12.412 5.376 1.00 71.03 H new ATOM 0 HG21 THR A 27 33.602 -12.666 8.094 1.00 42.10 H new ATOM 0 HG22 THR A 27 32.410 -13.290 9.259 1.00 42.10 H new ATOM 0 HG23 THR A 27 33.077 -14.364 8.006 1.00 42.10 H new ATOM 460 N LEU A 28 28.758 -12.338 8.287 1.00 62.22 N ATOM 461 CA LEU A 28 27.549 -11.523 8.231 1.00 24.51 C ATOM 462 C LEU A 28 27.556 -10.623 7.000 1.00 11.11 C ATOM 463 O LEU A 28 26.534 -10.457 6.336 1.00 75.44 O ATOM 464 CB LEU A 28 27.424 -10.675 9.497 1.00 0.45 C ATOM 465 CG LEU A 28 26.062 -10.702 10.192 1.00 70.02 C ATOM 466 CD1 LEU A 28 26.234 -10.777 11.701 1.00 14.11 C ATOM 467 CD2 LEU A 28 25.242 -9.479 9.806 1.00 21.35 C ATOM 0 H LEU A 28 29.266 -12.279 9.170 1.00 62.22 H new ATOM 0 HA LEU A 28 26.691 -12.192 8.163 1.00 24.51 H new ATOM 0 HB2 LEU A 28 28.179 -11.008 10.209 1.00 0.45 H new ATOM 0 HB3 LEU A 28 27.659 -9.642 9.243 1.00 0.45 H new ATOM 0 HG LEU A 28 25.526 -11.592 9.864 1.00 70.02 H new ATOM 0 HD11 LEU A 28 25.254 -10.795 12.178 1.00 14.11 H new ATOM 0 HD12 LEU A 28 26.781 -11.683 11.960 1.00 14.11 H new ATOM 0 HD13 LEU A 28 26.790 -9.906 12.048 1.00 14.11 H new ATOM 0 HD21 LEU A 28 24.276 -9.515 10.310 1.00 21.35 H new ATOM 0 HD22 LEU A 28 25.774 -8.575 10.105 1.00 21.35 H new ATOM 0 HD23 LEU A 28 25.088 -9.470 8.727 1.00 21.35 H new ATOM 479 N GLU A 29 28.715 -10.045 6.702 1.00 65.33 N ATOM 480 CA GLU A 29 28.854 -9.163 5.549 1.00 3.22 C ATOM 481 C GLU A 29 28.530 -9.903 4.255 1.00 70.11 C ATOM 482 O GLU A 29 27.922 -9.343 3.343 1.00 65.11 O ATOM 483 CB GLU A 29 30.273 -8.594 5.482 1.00 2.05 C ATOM 484 CG GLU A 29 30.527 -7.734 4.256 1.00 40.20 C ATOM 485 CD GLU A 29 30.836 -6.292 4.609 1.00 51.34 C ATOM 486 OE1 GLU A 29 31.944 -6.030 5.121 1.00 12.24 O ATOM 487 OE2 GLU A 29 29.969 -5.425 4.371 1.00 13.21 O ATOM 0 H GLU A 29 29.571 -10.171 7.242 1.00 65.33 H new ATOM 0 HA GLU A 29 28.146 -8.342 5.665 1.00 3.22 H new ATOM 0 HB2 GLU A 29 30.460 -8.000 6.377 1.00 2.05 H new ATOM 0 HB3 GLU A 29 30.987 -9.418 5.491 1.00 2.05 H new ATOM 0 HG2 GLU A 29 31.359 -8.152 3.690 1.00 40.20 H new ATOM 0 HG3 GLU A 29 29.652 -7.766 3.607 1.00 40.20 H new ATOM 494 N MET A 30 28.941 -11.165 4.183 1.00 34.11 N ATOM 495 CA MET A 30 28.693 -11.983 3.001 1.00 3.31 C ATOM 496 C MET A 30 27.197 -12.186 2.784 1.00 23.10 C ATOM 497 O MET A 30 26.690 -12.000 1.678 1.00 4.12 O ATOM 498 CB MET A 30 29.390 -13.338 3.138 1.00 73.05 C ATOM 499 CG MET A 30 30.743 -13.398 2.447 1.00 34.41 C ATOM 500 SD MET A 30 31.854 -12.082 2.980 1.00 33.11 S ATOM 501 CE MET A 30 33.425 -12.942 2.974 1.00 51.13 C ATOM 0 H MET A 30 29.447 -11.643 4.929 1.00 34.11 H new ATOM 0 HA MET A 30 29.099 -11.460 2.135 1.00 3.31 H new ATOM 0 HB2 MET A 30 29.521 -13.565 4.196 1.00 73.05 H new ATOM 0 HB3 MET A 30 28.745 -14.113 2.724 1.00 73.05 H new ATOM 0 HG2 MET A 30 31.207 -14.364 2.648 1.00 34.41 H new ATOM 0 HG3 MET A 30 30.599 -13.332 1.369 1.00 34.41 H new ATOM 0 HE1 MET A 30 34.215 -12.258 3.283 1.00 51.13 H new ATOM 0 HE2 MET A 30 33.382 -13.783 3.666 1.00 51.13 H new ATOM 0 HE3 MET A 30 33.635 -13.309 1.969 1.00 51.13 H new ATOM 511 N MET A 31 26.496 -12.570 3.846 1.00 5.52 N ATOM 512 CA MET A 31 25.058 -12.797 3.771 1.00 70.24 C ATOM 513 C MET A 31 24.301 -11.475 3.700 1.00 43.42 C ATOM 514 O MET A 31 23.250 -11.384 3.068 1.00 53.21 O ATOM 515 CB MET A 31 24.584 -13.605 4.980 1.00 73.51 C ATOM 516 CG MET A 31 25.344 -14.907 5.177 1.00 1.10 C ATOM 517 SD MET A 31 24.796 -15.818 6.633 1.00 11.34 S ATOM 518 CE MET A 31 23.237 -16.480 6.052 1.00 54.33 C ATOM 0 H MET A 31 26.901 -12.730 4.768 1.00 5.52 H new ATOM 0 HA MET A 31 24.852 -13.362 2.862 1.00 70.24 H new ATOM 0 HB2 MET A 31 24.687 -12.995 5.877 1.00 73.51 H new ATOM 0 HB3 MET A 31 23.523 -13.827 4.865 1.00 73.51 H new ATOM 0 HG2 MET A 31 25.219 -15.533 4.293 1.00 1.10 H new ATOM 0 HG3 MET A 31 26.409 -14.692 5.268 1.00 1.10 H new ATOM 0 HE1 MET A 31 22.835 -17.169 6.795 1.00 54.33 H new ATOM 0 HE2 MET A 31 22.532 -15.664 5.894 1.00 54.33 H new ATOM 0 HE3 MET A 31 23.394 -17.010 5.113 1.00 54.33 H new ATOM 528 N ASN A 32 24.844 -10.452 4.353 1.00 54.11 N ATOM 529 CA ASN A 32 24.218 -9.134 4.364 1.00 24.42 C ATOM 530 C ASN A 32 24.058 -8.596 2.946 1.00 74.33 C ATOM 531 O ASN A 32 22.999 -8.084 2.582 1.00 5.15 O ATOM 532 CB ASN A 32 25.050 -8.159 5.200 1.00 20.52 C ATOM 533 CG ASN A 32 24.602 -6.721 5.027 1.00 35.23 C ATOM 534 OD1 ASN A 32 23.778 -6.220 5.793 1.00 52.14 O ATOM 535 ND2 ASN A 32 25.143 -6.050 4.017 1.00 21.14 N ATOM 0 H ASN A 32 25.715 -10.510 4.881 1.00 54.11 H new ATOM 0 HA ASN A 32 23.228 -9.233 4.810 1.00 24.42 H new ATOM 0 HB2 ASN A 32 24.979 -8.435 6.252 1.00 20.52 H new ATOM 0 HB3 ASN A 32 26.099 -8.246 4.918 1.00 20.52 H new ATOM 0 HD21 ASN A 32 24.880 -5.079 3.851 1.00 21.14 H new ATOM 0 HD22 ASN A 32 25.822 -6.506 3.407 1.00 21.14 H new ATOM 542 N GLU A 33 25.115 -8.718 2.149 1.00 10.41 N ATOM 543 CA GLU A 33 25.090 -8.243 0.771 1.00 64.05 C ATOM 544 C GLU A 33 24.344 -9.224 -0.129 1.00 53.42 C ATOM 545 O GLU A 33 23.768 -8.835 -1.146 1.00 0.52 O ATOM 546 CB GLU A 33 26.516 -8.042 0.252 1.00 54.54 C ATOM 547 CG GLU A 33 27.374 -9.293 0.328 1.00 32.11 C ATOM 548 CD GLU A 33 28.858 -8.985 0.300 1.00 23.11 C ATOM 549 OE1 GLU A 33 29.339 -8.480 -0.736 1.00 3.11 O ATOM 550 OE2 GLU A 33 29.539 -9.249 1.313 1.00 31.21 O ATOM 0 H GLU A 33 25.998 -9.141 2.434 1.00 10.41 H new ATOM 0 HA GLU A 33 24.565 -7.288 0.752 1.00 64.05 H new ATOM 0 HB2 GLU A 33 26.472 -7.704 -0.783 1.00 54.54 H new ATOM 0 HB3 GLU A 33 26.994 -7.248 0.826 1.00 54.54 H new ATOM 0 HG2 GLU A 33 27.137 -9.837 1.242 1.00 32.11 H new ATOM 0 HG3 GLU A 33 27.127 -9.950 -0.506 1.00 32.11 H new ATOM 557 N ILE A 34 24.359 -10.496 0.252 1.00 34.32 N ATOM 558 CA ILE A 34 23.683 -11.532 -0.519 1.00 60.41 C ATOM 559 C ILE A 34 22.168 -11.414 -0.390 1.00 42.12 C ATOM 560 O ILE A 34 21.440 -11.519 -1.377 1.00 61.14 O ATOM 561 CB ILE A 34 24.116 -12.941 -0.071 1.00 5.30 C ATOM 562 CG1 ILE A 34 25.508 -13.267 -0.616 1.00 25.12 C ATOM 563 CG2 ILE A 34 23.104 -13.978 -0.533 1.00 23.33 C ATOM 564 CD1 ILE A 34 26.220 -14.355 0.158 1.00 44.32 C ATOM 0 H ILE A 34 24.832 -10.835 1.090 1.00 34.32 H new ATOM 0 HA ILE A 34 23.969 -11.386 -1.561 1.00 60.41 H new ATOM 0 HB ILE A 34 24.158 -12.964 1.018 1.00 5.30 H new ATOM 0 HG12 ILE A 34 25.419 -13.573 -1.658 1.00 25.12 H new ATOM 0 HG13 ILE A 34 26.117 -12.363 -0.600 1.00 25.12 H new ATOM 0 HG21 ILE A 34 23.424 -14.968 -0.209 1.00 23.33 H new ATOM 0 HG22 ILE A 34 22.129 -13.752 -0.101 1.00 23.33 H new ATOM 0 HG23 ILE A 34 23.033 -13.958 -1.620 1.00 23.33 H new ATOM 0 HD11 ILE A 34 27.200 -14.534 -0.284 1.00 44.32 H new ATOM 0 HD12 ILE A 34 26.341 -14.044 1.196 1.00 44.32 H new ATOM 0 HD13 ILE A 34 25.632 -15.272 0.121 1.00 44.32 H new ATOM 576 N VAL A 35 21.699 -11.192 0.834 1.00 63.32 N ATOM 577 CA VAL A 35 20.271 -11.056 1.092 1.00 31.12 C ATOM 578 C VAL A 35 19.749 -9.711 0.601 1.00 43.44 C ATOM 579 O VAL A 35 18.619 -9.608 0.123 1.00 25.11 O ATOM 580 CB VAL A 35 19.956 -11.199 2.593 1.00 30.11 C ATOM 581 CG1 VAL A 35 18.455 -11.306 2.816 1.00 22.32 C ATOM 582 CG2 VAL A 35 20.677 -12.405 3.176 1.00 44.11 C ATOM 0 H VAL A 35 22.288 -11.103 1.662 1.00 63.32 H new ATOM 0 HA VAL A 35 19.773 -11.857 0.545 1.00 31.12 H new ATOM 0 HB VAL A 35 20.313 -10.307 3.108 1.00 30.11 H new ATOM 0 HG11 VAL A 35 18.252 -11.406 3.882 1.00 22.32 H new ATOM 0 HG12 VAL A 35 17.966 -10.409 2.436 1.00 22.32 H new ATOM 0 HG13 VAL A 35 18.070 -12.179 2.290 1.00 22.32 H new ATOM 0 HG21 VAL A 35 20.443 -12.491 4.237 1.00 44.11 H new ATOM 0 HG22 VAL A 35 20.353 -13.308 2.659 1.00 44.11 H new ATOM 0 HG23 VAL A 35 21.753 -12.282 3.050 1.00 44.11 H new ATOM 592 N SER A 36 20.581 -8.680 0.721 1.00 75.35 N ATOM 593 CA SER A 36 20.202 -7.339 0.291 1.00 3.02 C ATOM 594 C SER A 36 20.144 -7.252 -1.231 1.00 11.02 C ATOM 595 O SER A 36 19.289 -6.568 -1.793 1.00 75.14 O ATOM 596 CB SER A 36 21.194 -6.308 0.835 1.00 74.23 C ATOM 597 OG SER A 36 22.257 -6.093 -0.077 1.00 30.31 O ATOM 0 H SER A 36 21.521 -8.748 1.112 1.00 75.35 H new ATOM 0 HA SER A 36 19.210 -7.123 0.687 1.00 3.02 H new ATOM 0 HB2 SER A 36 20.678 -5.367 1.025 1.00 74.23 H new ATOM 0 HB3 SER A 36 21.593 -6.651 1.789 1.00 74.23 H new ATOM 0 HG SER A 36 22.876 -5.429 0.293 1.00 30.31 H new ATOM 603 N LYS A 37 21.060 -7.950 -1.893 1.00 24.35 N ATOM 604 CA LYS A 37 21.115 -7.955 -3.350 1.00 11.24 C ATOM 605 C LYS A 37 19.997 -8.812 -3.933 1.00 75.42 C ATOM 606 O LYS A 37 19.268 -8.377 -4.824 1.00 45.54 O ATOM 607 CB LYS A 37 22.473 -8.474 -3.828 1.00 53.01 C ATOM 608 CG LYS A 37 22.766 -8.158 -5.284 1.00 51.44 C ATOM 609 CD LYS A 37 22.943 -6.665 -5.506 1.00 4.10 C ATOM 610 CE LYS A 37 24.372 -6.226 -5.226 1.00 5.22 C ATOM 611 NZ LYS A 37 24.580 -5.896 -3.788 1.00 73.15 N ATOM 0 H LYS A 37 21.776 -8.521 -1.443 1.00 24.35 H new ATOM 0 HA LYS A 37 20.982 -6.930 -3.698 1.00 11.24 H new ATOM 0 HB2 LYS A 37 23.257 -8.042 -3.206 1.00 53.01 H new ATOM 0 HB3 LYS A 37 22.511 -9.554 -3.684 1.00 53.01 H new ATOM 0 HG2 LYS A 37 23.669 -8.683 -5.597 1.00 51.44 H new ATOM 0 HG3 LYS A 37 21.951 -8.526 -5.908 1.00 51.44 H new ATOM 0 HD2 LYS A 37 22.679 -6.415 -6.534 1.00 4.10 H new ATOM 0 HD3 LYS A 37 22.259 -6.116 -4.859 1.00 4.10 H new ATOM 0 HE2 LYS A 37 25.060 -7.019 -5.520 1.00 5.22 H new ATOM 0 HE3 LYS A 37 24.611 -5.355 -5.837 1.00 5.22 H new ATOM 0 HZ1 LYS A 37 25.199 -5.064 -3.709 1.00 73.15 H new ATOM 0 HZ2 LYS A 37 23.663 -5.689 -3.343 1.00 73.15 H new ATOM 0 HZ3 LYS A 37 25.023 -6.704 -3.307 1.00 73.15 H new ATOM 625 N MET A 38 19.865 -10.033 -3.424 1.00 5.24 N ATOM 626 CA MET A 38 18.833 -10.950 -3.893 1.00 44.22 C ATOM 627 C MET A 38 17.451 -10.313 -3.787 1.00 63.23 C ATOM 628 O MET A 38 16.631 -10.433 -4.697 1.00 72.43 O ATOM 629 CB MET A 38 18.872 -12.250 -3.088 1.00 71.22 C ATOM 630 CG MET A 38 18.250 -12.128 -1.707 1.00 32.34 C ATOM 631 SD MET A 38 18.234 -13.693 -0.811 1.00 71.34 S ATOM 632 CE MET A 38 19.957 -14.169 -0.931 1.00 14.04 C ATOM 0 H MET A 38 20.460 -10.410 -2.686 1.00 5.24 H new ATOM 0 HA MET A 38 19.030 -11.175 -4.941 1.00 44.22 H new ATOM 0 HB2 MET A 38 18.350 -13.028 -3.645 1.00 71.22 H new ATOM 0 HB3 MET A 38 19.908 -12.572 -2.984 1.00 71.22 H new ATOM 0 HG2 MET A 38 18.803 -11.388 -1.128 1.00 32.34 H new ATOM 0 HG3 MET A 38 17.229 -11.759 -1.804 1.00 32.34 H new ATOM 0 HE1 MET A 38 20.302 -14.534 0.036 1.00 14.04 H new ATOM 0 HE2 MET A 38 20.066 -14.957 -1.676 1.00 14.04 H new ATOM 0 HE3 MET A 38 20.553 -13.306 -1.226 1.00 14.04 H new ATOM 642 N ASP A 39 17.201 -9.637 -2.672 1.00 15.22 N ATOM 643 CA ASP A 39 15.918 -8.981 -2.448 1.00 14.53 C ATOM 644 C ASP A 39 15.759 -7.770 -3.363 1.00 22.15 C ATOM 645 O ASP A 39 14.647 -7.419 -3.757 1.00 62.35 O ATOM 646 CB ASP A 39 15.789 -8.551 -0.986 1.00 1.45 C ATOM 647 CG ASP A 39 16.103 -7.081 -0.784 1.00 62.24 C ATOM 648 OD1 ASP A 39 15.239 -6.240 -1.110 1.00 5.55 O ATOM 649 OD2 ASP A 39 17.212 -6.773 -0.301 1.00 3.21 O ATOM 0 H ASP A 39 17.869 -9.529 -1.909 1.00 15.22 H new ATOM 0 HA ASP A 39 15.128 -9.695 -2.680 1.00 14.53 H new ATOM 0 HB2 ASP A 39 14.776 -8.754 -0.639 1.00 1.45 H new ATOM 0 HB3 ASP A 39 16.462 -9.151 -0.373 1.00 1.45 H new ATOM 654 N ASP A 40 16.878 -7.135 -3.694 1.00 61.53 N ATOM 655 CA ASP A 40 16.864 -5.964 -4.563 1.00 11.14 C ATOM 656 C ASP A 40 16.365 -6.328 -5.958 1.00 3.53 C ATOM 657 O ASP A 40 15.487 -5.663 -6.507 1.00 51.44 O ATOM 658 CB ASP A 40 18.262 -5.351 -4.651 1.00 24.11 C ATOM 659 CG ASP A 40 18.307 -4.140 -5.562 1.00 64.20 C ATOM 660 OD1 ASP A 40 17.466 -3.234 -5.387 1.00 72.02 O ATOM 661 OD2 ASP A 40 19.185 -4.098 -6.449 1.00 71.34 O ATOM 0 H ASP A 40 17.806 -7.411 -3.374 1.00 61.53 H new ATOM 0 HA ASP A 40 16.181 -5.231 -4.133 1.00 11.14 H new ATOM 0 HB2 ASP A 40 18.593 -5.064 -3.653 1.00 24.11 H new ATOM 0 HB3 ASP A 40 18.963 -6.102 -5.015 1.00 24.11 H new ATOM 666 N PHE A 41 16.933 -7.387 -6.526 1.00 14.52 N ATOM 667 CA PHE A 41 16.547 -7.838 -7.858 1.00 44.40 C ATOM 668 C PHE A 41 15.108 -8.345 -7.865 1.00 64.24 C ATOM 669 O PHE A 41 14.339 -8.052 -8.781 1.00 40.35 O ATOM 670 CB PHE A 41 17.492 -8.941 -8.339 1.00 31.11 C ATOM 671 CG PHE A 41 17.182 -9.434 -9.724 1.00 2.15 C ATOM 672 CD1 PHE A 41 16.718 -8.562 -10.696 1.00 21.44 C ATOM 673 CD2 PHE A 41 17.356 -10.768 -10.053 1.00 73.42 C ATOM 674 CE1 PHE A 41 16.432 -9.014 -11.970 1.00 53.42 C ATOM 675 CE2 PHE A 41 17.071 -11.225 -11.326 1.00 63.34 C ATOM 676 CZ PHE A 41 16.610 -10.346 -12.286 1.00 73.34 C ATOM 0 H PHE A 41 17.662 -7.948 -6.085 1.00 14.52 H new ATOM 0 HA PHE A 41 16.616 -6.988 -8.537 1.00 44.40 H new ATOM 0 HB2 PHE A 41 18.516 -8.567 -8.316 1.00 31.11 H new ATOM 0 HB3 PHE A 41 17.443 -9.779 -7.644 1.00 31.11 H new ATOM 0 HD1 PHE A 41 16.579 -7.518 -10.455 1.00 21.44 H new ATOM 0 HD2 PHE A 41 17.719 -11.459 -9.306 1.00 73.42 H new ATOM 0 HE1 PHE A 41 16.069 -8.325 -12.719 1.00 53.42 H new ATOM 0 HE2 PHE A 41 17.209 -12.268 -11.569 1.00 63.34 H new ATOM 0 HZ PHE A 41 16.389 -10.700 -13.282 1.00 73.34 H new ATOM 686 N LEU A 42 14.752 -9.109 -6.839 1.00 13.24 N ATOM 687 CA LEU A 42 13.405 -9.659 -6.726 1.00 3.24 C ATOM 688 C LEU A 42 12.392 -8.560 -6.422 1.00 31.05 C ATOM 689 O LEU A 42 11.218 -8.671 -6.772 1.00 54.14 O ATOM 690 CB LEU A 42 13.360 -10.727 -5.632 1.00 33.22 C ATOM 691 CG LEU A 42 12.772 -12.079 -6.038 1.00 61.11 C ATOM 692 CD1 LEU A 42 11.253 -12.012 -6.072 1.00 61.44 C ATOM 693 CD2 LEU A 42 13.319 -12.514 -7.390 1.00 3.11 C ATOM 0 H LEU A 42 15.377 -9.362 -6.073 1.00 13.24 H new ATOM 0 HA LEU A 42 13.143 -10.114 -7.681 1.00 3.24 H new ATOM 0 HB2 LEU A 42 14.375 -10.889 -5.268 1.00 33.22 H new ATOM 0 HB3 LEU A 42 12.780 -10.337 -4.795 1.00 33.22 H new ATOM 0 HG LEU A 42 13.066 -12.820 -5.294 1.00 61.11 H new ATOM 0 HD11 LEU A 42 10.852 -12.983 -6.363 1.00 61.44 H new ATOM 0 HD12 LEU A 42 10.878 -11.746 -5.084 1.00 61.44 H new ATOM 0 HD13 LEU A 42 10.938 -11.259 -6.794 1.00 61.44 H new ATOM 0 HD21 LEU A 42 12.890 -13.478 -7.663 1.00 3.11 H new ATOM 0 HD22 LEU A 42 13.056 -11.773 -8.145 1.00 3.11 H new ATOM 0 HD23 LEU A 42 14.404 -12.603 -7.332 1.00 3.11 H new ATOM 705 N MET A 43 12.855 -7.499 -5.769 1.00 22.13 N ATOM 706 CA MET A 43 11.990 -6.378 -5.421 1.00 35.32 C ATOM 707 C MET A 43 11.592 -5.591 -6.666 1.00 22.53 C ATOM 708 O MET A 43 10.435 -5.202 -6.824 1.00 31.14 O ATOM 709 CB MET A 43 12.691 -5.456 -4.422 1.00 53.51 C ATOM 710 CG MET A 43 11.907 -4.191 -4.109 1.00 60.13 C ATOM 711 SD MET A 43 12.477 -3.375 -2.606 1.00 42.53 S ATOM 712 CE MET A 43 14.132 -2.889 -3.091 1.00 73.34 C ATOM 0 H MET A 43 13.824 -7.392 -5.470 1.00 22.13 H new ATOM 0 HA MET A 43 11.086 -6.778 -4.962 1.00 35.32 H new ATOM 0 HB2 MET A 43 12.866 -6.003 -3.496 1.00 53.51 H new ATOM 0 HB3 MET A 43 13.668 -5.179 -4.819 1.00 53.51 H new ATOM 0 HG2 MET A 43 11.991 -3.499 -4.947 1.00 60.13 H new ATOM 0 HG3 MET A 43 10.851 -4.439 -4.005 1.00 60.13 H new ATOM 0 HE1 MET A 43 14.476 -2.077 -2.450 1.00 73.34 H new ATOM 0 HE2 MET A 43 14.805 -3.740 -2.991 1.00 73.34 H new ATOM 0 HE3 MET A 43 14.123 -2.553 -4.128 1.00 73.34 H new ATOM 722 N LYS A 44 12.559 -5.360 -7.547 1.00 72.04 N ATOM 723 CA LYS A 44 12.310 -4.620 -8.779 1.00 65.42 C ATOM 724 C LYS A 44 11.467 -5.444 -9.748 1.00 2.34 C ATOM 725 O LYS A 44 10.627 -4.905 -10.468 1.00 34.00 O ATOM 726 CB LYS A 44 13.635 -4.233 -9.442 1.00 34.15 C ATOM 727 CG LYS A 44 14.130 -5.252 -10.453 1.00 55.04 C ATOM 728 CD LYS A 44 15.584 -5.011 -10.822 1.00 54.43 C ATOM 729 CE LYS A 44 15.743 -3.756 -11.668 1.00 62.40 C ATOM 730 NZ LYS A 44 16.049 -2.561 -10.835 1.00 15.44 N ATOM 0 H LYS A 44 13.522 -5.674 -7.431 1.00 72.04 H new ATOM 0 HA LYS A 44 11.759 -3.715 -8.525 1.00 65.42 H new ATOM 0 HB2 LYS A 44 13.516 -3.270 -9.938 1.00 34.15 H new ATOM 0 HB3 LYS A 44 14.393 -4.102 -8.670 1.00 34.15 H new ATOM 0 HG2 LYS A 44 14.019 -6.256 -10.043 1.00 55.04 H new ATOM 0 HG3 LYS A 44 13.513 -5.205 -11.351 1.00 55.04 H new ATOM 0 HD2 LYS A 44 16.180 -4.917 -9.914 1.00 54.43 H new ATOM 0 HD3 LYS A 44 15.969 -5.871 -11.369 1.00 54.43 H new ATOM 0 HE2 LYS A 44 16.542 -3.906 -12.394 1.00 62.40 H new ATOM 0 HE3 LYS A 44 14.827 -3.580 -12.233 1.00 62.40 H new ATOM 0 HZ1 LYS A 44 15.439 -1.770 -11.125 1.00 15.44 H new ATOM 0 HZ2 LYS A 44 15.876 -2.782 -9.834 1.00 15.44 H new ATOM 0 HZ3 LYS A 44 17.046 -2.294 -10.963 1.00 15.44 H new ATOM 744 N LYS A 45 11.696 -6.753 -9.759 1.00 1.50 N ATOM 745 CA LYS A 45 10.956 -7.652 -10.636 1.00 41.44 C ATOM 746 C LYS A 45 9.475 -7.672 -10.271 1.00 43.30 C ATOM 747 O LYS A 45 8.613 -7.464 -11.125 1.00 32.55 O ATOM 748 CB LYS A 45 11.532 -9.067 -10.553 1.00 60.04 C ATOM 749 CG LYS A 45 10.987 -10.008 -11.614 1.00 22.55 C ATOM 750 CD LYS A 45 11.190 -9.451 -13.012 1.00 44.23 C ATOM 751 CE LYS A 45 12.648 -9.095 -13.264 1.00 73.32 C ATOM 752 NZ LYS A 45 13.567 -10.182 -12.828 1.00 22.41 N ATOM 0 H LYS A 45 12.389 -7.215 -9.170 1.00 1.50 H new ATOM 0 HA LYS A 45 11.055 -7.285 -11.658 1.00 41.44 H new ATOM 0 HB2 LYS A 45 12.617 -9.015 -10.648 1.00 60.04 H new ATOM 0 HB3 LYS A 45 11.318 -9.481 -9.568 1.00 60.04 H new ATOM 0 HG2 LYS A 45 11.482 -10.976 -11.532 1.00 22.55 H new ATOM 0 HG3 LYS A 45 9.924 -10.177 -11.440 1.00 22.55 H new ATOM 0 HD2 LYS A 45 10.861 -10.184 -13.748 1.00 44.23 H new ATOM 0 HD3 LYS A 45 10.570 -8.565 -13.145 1.00 44.23 H new ATOM 0 HE2 LYS A 45 12.796 -8.899 -14.326 1.00 73.32 H new ATOM 0 HE3 LYS A 45 12.895 -8.176 -12.733 1.00 73.32 H new ATOM 0 HZ1 LYS A 45 14.551 -9.894 -13.001 1.00 22.41 H new ATOM 0 HZ2 LYS A 45 13.432 -10.364 -11.813 1.00 22.41 H new ATOM 0 HZ3 LYS A 45 13.360 -11.048 -13.365 1.00 22.41 H new ATOM 766 N SER A 46 9.188 -7.921 -8.997 1.00 70.04 N ATOM 767 CA SER A 46 7.811 -7.970 -8.520 1.00 20.21 C ATOM 768 C SER A 46 7.126 -6.619 -8.697 1.00 51.43 C ATOM 769 O SER A 46 5.904 -6.540 -8.823 1.00 33.11 O ATOM 770 CB SER A 46 7.774 -8.384 -7.048 1.00 30.24 C ATOM 771 OG SER A 46 6.512 -8.927 -6.702 1.00 74.42 O ATOM 0 H SER A 46 9.890 -8.092 -8.277 1.00 70.04 H new ATOM 0 HA SER A 46 7.273 -8.710 -9.112 1.00 20.21 H new ATOM 0 HB2 SER A 46 8.555 -9.119 -6.854 1.00 30.24 H new ATOM 0 HB3 SER A 46 7.986 -7.520 -6.419 1.00 30.24 H new ATOM 0 HG SER A 46 6.115 -9.359 -7.487 1.00 74.42 H new ATOM 777 N LYS A 47 7.923 -5.555 -8.707 1.00 33.34 N ATOM 778 CA LYS A 47 7.396 -4.205 -8.870 1.00 22.53 C ATOM 779 C LYS A 47 6.954 -3.964 -10.309 1.00 63.05 C ATOM 780 O LYS A 47 6.035 -3.186 -10.564 1.00 12.51 O ATOM 781 CB LYS A 47 8.452 -3.172 -8.469 1.00 34.32 C ATOM 782 CG LYS A 47 9.035 -2.410 -9.646 1.00 73.22 C ATOM 783 CD LYS A 47 9.271 -0.949 -9.303 1.00 25.15 C ATOM 784 CE LYS A 47 10.445 -0.784 -8.349 1.00 15.05 C ATOM 785 NZ LYS A 47 10.735 0.650 -8.070 1.00 23.31 N ATOM 0 H LYS A 47 8.937 -5.602 -8.604 1.00 33.34 H new ATOM 0 HA LYS A 47 6.528 -4.099 -8.220 1.00 22.53 H new ATOM 0 HB2 LYS A 47 8.007 -2.462 -7.772 1.00 34.32 H new ATOM 0 HB3 LYS A 47 9.259 -3.677 -7.938 1.00 34.32 H new ATOM 0 HG2 LYS A 47 9.976 -2.870 -9.948 1.00 73.22 H new ATOM 0 HG3 LYS A 47 8.358 -2.480 -10.497 1.00 73.22 H new ATOM 0 HD2 LYS A 47 9.461 -0.386 -10.217 1.00 25.15 H new ATOM 0 HD3 LYS A 47 8.372 -0.530 -8.851 1.00 25.15 H new ATOM 0 HE2 LYS A 47 10.228 -1.299 -7.413 1.00 15.05 H new ATOM 0 HE3 LYS A 47 11.329 -1.257 -8.776 1.00 15.05 H new ATOM 0 HZ1 LYS A 47 11.541 0.720 -7.416 1.00 23.31 H new ATOM 0 HZ2 LYS A 47 10.967 1.137 -8.959 1.00 23.31 H new ATOM 0 HZ3 LYS A 47 9.900 1.096 -7.639 1.00 23.31 H new ATOM 799 N ILE A 48 7.614 -4.637 -11.247 1.00 14.24 N ATOM 800 CA ILE A 48 7.286 -4.497 -12.660 1.00 43.40 C ATOM 801 C ILE A 48 6.067 -5.335 -13.028 1.00 15.25 C ATOM 802 O ILE A 48 5.286 -4.964 -13.906 1.00 4.03 O ATOM 803 CB ILE A 48 8.469 -4.911 -13.556 1.00 13.04 C ATOM 804 CG1 ILE A 48 9.627 -3.924 -13.398 1.00 11.34 C ATOM 805 CG2 ILE A 48 8.029 -4.992 -15.010 1.00 11.33 C ATOM 806 CD1 ILE A 48 10.976 -4.593 -13.255 1.00 41.35 C ATOM 0 H ILE A 48 8.378 -5.284 -11.053 1.00 14.24 H new ATOM 0 HA ILE A 48 7.063 -3.443 -12.829 1.00 43.40 H new ATOM 0 HB ILE A 48 8.813 -5.898 -13.245 1.00 13.04 H new ATOM 0 HG12 ILE A 48 9.649 -3.261 -14.263 1.00 11.34 H new ATOM 0 HG13 ILE A 48 9.445 -3.300 -12.523 1.00 11.34 H new ATOM 0 HG21 ILE A 48 8.876 -5.286 -15.631 1.00 11.33 H new ATOM 0 HG22 ILE A 48 7.233 -5.730 -15.109 1.00 11.33 H new ATOM 0 HG23 ILE A 48 7.662 -4.018 -15.334 1.00 11.33 H new ATOM 0 HD11 ILE A 48 11.750 -3.833 -13.147 1.00 41.35 H new ATOM 0 HD12 ILE A 48 10.972 -5.235 -12.374 1.00 41.35 H new ATOM 0 HD13 ILE A 48 11.180 -5.195 -14.141 1.00 41.35 H new ATOM 818 N LEU A 49 5.907 -6.466 -12.349 1.00 53.32 N ATOM 819 CA LEU A 49 4.780 -7.357 -12.602 1.00 70.05 C ATOM 820 C LEU A 49 3.456 -6.655 -12.319 1.00 52.12 C ATOM 821 O LEU A 49 2.407 -7.061 -12.817 1.00 70.35 O ATOM 822 CB LEU A 49 4.897 -8.616 -11.742 1.00 30.22 C ATOM 823 CG LEU A 49 6.262 -9.305 -11.742 1.00 61.14 C ATOM 824 CD1 LEU A 49 6.126 -10.760 -11.322 1.00 73.44 C ATOM 825 CD2 LEU A 49 6.911 -9.203 -13.115 1.00 54.32 C ATOM 0 H LEU A 49 6.543 -6.787 -11.619 1.00 53.32 H new ATOM 0 HA LEU A 49 4.802 -7.640 -13.654 1.00 70.05 H new ATOM 0 HB2 LEU A 49 4.645 -8.354 -10.714 1.00 30.22 H new ATOM 0 HB3 LEU A 49 4.150 -9.334 -12.081 1.00 30.22 H new ATOM 0 HG LEU A 49 6.903 -8.798 -11.020 1.00 61.14 H new ATOM 0 HD11 LEU A 49 7.108 -11.234 -11.328 1.00 73.44 H new ATOM 0 HD12 LEU A 49 5.705 -10.811 -10.318 1.00 73.44 H new ATOM 0 HD13 LEU A 49 5.468 -11.280 -12.018 1.00 73.44 H new ATOM 0 HD21 LEU A 49 7.882 -9.699 -13.096 1.00 54.32 H new ATOM 0 HD22 LEU A 49 6.272 -9.684 -13.856 1.00 54.32 H new ATOM 0 HD23 LEU A 49 7.045 -8.153 -13.377 1.00 54.32 H new ATOM 837 N GLY A 50 3.513 -5.596 -11.517 1.00 32.34 N ATOM 838 CA GLY A 50 2.312 -4.853 -11.183 1.00 31.13 C ATOM 839 C GLY A 50 2.272 -3.489 -11.842 1.00 42.22 C ATOM 840 O GLY A 50 1.198 -2.955 -12.117 1.00 54.45 O ATOM 0 H GLY A 50 4.369 -5.240 -11.093 1.00 32.34 H new ATOM 0 HA2 GLY A 50 1.437 -5.427 -11.489 1.00 31.13 H new ATOM 0 HA3 GLY A 50 2.252 -4.732 -10.101 1.00 31.13 H new ATOM 844 N LYS A 51 3.447 -2.922 -12.095 1.00 53.55 N ATOM 845 CA LYS A 51 3.544 -1.611 -12.726 1.00 54.44 C ATOM 846 C LYS A 51 2.932 -1.633 -14.124 1.00 11.44 C ATOM 847 O LYS A 51 2.352 -2.635 -14.544 1.00 3.24 O ATOM 848 CB LYS A 51 5.006 -1.167 -12.805 1.00 50.43 C ATOM 849 CG LYS A 51 5.308 0.081 -11.993 1.00 34.32 C ATOM 850 CD LYS A 51 4.901 -0.089 -10.539 1.00 32.14 C ATOM 851 CE LYS A 51 5.374 1.079 -9.687 1.00 54.44 C ATOM 852 NZ LYS A 51 4.375 2.183 -9.657 1.00 15.33 N ATOM 0 H LYS A 51 4.346 -3.350 -11.873 1.00 53.55 H new ATOM 0 HA LYS A 51 2.987 -0.900 -12.116 1.00 54.44 H new ATOM 0 HB2 LYS A 51 5.643 -1.980 -12.457 1.00 50.43 H new ATOM 0 HB3 LYS A 51 5.265 -0.983 -13.848 1.00 50.43 H new ATOM 0 HG2 LYS A 51 6.373 0.305 -12.050 1.00 34.32 H new ATOM 0 HG3 LYS A 51 4.780 0.932 -12.423 1.00 34.32 H new ATOM 0 HD2 LYS A 51 3.816 -0.174 -10.471 1.00 32.14 H new ATOM 0 HD3 LYS A 51 5.319 -1.017 -10.149 1.00 32.14 H new ATOM 0 HE2 LYS A 51 5.565 0.734 -8.671 1.00 54.44 H new ATOM 0 HE3 LYS A 51 6.319 1.455 -10.078 1.00 54.44 H new ATOM 0 HZ1 LYS A 51 4.734 2.960 -9.066 1.00 15.33 H new ATOM 0 HZ2 LYS A 51 4.212 2.530 -10.624 1.00 15.33 H new ATOM 0 HZ3 LYS A 51 3.481 1.831 -9.260 1.00 15.33 H new ATOM 866 N THR A 52 3.066 -0.521 -14.841 1.00 34.30 N ATOM 867 CA THR A 52 2.527 -0.413 -16.191 1.00 34.43 C ATOM 868 C THR A 52 3.617 -0.043 -17.190 1.00 74.10 C ATOM 869 O THR A 52 4.721 0.339 -16.805 1.00 72.20 O ATOM 870 CB THR A 52 1.401 0.635 -16.264 1.00 11.40 C ATOM 871 OG1 THR A 52 0.799 0.618 -17.563 1.00 34.21 O ATOM 872 CG2 THR A 52 1.938 2.027 -15.967 1.00 41.43 C ATOM 0 H THR A 52 3.543 0.317 -14.509 1.00 34.30 H new ATOM 0 HA THR A 52 2.120 -1.391 -16.448 1.00 34.43 H new ATOM 0 HB THR A 52 0.652 0.384 -15.514 1.00 11.40 H new ATOM 0 HG1 THR A 52 -0.090 1.029 -17.517 1.00 34.21 H new ATOM 0 HG21 THR A 52 1.125 2.751 -16.024 1.00 41.43 H new ATOM 0 HG22 THR A 52 2.370 2.045 -14.966 1.00 41.43 H new ATOM 0 HG23 THR A 52 2.705 2.285 -16.697 1.00 41.43 H new ATOM 880 N ASN A 53 3.298 -0.158 -18.475 1.00 64.13 N ATOM 881 CA ASN A 53 4.252 0.165 -19.531 1.00 13.34 C ATOM 882 C ASN A 53 4.758 1.597 -19.386 1.00 52.34 C ATOM 883 O ASN A 53 5.861 1.925 -19.824 1.00 22.13 O ATOM 884 CB ASN A 53 3.606 -0.023 -20.905 1.00 23.40 C ATOM 885 CG ASN A 53 2.652 1.102 -21.255 1.00 41.00 C ATOM 886 OD1 ASN A 53 1.447 1.005 -21.021 1.00 63.30 O ATOM 887 ND2 ASN A 53 3.188 2.178 -21.819 1.00 41.02 N ATOM 0 H ASN A 53 2.387 -0.472 -18.810 1.00 64.13 H new ATOM 0 HA ASN A 53 5.101 -0.513 -19.440 1.00 13.34 H new ATOM 0 HB2 ASN A 53 4.385 -0.084 -21.664 1.00 23.40 H new ATOM 0 HB3 ASN A 53 3.068 -0.971 -20.924 1.00 23.40 H new ATOM 0 HD21 ASN A 53 2.596 2.967 -22.077 1.00 41.02 H new ATOM 0 HD22 ASN A 53 4.192 2.215 -21.995 1.00 41.02 H new ATOM 894 N LYS A 54 3.944 2.447 -18.769 1.00 50.34 N ATOM 895 CA LYS A 54 4.308 3.844 -18.565 1.00 1.23 C ATOM 896 C LYS A 54 5.404 3.972 -17.512 1.00 2.04 C ATOM 897 O LYS A 54 6.305 4.800 -17.639 1.00 44.31 O ATOM 898 CB LYS A 54 3.082 4.656 -18.141 1.00 32.52 C ATOM 899 CG LYS A 54 1.859 4.406 -19.006 1.00 54.00 C ATOM 900 CD LYS A 54 0.639 5.139 -18.473 1.00 2.15 C ATOM 901 CE LYS A 54 -0.084 4.321 -17.414 1.00 31.21 C ATOM 902 NZ LYS A 54 -1.460 4.831 -17.163 1.00 13.32 N ATOM 0 H LYS A 54 3.027 2.192 -18.401 1.00 50.34 H new ATOM 0 HA LYS A 54 4.687 4.236 -19.509 1.00 1.23 H new ATOM 0 HB2 LYS A 54 2.839 4.418 -17.105 1.00 32.52 H new ATOM 0 HB3 LYS A 54 3.330 5.717 -18.174 1.00 32.52 H new ATOM 0 HG2 LYS A 54 2.062 4.730 -20.027 1.00 54.00 H new ATOM 0 HG3 LYS A 54 1.653 3.336 -19.046 1.00 54.00 H new ATOM 0 HD2 LYS A 54 0.944 6.096 -18.050 1.00 2.15 H new ATOM 0 HD3 LYS A 54 -0.043 5.357 -19.294 1.00 2.15 H new ATOM 0 HE2 LYS A 54 -0.135 3.280 -17.732 1.00 31.21 H new ATOM 0 HE3 LYS A 54 0.487 4.343 -16.486 1.00 31.21 H new ATOM 0 HZ1 LYS A 54 -1.919 4.247 -16.435 1.00 13.32 H new ATOM 0 HZ2 LYS A 54 -1.410 5.817 -16.835 1.00 13.32 H new ATOM 0 HZ3 LYS A 54 -2.013 4.786 -18.043 1.00 13.32 H new ATOM 916 N GLN A 55 5.321 3.146 -16.474 1.00 14.03 N ATOM 917 CA GLN A 55 6.307 3.167 -15.400 1.00 14.32 C ATOM 918 C GLN A 55 7.522 2.319 -15.759 1.00 72.24 C ATOM 919 O GLN A 55 8.640 2.603 -15.329 1.00 43.30 O ATOM 920 CB GLN A 55 5.684 2.662 -14.097 1.00 61.42 C ATOM 921 CG GLN A 55 6.478 3.039 -12.857 1.00 21.51 C ATOM 922 CD GLN A 55 6.745 4.528 -12.765 1.00 64.13 C ATOM 923 OE1 GLN A 55 5.831 5.322 -12.543 1.00 72.01 O ATOM 924 NE2 GLN A 55 8.004 4.915 -12.936 1.00 51.54 N ATOM 0 H GLN A 55 4.581 2.454 -16.354 1.00 14.03 H new ATOM 0 HA GLN A 55 6.635 4.197 -15.262 1.00 14.32 H new ATOM 0 HB2 GLN A 55 4.674 3.063 -14.008 1.00 61.42 H new ATOM 0 HB3 GLN A 55 5.593 1.577 -14.144 1.00 61.42 H new ATOM 0 HG2 GLN A 55 5.934 2.716 -11.970 1.00 21.51 H new ATOM 0 HG3 GLN A 55 7.427 2.503 -12.861 1.00 21.51 H new ATOM 0 HE21 GLN A 55 8.730 4.222 -13.118 1.00 51.54 H new ATOM 0 HE22 GLN A 55 8.245 5.905 -12.885 1.00 51.54 H new ATOM 933 N LEU A 56 7.295 1.276 -16.550 1.00 64.33 N ATOM 934 CA LEU A 56 8.372 0.385 -16.968 1.00 62.51 C ATOM 935 C LEU A 56 9.542 1.176 -17.543 1.00 3.42 C ATOM 936 O LEU A 56 9.363 2.024 -18.418 1.00 10.44 O ATOM 937 CB LEU A 56 7.859 -0.615 -18.006 1.00 64.31 C ATOM 938 CG LEU A 56 8.925 -1.298 -18.864 1.00 21.43 C ATOM 939 CD1 LEU A 56 8.496 -2.713 -19.222 1.00 4.05 C ATOM 940 CD2 LEU A 56 9.198 -0.487 -20.122 1.00 74.42 C ATOM 0 H LEU A 56 6.376 1.027 -16.915 1.00 64.33 H new ATOM 0 HA LEU A 56 8.722 -0.158 -16.090 1.00 62.51 H new ATOM 0 HB2 LEU A 56 7.289 -1.386 -17.488 1.00 64.31 H new ATOM 0 HB3 LEU A 56 7.165 -0.097 -18.668 1.00 64.31 H new ATOM 0 HG LEU A 56 9.847 -1.355 -18.286 1.00 21.43 H new ATOM 0 HD11 LEU A 56 9.267 -3.183 -19.833 1.00 4.05 H new ATOM 0 HD12 LEU A 56 8.353 -3.292 -18.309 1.00 4.05 H new ATOM 0 HD13 LEU A 56 7.561 -2.679 -19.781 1.00 4.05 H new ATOM 0 HD21 LEU A 56 9.959 -0.988 -20.720 1.00 74.42 H new ATOM 0 HD22 LEU A 56 8.280 -0.397 -20.703 1.00 74.42 H new ATOM 0 HD23 LEU A 56 9.550 0.507 -19.845 1.00 74.42 H new ATOM 952 N THR A 57 10.743 0.893 -17.047 1.00 32.23 N ATOM 953 CA THR A 57 11.943 1.577 -17.511 1.00 52.10 C ATOM 954 C THR A 57 12.859 0.625 -18.272 1.00 0.34 C ATOM 955 O THR A 57 12.501 -0.524 -18.528 1.00 34.34 O ATOM 956 CB THR A 57 12.725 2.197 -16.338 1.00 43.11 C ATOM 957 OG1 THR A 57 13.370 1.167 -15.581 1.00 3.34 O ATOM 958 CG2 THR A 57 11.800 2.996 -15.432 1.00 61.14 C ATOM 0 H THR A 57 10.910 0.194 -16.323 1.00 32.23 H new ATOM 0 HA THR A 57 11.615 2.373 -18.180 1.00 52.10 H new ATOM 0 HB THR A 57 13.477 2.872 -16.748 1.00 43.11 H new ATOM 0 HG1 THR A 57 13.867 1.569 -14.838 1.00 3.34 H new ATOM 0 HG21 THR A 57 12.375 3.424 -14.611 1.00 61.14 H new ATOM 0 HG22 THR A 57 11.333 3.797 -16.004 1.00 61.14 H new ATOM 0 HG23 THR A 57 11.028 2.340 -15.030 1.00 61.14 H new ATOM 966 N ARG A 58 14.043 1.111 -18.630 1.00 21.04 N ATOM 967 CA ARG A 58 15.011 0.303 -19.362 1.00 32.33 C ATOM 968 C ARG A 58 15.372 -0.956 -18.578 1.00 14.21 C ATOM 969 O ARG A 58 15.232 -2.072 -19.078 1.00 43.11 O ATOM 970 CB ARG A 58 16.274 1.117 -19.649 1.00 74.13 C ATOM 971 CG ARG A 58 17.284 0.387 -20.519 1.00 72.04 C ATOM 972 CD ARG A 58 18.710 0.774 -20.161 1.00 21.20 C ATOM 973 NE ARG A 58 19.680 -0.209 -20.636 1.00 73.52 N ATOM 974 CZ ARG A 58 20.102 -0.277 -21.894 1.00 1.41 C ATOM 975 NH1 ARG A 58 19.643 0.578 -22.797 1.00 52.05 N ATOM 976 NH2 ARG A 58 20.986 -1.200 -22.250 1.00 3.23 N ATOM 0 H ARG A 58 14.355 2.060 -18.425 1.00 21.04 H new ATOM 0 HA ARG A 58 14.557 0.005 -20.307 1.00 32.33 H new ATOM 0 HB2 ARG A 58 15.992 2.049 -20.139 1.00 74.13 H new ATOM 0 HB3 ARG A 58 16.747 1.384 -18.704 1.00 74.13 H new ATOM 0 HG2 ARG A 58 17.157 -0.689 -20.401 1.00 72.04 H new ATOM 0 HG3 ARG A 58 17.096 0.617 -21.568 1.00 72.04 H new ATOM 0 HD2 ARG A 58 18.940 1.748 -20.592 1.00 21.20 H new ATOM 0 HD3 ARG A 58 18.797 0.876 -19.079 1.00 21.20 H new ATOM 0 HE ARG A 58 20.054 -0.880 -19.965 1.00 73.52 H new ATOM 0 HH11 ARG A 58 18.964 1.290 -22.527 1.00 52.05 H new ATOM 0 HH12 ARG A 58 19.968 0.524 -23.762 1.00 52.05 H new ATOM 0 HH21 ARG A 58 21.343 -1.859 -21.558 1.00 3.23 H new ATOM 0 HH22 ARG A 58 21.309 -1.251 -23.216 1.00 3.23 H new ATOM 990 N SER A 59 15.836 -0.767 -17.347 1.00 23.30 N ATOM 991 CA SER A 59 16.221 -1.887 -16.496 1.00 3.25 C ATOM 992 C SER A 59 15.084 -2.896 -16.378 1.00 74.40 C ATOM 993 O SER A 59 15.316 -4.091 -16.189 1.00 14.55 O ATOM 994 CB SER A 59 16.619 -1.385 -15.106 1.00 14.11 C ATOM 995 OG SER A 59 17.902 -0.784 -15.128 1.00 71.42 O ATOM 0 H SER A 59 15.954 0.150 -16.917 1.00 23.30 H new ATOM 0 HA SER A 59 17.077 -2.383 -16.955 1.00 3.25 H new ATOM 0 HB2 SER A 59 15.882 -0.664 -14.752 1.00 14.11 H new ATOM 0 HB3 SER A 59 16.616 -2.216 -14.401 1.00 14.11 H new ATOM 0 HG SER A 59 18.132 -0.470 -14.228 1.00 71.42 H new ATOM 1001 N ASP A 60 13.854 -2.408 -16.492 1.00 14.32 N ATOM 1002 CA ASP A 60 12.678 -3.266 -16.400 1.00 22.14 C ATOM 1003 C ASP A 60 12.517 -4.104 -17.664 1.00 31.20 C ATOM 1004 O ASP A 60 12.014 -5.227 -17.616 1.00 54.34 O ATOM 1005 CB ASP A 60 11.423 -2.424 -16.167 1.00 74.30 C ATOM 1006 CG ASP A 60 11.479 -1.648 -14.866 1.00 53.01 C ATOM 1007 OD1 ASP A 60 12.452 -1.833 -14.106 1.00 5.21 O ATOM 1008 OD2 ASP A 60 10.549 -0.855 -14.608 1.00 44.14 O ATOM 0 H ASP A 60 13.645 -1.422 -16.648 1.00 14.32 H new ATOM 0 HA ASP A 60 12.815 -3.940 -15.554 1.00 22.14 H new ATOM 0 HB2 ASP A 60 11.297 -1.728 -16.996 1.00 74.30 H new ATOM 0 HB3 ASP A 60 10.549 -3.075 -16.161 1.00 74.30 H new ATOM 1013 N ARG A 61 12.946 -3.551 -18.793 1.00 42.34 N ATOM 1014 CA ARG A 61 12.847 -4.246 -20.071 1.00 22.31 C ATOM 1015 C ARG A 61 13.915 -5.330 -20.184 1.00 21.41 C ATOM 1016 O ARG A 61 13.642 -6.437 -20.647 1.00 22.21 O ATOM 1017 CB ARG A 61 12.987 -3.255 -21.228 1.00 21.13 C ATOM 1018 CG ARG A 61 11.840 -3.315 -22.223 1.00 40.21 C ATOM 1019 CD ARG A 61 11.376 -1.923 -22.623 1.00 1.13 C ATOM 1020 NE ARG A 61 10.328 -1.966 -23.639 1.00 0.02 N ATOM 1021 CZ ARG A 61 10.543 -2.318 -24.902 1.00 13.24 C ATOM 1022 NH1 ARG A 61 11.761 -2.656 -25.301 1.00 51.32 N ATOM 1023 NH2 ARG A 61 9.537 -2.333 -25.768 1.00 4.55 N ATOM 0 H ARG A 61 13.366 -2.623 -18.849 1.00 42.34 H new ATOM 0 HA ARG A 61 11.866 -4.719 -20.124 1.00 22.31 H new ATOM 0 HB2 ARG A 61 13.054 -2.245 -20.824 1.00 21.13 H new ATOM 0 HB3 ARG A 61 13.922 -3.451 -21.752 1.00 21.13 H new ATOM 0 HG2 ARG A 61 12.155 -3.864 -23.111 1.00 40.21 H new ATOM 0 HG3 ARG A 61 11.007 -3.866 -21.787 1.00 40.21 H new ATOM 0 HD2 ARG A 61 11.006 -1.397 -21.743 1.00 1.13 H new ATOM 0 HD3 ARG A 61 12.224 -1.353 -23.001 1.00 1.13 H new ATOM 0 HE ARG A 61 9.379 -1.712 -23.364 1.00 0.02 H new ATOM 0 HH11 ARG A 61 12.536 -2.646 -24.638 1.00 51.32 H new ATOM 0 HH12 ARG A 61 11.923 -2.926 -26.271 1.00 51.32 H new ATOM 0 HH21 ARG A 61 8.598 -2.074 -25.464 1.00 4.55 H new ATOM 0 HH22 ARG A 61 9.703 -2.603 -26.737 1.00 4.55 H new ATOM 1037 N GLU A 62 15.131 -5.003 -19.758 1.00 1.20 N ATOM 1038 CA GLU A 62 16.240 -5.949 -19.813 1.00 55.41 C ATOM 1039 C GLU A 62 15.997 -7.127 -18.874 1.00 11.42 C ATOM 1040 O GLU A 62 16.317 -8.270 -19.198 1.00 62.13 O ATOM 1041 CB GLU A 62 17.552 -5.252 -19.447 1.00 71.31 C ATOM 1042 CG GLU A 62 17.815 -5.196 -17.952 1.00 15.24 C ATOM 1043 CD GLU A 62 18.445 -6.469 -17.421 1.00 40.15 C ATOM 1044 OE1 GLU A 62 18.703 -7.385 -18.230 1.00 35.24 O ATOM 1045 OE2 GLU A 62 18.681 -6.548 -16.198 1.00 21.34 O ATOM 0 H GLU A 62 15.373 -4.091 -19.371 1.00 1.20 H new ATOM 0 HA GLU A 62 16.311 -6.328 -20.832 1.00 55.41 H new ATOM 0 HB2 GLU A 62 18.378 -5.772 -19.933 1.00 71.31 H new ATOM 0 HB3 GLU A 62 17.537 -4.237 -19.843 1.00 71.31 H new ATOM 0 HG2 GLU A 62 18.470 -4.353 -17.734 1.00 15.24 H new ATOM 0 HG3 GLU A 62 16.876 -5.014 -17.429 1.00 15.24 H new ATOM 1052 N VAL A 63 15.429 -6.838 -17.707 1.00 70.30 N ATOM 1053 CA VAL A 63 15.142 -7.872 -16.720 1.00 24.40 C ATOM 1054 C VAL A 63 13.988 -8.759 -17.172 1.00 54.04 C ATOM 1055 O VAL A 63 14.019 -9.977 -16.994 1.00 61.44 O ATOM 1056 CB VAL A 63 14.799 -7.260 -15.349 1.00 74.02 C ATOM 1057 CG1 VAL A 63 15.983 -6.480 -14.800 1.00 44.14 C ATOM 1058 CG2 VAL A 63 13.568 -6.372 -15.456 1.00 44.34 C ATOM 0 H VAL A 63 15.159 -5.897 -17.422 1.00 70.30 H new ATOM 0 HA VAL A 63 16.044 -8.476 -16.624 1.00 24.40 H new ATOM 0 HB VAL A 63 14.576 -8.070 -14.655 1.00 74.02 H new ATOM 0 HG11 VAL A 63 15.721 -6.055 -13.831 1.00 44.14 H new ATOM 0 HG12 VAL A 63 16.837 -7.148 -14.685 1.00 44.14 H new ATOM 0 HG13 VAL A 63 16.241 -5.677 -15.490 1.00 44.14 H new ATOM 0 HG21 VAL A 63 13.339 -5.948 -14.478 1.00 44.34 H new ATOM 0 HG22 VAL A 63 13.761 -5.567 -16.165 1.00 44.34 H new ATOM 0 HG23 VAL A 63 12.721 -6.965 -15.801 1.00 44.34 H new ATOM 1068 N LEU A 64 12.969 -8.140 -17.759 1.00 32.33 N ATOM 1069 CA LEU A 64 11.802 -8.873 -18.238 1.00 61.22 C ATOM 1070 C LEU A 64 12.199 -9.893 -19.301 1.00 33.22 C ATOM 1071 O LEU A 64 11.751 -11.040 -19.273 1.00 11.42 O ATOM 1072 CB LEU A 64 10.765 -7.904 -18.807 1.00 52.25 C ATOM 1073 CG LEU A 64 9.471 -7.759 -18.006 1.00 54.11 C ATOM 1074 CD1 LEU A 64 9.774 -7.619 -16.523 1.00 23.35 C ATOM 1075 CD2 LEU A 64 8.667 -6.566 -18.502 1.00 53.04 C ATOM 0 H LEU A 64 12.927 -7.133 -17.915 1.00 32.33 H new ATOM 0 HA LEU A 64 11.366 -9.406 -17.393 1.00 61.22 H new ATOM 0 HB2 LEU A 64 11.226 -6.920 -18.895 1.00 52.25 H new ATOM 0 HB3 LEU A 64 10.510 -8.228 -19.816 1.00 52.25 H new ATOM 0 HG LEU A 64 8.874 -8.660 -18.151 1.00 54.11 H new ATOM 0 HD11 LEU A 64 8.841 -7.517 -15.969 1.00 23.35 H new ATOM 0 HD12 LEU A 64 10.307 -8.504 -16.175 1.00 23.35 H new ATOM 0 HD13 LEU A 64 10.391 -6.736 -16.360 1.00 23.35 H new ATOM 0 HD21 LEU A 64 7.749 -6.478 -17.920 1.00 53.04 H new ATOM 0 HD22 LEU A 64 9.257 -5.657 -18.388 1.00 53.04 H new ATOM 0 HD23 LEU A 64 8.418 -6.707 -19.554 1.00 53.04 H new ATOM 1087 N ASP A 65 13.042 -9.469 -20.235 1.00 5.21 N ATOM 1088 CA ASP A 65 13.503 -10.346 -21.305 1.00 54.01 C ATOM 1089 C ASP A 65 14.351 -11.484 -20.748 1.00 23.44 C ATOM 1090 O ASP A 65 14.267 -12.620 -21.214 1.00 3.25 O ATOM 1091 CB ASP A 65 14.307 -9.551 -22.335 1.00 13.10 C ATOM 1092 CG ASP A 65 14.037 -10.005 -23.756 1.00 55.31 C ATOM 1093 OD1 ASP A 65 13.089 -9.479 -24.377 1.00 74.20 O ATOM 1094 OD2 ASP A 65 14.773 -10.885 -24.248 1.00 4.43 O ATOM 0 H ASP A 65 13.421 -8.523 -20.273 1.00 5.21 H new ATOM 0 HA ASP A 65 12.627 -10.775 -21.792 1.00 54.01 H new ATOM 0 HB2 ASP A 65 14.064 -8.492 -22.243 1.00 13.10 H new ATOM 0 HB3 ASP A 65 15.371 -9.654 -22.120 1.00 13.10 H new ATOM 1099 N ASN A 66 15.169 -11.171 -19.748 1.00 22.31 N ATOM 1100 CA ASN A 66 16.035 -12.168 -19.128 1.00 11.21 C ATOM 1101 C ASN A 66 15.226 -13.124 -18.256 1.00 63.15 C ATOM 1102 O ASN A 66 15.529 -14.315 -18.178 1.00 3.32 O ATOM 1103 CB ASN A 66 17.115 -11.483 -18.287 1.00 73.53 C ATOM 1104 CG ASN A 66 18.087 -12.475 -17.677 1.00 13.43 C ATOM 1105 OD1 ASN A 66 17.769 -13.149 -16.697 1.00 63.21 O ATOM 1106 ND2 ASN A 66 19.279 -12.566 -18.255 1.00 32.44 N ATOM 0 H ASN A 66 15.250 -10.235 -19.350 1.00 22.31 H new ATOM 0 HA ASN A 66 16.512 -12.743 -19.922 1.00 11.21 H new ATOM 0 HB2 ASN A 66 17.664 -10.777 -18.910 1.00 73.53 H new ATOM 0 HB3 ASN A 66 16.642 -10.906 -17.492 1.00 73.53 H new ATOM 0 HD21 ASN A 66 19.975 -13.215 -17.888 1.00 32.44 H new ATOM 0 HD22 ASN A 66 19.498 -11.987 -19.066 1.00 32.44 H new ATOM 1113 N TRP A 67 14.197 -12.595 -17.605 1.00 41.10 N ATOM 1114 CA TRP A 67 13.344 -13.402 -16.740 1.00 2.34 C ATOM 1115 C TRP A 67 12.633 -14.490 -17.537 1.00 3.41 C ATOM 1116 O TRP A 67 12.612 -15.653 -17.135 1.00 11.12 O ATOM 1117 CB TRP A 67 12.317 -12.516 -16.033 1.00 34.11 C ATOM 1118 CG TRP A 67 12.109 -12.880 -14.594 1.00 13.22 C ATOM 1119 CD1 TRP A 67 13.049 -13.355 -13.724 1.00 51.44 C ATOM 1120 CD2 TRP A 67 10.883 -12.800 -13.858 1.00 60.02 C ATOM 1121 NE1 TRP A 67 12.481 -13.575 -12.493 1.00 4.35 N ATOM 1122 CE2 TRP A 67 11.154 -13.241 -12.548 1.00 71.52 C ATOM 1123 CE3 TRP A 67 9.584 -12.397 -14.178 1.00 12.32 C ATOM 1124 CZ2 TRP A 67 10.172 -13.291 -11.562 1.00 24.11 C ATOM 1125 CZ3 TRP A 67 8.611 -12.447 -13.198 1.00 12.11 C ATOM 1126 CH2 TRP A 67 8.909 -12.891 -11.903 1.00 1.54 C ATOM 0 H TRP A 67 13.933 -11.611 -17.659 1.00 41.10 H new ATOM 0 HA TRP A 67 13.976 -13.881 -15.993 1.00 2.34 H new ATOM 0 HB2 TRP A 67 12.641 -11.477 -16.094 1.00 34.11 H new ATOM 0 HB3 TRP A 67 11.365 -12.585 -16.559 1.00 34.11 H new ATOM 0 HD1 TRP A 67 14.086 -13.532 -13.968 1.00 51.44 H new ATOM 0 HE1 TRP A 67 12.969 -13.930 -11.671 1.00 4.35 H new ATOM 0 HE3 TRP A 67 9.345 -12.053 -15.173 1.00 12.32 H new ATOM 0 HZ2 TRP A 67 10.399 -13.633 -10.563 1.00 24.11 H new ATOM 0 HZ3 TRP A 67 7.603 -12.138 -13.434 1.00 12.11 H new ATOM 0 HH2 TRP A 67 8.126 -12.918 -11.159 1.00 1.54 H new ATOM 1137 N ARG A 68 12.053 -14.104 -18.669 1.00 33.24 N ATOM 1138 CA ARG A 68 11.340 -15.048 -19.522 1.00 0.45 C ATOM 1139 C ARG A 68 12.314 -15.993 -20.219 1.00 51.43 C ATOM 1140 O ARG A 68 11.944 -17.097 -20.617 1.00 41.42 O ATOM 1141 CB ARG A 68 10.506 -14.298 -20.562 1.00 42.11 C ATOM 1142 CG ARG A 68 11.313 -13.319 -21.399 1.00 3.32 C ATOM 1143 CD ARG A 68 11.999 -14.015 -22.564 1.00 5.13 C ATOM 1144 NE ARG A 68 11.942 -13.220 -23.787 1.00 41.33 N ATOM 1145 CZ ARG A 68 10.858 -13.119 -24.548 1.00 14.52 C ATOM 1146 NH1 ARG A 68 9.746 -13.759 -24.212 1.00 3.21 N ATOM 1147 NH2 ARG A 68 10.883 -12.375 -25.647 1.00 24.33 N ATOM 0 H ARG A 68 12.063 -13.145 -19.017 1.00 33.24 H new ATOM 0 HA ARG A 68 10.676 -15.639 -18.892 1.00 0.45 H new ATOM 0 HB2 ARG A 68 10.029 -15.021 -21.223 1.00 42.11 H new ATOM 0 HB3 ARG A 68 9.708 -13.757 -20.054 1.00 42.11 H new ATOM 0 HG2 ARG A 68 10.657 -12.535 -21.777 1.00 3.32 H new ATOM 0 HG3 ARG A 68 12.061 -12.833 -20.772 1.00 3.32 H new ATOM 0 HD2 ARG A 68 13.040 -14.211 -22.307 1.00 5.13 H new ATOM 0 HD3 ARG A 68 11.526 -14.982 -22.738 1.00 5.13 H new ATOM 0 HE ARG A 68 12.780 -12.714 -24.073 1.00 41.33 H new ATOM 0 HH11 ARG A 68 9.722 -14.330 -23.367 1.00 3.21 H new ATOM 0 HH12 ARG A 68 8.915 -13.680 -24.798 1.00 3.21 H new ATOM 0 HH21 ARG A 68 11.736 -11.880 -25.908 1.00 24.33 H new ATOM 0 HH22 ARG A 68 10.050 -12.299 -26.230 1.00 24.33 H new ATOM 1161 N GLU A 69 13.559 -15.550 -20.364 1.00 41.11 N ATOM 1162 CA GLU A 69 14.585 -16.356 -21.015 1.00 71.21 C ATOM 1163 C GLU A 69 14.974 -17.548 -20.145 1.00 12.00 C ATOM 1164 O GLU A 69 15.090 -18.674 -20.630 1.00 62.05 O ATOM 1165 CB GLU A 69 15.820 -15.505 -21.315 1.00 4.33 C ATOM 1166 CG GLU A 69 16.994 -16.304 -21.856 1.00 72.01 C ATOM 1167 CD GLU A 69 16.687 -16.960 -23.188 1.00 64.33 C ATOM 1168 OE1 GLU A 69 16.007 -16.324 -24.020 1.00 45.52 O ATOM 1169 OE2 GLU A 69 17.127 -18.110 -23.399 1.00 51.10 O ATOM 0 H GLU A 69 13.881 -14.638 -20.040 1.00 41.11 H new ATOM 0 HA GLU A 69 14.175 -16.731 -21.953 1.00 71.21 H new ATOM 0 HB2 GLU A 69 15.553 -14.734 -22.038 1.00 4.33 H new ATOM 0 HB3 GLU A 69 16.129 -14.994 -20.403 1.00 4.33 H new ATOM 0 HG2 GLU A 69 17.856 -15.646 -21.969 1.00 72.01 H new ATOM 0 HG3 GLU A 69 17.271 -17.071 -21.133 1.00 72.01 H new ATOM 1176 N LEU A 70 15.174 -17.292 -18.857 1.00 0.00 N ATOM 1177 CA LEU A 70 15.551 -18.343 -17.918 1.00 14.34 C ATOM 1178 C LEU A 70 14.357 -19.235 -17.592 1.00 22.03 C ATOM 1179 O LEU A 70 14.517 -20.421 -17.307 1.00 23.25 O ATOM 1180 CB LEU A 70 16.109 -17.729 -16.632 1.00 51.15 C ATOM 1181 CG LEU A 70 15.305 -16.573 -16.037 1.00 3.45 C ATOM 1182 CD1 LEU A 70 14.222 -17.098 -15.108 1.00 31.43 C ATOM 1183 CD2 LEU A 70 16.223 -15.610 -15.297 1.00 64.32 C ATOM 0 H LEU A 70 15.081 -16.366 -18.439 1.00 0.00 H new ATOM 0 HA LEU A 70 16.322 -18.955 -18.386 1.00 14.34 H new ATOM 0 HB2 LEU A 70 16.187 -18.516 -15.881 1.00 51.15 H new ATOM 0 HB3 LEU A 70 17.121 -17.377 -16.831 1.00 51.15 H new ATOM 0 HG LEU A 70 14.825 -16.033 -16.853 1.00 3.45 H new ATOM 0 HD11 LEU A 70 13.660 -16.261 -14.694 1.00 31.43 H new ATOM 0 HD12 LEU A 70 13.547 -17.747 -15.666 1.00 31.43 H new ATOM 0 HD13 LEU A 70 14.681 -17.663 -14.297 1.00 31.43 H new ATOM 0 HD21 LEU A 70 15.634 -14.793 -14.880 1.00 64.32 H new ATOM 0 HD22 LEU A 70 16.732 -16.139 -14.491 1.00 64.32 H new ATOM 0 HD23 LEU A 70 16.962 -15.207 -15.990 1.00 64.32 H new ATOM 1195 N GLU A 71 13.161 -18.656 -17.638 1.00 45.05 N ATOM 1196 CA GLU A 71 11.941 -19.400 -17.349 1.00 63.14 C ATOM 1197 C GLU A 71 11.661 -20.430 -18.440 1.00 13.00 C ATOM 1198 O GLU A 71 11.167 -21.523 -18.164 1.00 1.11 O ATOM 1199 CB GLU A 71 10.754 -18.444 -17.218 1.00 33.45 C ATOM 1200 CG GLU A 71 9.454 -19.137 -16.844 1.00 13.30 C ATOM 1201 CD GLU A 71 8.239 -18.255 -17.063 1.00 25.23 C ATOM 1202 OE1 GLU A 71 8.170 -17.594 -18.120 1.00 73.42 O ATOM 1203 OE2 GLU A 71 7.360 -18.226 -16.177 1.00 53.31 O ATOM 0 H GLU A 71 13.011 -17.675 -17.873 1.00 45.05 H new ATOM 0 HA GLU A 71 12.081 -19.926 -16.404 1.00 63.14 H new ATOM 0 HB2 GLU A 71 10.985 -17.692 -16.464 1.00 33.45 H new ATOM 0 HB3 GLU A 71 10.617 -17.917 -18.162 1.00 33.45 H new ATOM 0 HG2 GLU A 71 9.349 -20.047 -17.434 1.00 13.30 H new ATOM 0 HG3 GLU A 71 9.495 -19.439 -15.797 1.00 13.30 H new ATOM 1210 N MET A 72 11.979 -20.072 -19.680 1.00 11.24 N ATOM 1211 CA MET A 72 11.762 -20.965 -20.812 1.00 51.41 C ATOM 1212 C MET A 72 12.967 -21.875 -21.025 1.00 71.41 C ATOM 1213 O MET A 72 12.884 -22.876 -21.738 1.00 12.11 O ATOM 1214 CB MET A 72 11.489 -20.156 -22.082 1.00 14.24 C ATOM 1215 CG MET A 72 12.735 -19.522 -22.679 1.00 32.34 C ATOM 1216 SD MET A 72 12.375 -18.520 -24.134 1.00 4.35 S ATOM 1217 CE MET A 72 13.205 -19.465 -25.409 1.00 51.42 C ATOM 0 H MET A 72 12.388 -19.170 -19.926 1.00 11.24 H new ATOM 0 HA MET A 72 10.894 -21.586 -20.592 1.00 51.41 H new ATOM 0 HB2 MET A 72 11.031 -20.807 -22.826 1.00 14.24 H new ATOM 0 HB3 MET A 72 10.766 -19.373 -21.855 1.00 14.24 H new ATOM 0 HG2 MET A 72 13.219 -18.901 -21.925 1.00 32.34 H new ATOM 0 HG3 MET A 72 13.443 -20.306 -22.948 1.00 32.34 H new ATOM 0 HE1 MET A 72 13.073 -18.971 -26.372 1.00 51.42 H new ATOM 0 HE2 MET A 72 14.268 -19.532 -25.178 1.00 51.42 H new ATOM 0 HE3 MET A 72 12.779 -20.467 -25.454 1.00 51.42 H new ATOM 1227 N LYS A 73 14.087 -21.523 -20.403 1.00 13.20 N ATOM 1228 CA LYS A 73 15.309 -22.308 -20.523 1.00 62.31 C ATOM 1229 C LYS A 73 15.362 -23.398 -19.457 1.00 64.34 C ATOM 1230 O LYS A 73 16.160 -24.331 -19.549 1.00 50.15 O ATOM 1231 CB LYS A 73 16.536 -21.402 -20.402 1.00 43.23 C ATOM 1232 CG LYS A 73 16.992 -20.815 -21.727 1.00 71.21 C ATOM 1233 CD LYS A 73 18.476 -21.046 -21.958 1.00 50.41 C ATOM 1234 CE LYS A 73 18.765 -21.407 -23.407 1.00 70.10 C ATOM 1235 NZ LYS A 73 18.386 -22.814 -23.714 1.00 31.11 N ATOM 0 H LYS A 73 14.173 -20.698 -19.810 1.00 13.20 H new ATOM 0 HA LYS A 73 15.311 -22.783 -21.504 1.00 62.31 H new ATOM 0 HB2 LYS A 73 16.310 -20.589 -19.712 1.00 43.23 H new ATOM 0 HB3 LYS A 73 17.356 -21.972 -19.965 1.00 43.23 H new ATOM 0 HG2 LYS A 73 16.422 -21.264 -22.540 1.00 71.21 H new ATOM 0 HG3 LYS A 73 16.782 -19.745 -21.744 1.00 71.21 H new ATOM 0 HD2 LYS A 73 19.031 -20.148 -21.688 1.00 50.41 H new ATOM 0 HD3 LYS A 73 18.827 -21.846 -21.306 1.00 50.41 H new ATOM 0 HE2 LYS A 73 18.219 -20.732 -24.065 1.00 70.10 H new ATOM 0 HE3 LYS A 73 19.826 -21.263 -23.612 1.00 70.10 H new ATOM 0 HZ1 LYS A 73 18.598 -23.021 -24.711 1.00 31.11 H new ATOM 0 HZ2 LYS A 73 18.926 -23.460 -23.103 1.00 31.11 H new ATOM 0 HZ3 LYS A 73 17.369 -22.945 -23.542 1.00 31.11 H new ATOM 1249 N ALA A 74 14.507 -23.275 -18.448 1.00 2.43 N ATOM 1250 CA ALA A 74 14.455 -24.251 -17.367 1.00 31.21 C ATOM 1251 C ALA A 74 13.835 -25.561 -17.840 1.00 74.33 C ATOM 1252 O ALA A 74 13.739 -26.524 -17.080 1.00 22.55 O ATOM 1253 CB ALA A 74 13.674 -23.691 -16.187 1.00 23.40 C ATOM 0 H ALA A 74 13.840 -22.509 -18.356 1.00 2.43 H new ATOM 0 HA ALA A 74 15.477 -24.457 -17.047 1.00 31.21 H new ATOM 0 HB1 ALA A 74 13.643 -24.431 -15.387 1.00 23.40 H new ATOM 0 HB2 ALA A 74 14.161 -22.785 -15.825 1.00 23.40 H new ATOM 0 HB3 ALA A 74 12.658 -23.455 -16.502 1.00 23.40 H new ATOM 1259 N ARG A 75 13.414 -25.590 -19.101 1.00 13.04 N ATOM 1260 CA ARG A 75 12.801 -26.782 -19.674 1.00 54.34 C ATOM 1261 C ARG A 75 11.739 -27.352 -18.738 1.00 2.41 C ATOM 1262 O ARG A 75 11.606 -28.568 -18.599 1.00 4.31 O ATOM 1263 CB ARG A 75 13.866 -27.842 -19.961 1.00 13.24 C ATOM 1264 CG ARG A 75 13.641 -28.596 -21.261 1.00 54.20 C ATOM 1265 CD ARG A 75 14.363 -29.934 -21.261 1.00 42.14 C ATOM 1266 NE ARG A 75 13.999 -30.752 -22.415 1.00 34.55 N ATOM 1267 CZ ARG A 75 12.814 -31.336 -22.556 1.00 53.15 C ATOM 1268 NH1 ARG A 75 11.884 -31.191 -21.623 1.00 33.24 N ATOM 1269 NH2 ARG A 75 12.557 -32.066 -23.635 1.00 11.44 N ATOM 0 H ARG A 75 13.486 -24.802 -19.744 1.00 13.04 H new ATOM 0 HA ARG A 75 12.320 -26.498 -20.610 1.00 54.34 H new ATOM 0 HB2 ARG A 75 14.844 -27.362 -19.994 1.00 13.24 H new ATOM 0 HB3 ARG A 75 13.888 -28.555 -19.137 1.00 13.24 H new ATOM 0 HG2 ARG A 75 12.573 -28.758 -21.409 1.00 54.20 H new ATOM 0 HG3 ARG A 75 13.991 -27.992 -22.098 1.00 54.20 H new ATOM 0 HD2 ARG A 75 15.440 -29.765 -21.262 1.00 42.14 H new ATOM 0 HD3 ARG A 75 14.126 -30.474 -20.344 1.00 42.14 H new ATOM 0 HE ARG A 75 14.692 -30.882 -23.152 1.00 34.55 H new ATOM 0 HH11 ARG A 75 12.077 -30.630 -20.794 1.00 33.24 H new ATOM 0 HH12 ARG A 75 10.975 -31.641 -21.734 1.00 33.24 H new ATOM 0 HH21 ARG A 75 13.270 -32.179 -24.356 1.00 11.44 H new ATOM 0 HH22 ARG A 75 11.647 -32.514 -23.743 1.00 11.44 H new ATOM 1283 N LYS A 76 10.986 -26.465 -18.097 1.00 15.21 N ATOM 1284 CA LYS A 76 9.935 -26.878 -17.174 1.00 0.32 C ATOM 1285 C LYS A 76 9.234 -25.665 -16.569 1.00 63.15 C ATOM 1286 O LYS A 76 9.666 -24.528 -16.760 1.00 23.11 O ATOM 1287 CB LYS A 76 10.520 -27.750 -16.060 1.00 52.43 C ATOM 1288 CG LYS A 76 9.791 -29.069 -15.875 1.00 32.12 C ATOM 1289 CD LYS A 76 10.207 -29.760 -14.587 1.00 0.21 C ATOM 1290 CE LYS A 76 9.305 -30.944 -14.273 1.00 1.43 C ATOM 1291 NZ LYS A 76 9.412 -32.012 -15.305 1.00 51.50 N ATOM 0 H LYS A 76 11.084 -25.455 -18.200 1.00 15.21 H new ATOM 0 HA LYS A 76 9.201 -27.458 -17.734 1.00 0.32 H new ATOM 0 HB2 LYS A 76 11.568 -27.952 -16.280 1.00 52.43 H new ATOM 0 HB3 LYS A 76 10.492 -27.194 -15.123 1.00 52.43 H new ATOM 0 HG2 LYS A 76 8.715 -28.893 -15.863 1.00 32.12 H new ATOM 0 HG3 LYS A 76 9.998 -29.722 -16.723 1.00 32.12 H new ATOM 0 HD2 LYS A 76 11.239 -30.100 -14.672 1.00 0.21 H new ATOM 0 HD3 LYS A 76 10.173 -29.047 -13.763 1.00 0.21 H new ATOM 0 HE2 LYS A 76 9.569 -31.353 -13.298 1.00 1.43 H new ATOM 0 HE3 LYS A 76 8.271 -30.605 -14.207 1.00 1.43 H new ATOM 0 HZ1 LYS A 76 8.835 -32.829 -15.020 1.00 51.50 H new ATOM 0 HZ2 LYS A 76 9.071 -31.648 -16.218 1.00 51.50 H new ATOM 0 HZ3 LYS A 76 10.405 -32.306 -15.399 1.00 51.50 H new ATOM 1305 N ARG A 77 8.152 -25.915 -15.840 1.00 22.53 N ATOM 1306 CA ARG A 77 7.392 -24.844 -15.207 1.00 44.13 C ATOM 1307 C ARG A 77 7.520 -24.910 -13.688 1.00 70.22 C ATOM 1308 O ARG A 77 6.728 -25.573 -13.016 1.00 43.32 O ATOM 1309 CB ARG A 77 5.919 -24.928 -15.610 1.00 70.12 C ATOM 1310 CG ARG A 77 5.344 -26.333 -15.527 1.00 43.24 C ATOM 1311 CD ARG A 77 3.924 -26.387 -16.069 1.00 3.41 C ATOM 1312 NE ARG A 77 2.978 -26.883 -15.074 1.00 34.01 N ATOM 1313 CZ ARG A 77 2.454 -26.127 -14.116 1.00 4.55 C ATOM 1314 NH1 ARG A 77 2.784 -24.846 -14.023 1.00 50.44 N ATOM 1315 NH2 ARG A 77 1.599 -26.651 -13.247 1.00 62.01 N ATOM 0 H ARG A 77 7.781 -26.851 -15.673 1.00 22.53 H new ATOM 0 HA ARG A 77 7.801 -23.893 -15.547 1.00 44.13 H new ATOM 0 HB2 ARG A 77 5.337 -24.268 -14.967 1.00 70.12 H new ATOM 0 HB3 ARG A 77 5.808 -24.559 -16.630 1.00 70.12 H new ATOM 0 HG2 ARG A 77 5.976 -27.020 -16.090 1.00 43.24 H new ATOM 0 HG3 ARG A 77 5.352 -26.670 -14.490 1.00 43.24 H new ATOM 0 HD2 ARG A 77 3.621 -25.391 -16.392 1.00 3.41 H new ATOM 0 HD3 ARG A 77 3.896 -27.030 -16.949 1.00 3.41 H new ATOM 0 HE ARG A 77 2.704 -27.865 -15.117 1.00 34.01 H new ATOM 0 HH11 ARG A 77 3.442 -24.439 -14.688 1.00 50.44 H new ATOM 0 HH12 ARG A 77 2.380 -24.268 -13.286 1.00 50.44 H new ATOM 0 HH21 ARG A 77 1.343 -27.636 -13.314 1.00 62.01 H new ATOM 0 HH22 ARG A 77 1.198 -26.069 -12.512 1.00 62.01 H new ATOM 1329 N LEU A 78 8.521 -24.220 -13.153 1.00 62.33 N ATOM 1330 CA LEU A 78 8.753 -24.201 -11.713 1.00 44.32 C ATOM 1331 C LEU A 78 7.478 -23.836 -10.961 1.00 33.12 C ATOM 1332 O LEU A 78 6.537 -23.273 -11.521 1.00 32.12 O ATOM 1333 CB LEU A 78 9.864 -23.206 -11.369 1.00 72.42 C ATOM 1334 CG LEU A 78 11.291 -23.755 -11.403 1.00 35.53 C ATOM 1335 CD1 LEU A 78 11.516 -24.579 -12.661 1.00 43.54 C ATOM 1336 CD2 LEU A 78 12.301 -22.621 -11.317 1.00 12.32 C ATOM 0 H LEU A 78 9.185 -23.666 -13.694 1.00 62.33 H new ATOM 0 HA LEU A 78 9.060 -25.201 -11.406 1.00 44.32 H new ATOM 0 HB2 LEU A 78 9.802 -22.368 -12.063 1.00 72.42 H new ATOM 0 HB3 LEU A 78 9.673 -22.809 -10.372 1.00 72.42 H new ATOM 0 HG LEU A 78 11.431 -24.405 -10.539 1.00 35.53 H new ATOM 0 HD11 LEU A 78 12.537 -24.961 -12.668 1.00 43.54 H new ATOM 0 HD12 LEU A 78 10.816 -25.414 -12.679 1.00 43.54 H new ATOM 0 HD13 LEU A 78 11.357 -23.953 -13.539 1.00 43.54 H new ATOM 0 HD21 LEU A 78 13.311 -23.030 -11.343 1.00 12.32 H new ATOM 0 HD22 LEU A 78 12.162 -21.945 -12.161 1.00 12.32 H new ATOM 0 HD23 LEU A 78 12.155 -22.074 -10.386 1.00 12.32 H new ATOM 1348 N PRO A 79 7.444 -24.162 -9.660 1.00 51.21 N ATOM 1349 CA PRO A 79 6.290 -23.875 -8.802 1.00 63.51 C ATOM 1350 C PRO A 79 6.124 -22.384 -8.533 1.00 53.35 C ATOM 1351 O PRO A 79 5.024 -21.840 -8.647 1.00 65.25 O ATOM 1352 CB PRO A 79 6.620 -24.619 -7.505 1.00 53.21 C ATOM 1353 CG PRO A 79 8.106 -24.712 -7.489 1.00 5.31 C ATOM 1354 CD PRO A 79 8.529 -24.834 -8.927 1.00 24.23 C ATOM 0 HA PRO A 79 5.352 -24.186 -9.262 1.00 63.51 H new ATOM 0 HB2 PRO A 79 6.248 -24.080 -6.634 1.00 53.21 H new ATOM 0 HB3 PRO A 79 6.161 -25.608 -7.488 1.00 53.21 H new ATOM 0 HG2 PRO A 79 8.547 -23.829 -7.026 1.00 5.31 H new ATOM 0 HG3 PRO A 79 8.437 -25.575 -6.910 1.00 5.31 H new ATOM 0 HD2 PRO A 79 9.491 -24.354 -9.105 1.00 24.23 H new ATOM 0 HD3 PRO A 79 8.632 -25.876 -9.228 1.00 24.23 H new ATOM 1362 N THR A 80 7.222 -21.725 -8.176 1.00 71.02 N ATOM 1363 CA THR A 80 7.197 -20.296 -7.891 1.00 22.12 C ATOM 1364 C THR A 80 7.420 -19.478 -9.158 1.00 31.32 C ATOM 1365 O THR A 80 7.980 -19.971 -10.138 1.00 34.42 O ATOM 1366 CB THR A 80 8.267 -19.912 -6.851 1.00 71.30 C ATOM 1367 OG1 THR A 80 8.411 -20.961 -5.886 1.00 52.34 O ATOM 1368 CG2 THR A 80 7.897 -18.616 -6.147 1.00 14.31 C ATOM 0 H THR A 80 8.140 -22.159 -8.077 1.00 71.02 H new ATOM 0 HA THR A 80 6.210 -20.072 -7.486 1.00 22.12 H new ATOM 0 HB THR A 80 9.213 -19.766 -7.373 1.00 71.30 H new ATOM 0 HG1 THR A 80 9.304 -20.917 -5.486 1.00 52.34 H new ATOM 0 HG21 THR A 80 8.667 -18.365 -5.418 1.00 14.31 H new ATOM 0 HG22 THR A 80 7.817 -17.814 -6.880 1.00 14.31 H new ATOM 0 HG23 THR A 80 6.941 -18.739 -5.638 1.00 14.31 H new ATOM 1376 N THR A 81 6.979 -18.224 -9.133 1.00 30.34 N ATOM 1377 CA THR A 81 7.130 -17.338 -10.280 1.00 12.15 C ATOM 1378 C THR A 81 8.048 -16.166 -9.952 1.00 11.13 C ATOM 1379 O THR A 81 8.651 -15.568 -10.844 1.00 1.02 O ATOM 1380 CB THR A 81 5.769 -16.793 -10.751 1.00 54.41 C ATOM 1381 OG1 THR A 81 4.770 -17.814 -10.651 1.00 22.25 O ATOM 1382 CG2 THR A 81 5.852 -16.298 -12.187 1.00 50.51 C ATOM 0 H THR A 81 6.514 -17.799 -8.330 1.00 30.34 H new ATOM 0 HA THR A 81 7.573 -17.930 -11.081 1.00 12.15 H new ATOM 0 HB THR A 81 5.497 -15.955 -10.109 1.00 54.41 H new ATOM 0 HG1 THR A 81 3.907 -17.458 -10.951 1.00 22.25 H new ATOM 0 HG21 THR A 81 4.879 -15.918 -12.498 1.00 50.51 H new ATOM 0 HG22 THR A 81 6.592 -15.500 -12.255 1.00 50.51 H new ATOM 0 HG23 THR A 81 6.145 -17.121 -12.839 1.00 50.51 H new ATOM 1390 N LEU A 82 8.150 -15.842 -8.667 1.00 65.34 N ATOM 1391 CA LEU A 82 8.997 -14.741 -8.221 1.00 72.02 C ATOM 1392 C LEU A 82 10.366 -15.250 -7.783 1.00 3.21 C ATOM 1393 O LEU A 82 10.654 -15.340 -6.589 1.00 51.01 O ATOM 1394 CB LEU A 82 8.326 -13.991 -7.069 1.00 41.10 C ATOM 1395 CG LEU A 82 7.509 -12.758 -7.456 1.00 51.14 C ATOM 1396 CD1 LEU A 82 6.928 -12.092 -6.219 1.00 3.23 C ATOM 1397 CD2 LEU A 82 8.366 -11.775 -8.241 1.00 33.10 C ATOM 0 H LEU A 82 7.657 -16.326 -7.916 1.00 65.34 H new ATOM 0 HA LEU A 82 9.136 -14.058 -9.059 1.00 72.02 H new ATOM 0 HB2 LEU A 82 7.671 -14.685 -6.543 1.00 41.10 H new ATOM 0 HB3 LEU A 82 9.098 -13.684 -6.364 1.00 41.10 H new ATOM 0 HG LEU A 82 6.684 -13.078 -8.092 1.00 51.14 H new ATOM 0 HD11 LEU A 82 6.350 -11.216 -6.515 1.00 3.23 H new ATOM 0 HD12 LEU A 82 6.279 -12.796 -5.697 1.00 3.23 H new ATOM 0 HD13 LEU A 82 7.738 -11.785 -5.557 1.00 3.23 H new ATOM 0 HD21 LEU A 82 7.768 -10.904 -8.508 1.00 33.10 H new ATOM 0 HD22 LEU A 82 9.212 -11.461 -7.630 1.00 33.10 H new ATOM 0 HD23 LEU A 82 8.732 -12.255 -9.148 1.00 33.10 H new ATOM 1409 N PHE A 83 11.209 -15.579 -8.756 1.00 73.34 N ATOM 1410 CA PHE A 83 12.549 -16.078 -8.471 1.00 42.23 C ATOM 1411 C PHE A 83 13.590 -15.356 -9.322 1.00 62.22 C ATOM 1412 O PHE A 83 13.274 -14.404 -10.035 1.00 54.32 O ATOM 1413 CB PHE A 83 12.621 -17.585 -8.727 1.00 11.32 C ATOM 1414 CG PHE A 83 12.008 -18.001 -10.033 1.00 73.11 C ATOM 1415 CD1 PHE A 83 12.292 -17.309 -11.199 1.00 42.50 C ATOM 1416 CD2 PHE A 83 11.147 -19.085 -10.095 1.00 63.34 C ATOM 1417 CE1 PHE A 83 11.729 -17.689 -12.402 1.00 74.22 C ATOM 1418 CE2 PHE A 83 10.581 -19.471 -11.296 1.00 10.01 C ATOM 1419 CZ PHE A 83 10.873 -18.772 -12.451 1.00 30.51 C ATOM 0 H PHE A 83 10.988 -15.509 -9.749 1.00 73.34 H new ATOM 0 HA PHE A 83 12.766 -15.885 -7.420 1.00 42.23 H new ATOM 0 HB2 PHE A 83 13.665 -17.899 -8.708 1.00 11.32 H new ATOM 0 HB3 PHE A 83 12.116 -18.108 -7.915 1.00 11.32 H new ATOM 0 HD1 PHE A 83 12.962 -16.462 -11.167 1.00 42.50 H new ATOM 0 HD2 PHE A 83 10.915 -19.635 -9.195 1.00 63.34 H new ATOM 0 HE1 PHE A 83 11.958 -17.140 -13.303 1.00 74.22 H new ATOM 0 HE2 PHE A 83 9.912 -20.318 -11.331 1.00 10.01 H new ATOM 0 HZ PHE A 83 10.433 -19.072 -13.391 1.00 30.51 H new ATOM 1429 N PHE A 84 14.834 -15.817 -9.241 1.00 41.23 N ATOM 1430 CA PHE A 84 15.923 -15.215 -10.002 1.00 60.31 C ATOM 1431 C PHE A 84 17.078 -16.198 -10.169 1.00 30.52 C ATOM 1432 O PHE A 84 17.131 -17.229 -9.497 1.00 62.33 O ATOM 1433 CB PHE A 84 16.417 -13.944 -9.308 1.00 73.13 C ATOM 1434 CG PHE A 84 17.107 -14.205 -8.000 1.00 44.33 C ATOM 1435 CD1 PHE A 84 18.330 -14.855 -7.965 1.00 3.11 C ATOM 1436 CD2 PHE A 84 16.533 -13.800 -6.806 1.00 3.21 C ATOM 1437 CE1 PHE A 84 18.969 -15.096 -6.763 1.00 12.01 C ATOM 1438 CE2 PHE A 84 17.167 -14.038 -5.601 1.00 42.31 C ATOM 1439 CZ PHE A 84 18.386 -14.688 -5.579 1.00 52.34 C ATOM 0 H PHE A 84 15.113 -16.605 -8.656 1.00 41.23 H new ATOM 0 HA PHE A 84 15.543 -14.957 -10.990 1.00 60.31 H new ATOM 0 HB2 PHE A 84 17.103 -13.420 -9.973 1.00 73.13 H new ATOM 0 HB3 PHE A 84 15.569 -13.280 -9.137 1.00 73.13 H new ATOM 0 HD1 PHE A 84 18.790 -15.177 -8.888 1.00 3.11 H new ATOM 0 HD2 PHE A 84 15.580 -13.293 -6.817 1.00 3.21 H new ATOM 0 HE1 PHE A 84 19.923 -15.603 -6.750 1.00 12.01 H new ATOM 0 HE2 PHE A 84 16.710 -13.716 -4.677 1.00 42.31 H new ATOM 0 HZ PHE A 84 18.882 -14.877 -4.638 1.00 52.34 H new ATOM 1449 N ILE A 85 18.000 -15.872 -11.069 1.00 34.15 N ATOM 1450 CA ILE A 85 19.154 -16.725 -11.323 1.00 74.44 C ATOM 1451 C ILE A 85 20.401 -16.183 -10.635 1.00 43.40 C ATOM 1452 O ILE A 85 20.612 -14.972 -10.575 1.00 53.25 O ATOM 1453 CB ILE A 85 19.431 -16.861 -12.832 1.00 42.22 C ATOM 1454 CG1 ILE A 85 19.861 -15.514 -13.417 1.00 5.12 C ATOM 1455 CG2 ILE A 85 18.199 -17.388 -13.552 1.00 51.53 C ATOM 1456 CD1 ILE A 85 20.271 -15.589 -14.871 1.00 74.31 C ATOM 0 H ILE A 85 17.970 -15.023 -11.634 1.00 34.15 H new ATOM 0 HA ILE A 85 18.916 -17.707 -10.915 1.00 74.44 H new ATOM 0 HB ILE A 85 20.243 -17.574 -12.974 1.00 42.22 H new ATOM 0 HG12 ILE A 85 19.040 -14.804 -13.316 1.00 5.12 H new ATOM 0 HG13 ILE A 85 20.694 -15.123 -12.833 1.00 5.12 H new ATOM 0 HG21 ILE A 85 18.411 -17.478 -14.617 1.00 51.53 H new ATOM 0 HG22 ILE A 85 17.934 -18.366 -13.151 1.00 51.53 H new ATOM 0 HG23 ILE A 85 17.368 -16.698 -13.405 1.00 51.53 H new ATOM 0 HD11 ILE A 85 20.563 -14.598 -15.218 1.00 74.31 H new ATOM 0 HD12 ILE A 85 21.113 -16.273 -14.977 1.00 74.31 H new ATOM 0 HD13 ILE A 85 19.433 -15.950 -15.467 1.00 74.31 H new ATOM 1468 N GLU A 86 21.226 -17.088 -10.118 1.00 45.30 N ATOM 1469 CA GLU A 86 22.454 -16.699 -9.435 1.00 5.13 C ATOM 1470 C GLU A 86 23.346 -15.864 -10.350 1.00 73.41 C ATOM 1471 O GLU A 86 24.161 -15.067 -9.885 1.00 14.22 O ATOM 1472 CB GLU A 86 23.214 -17.939 -8.958 1.00 15.14 C ATOM 1473 CG GLU A 86 24.454 -17.617 -8.142 1.00 44.40 C ATOM 1474 CD GLU A 86 24.440 -18.272 -6.775 1.00 24.32 C ATOM 1475 OE1 GLU A 86 23.593 -17.889 -5.941 1.00 65.31 O ATOM 1476 OE2 GLU A 86 25.277 -19.169 -6.539 1.00 70.32 O ATOM 0 H GLU A 86 21.066 -18.095 -10.159 1.00 45.30 H new ATOM 0 HA GLU A 86 22.181 -16.093 -8.571 1.00 5.13 H new ATOM 0 HB2 GLU A 86 22.545 -18.556 -8.358 1.00 15.14 H new ATOM 0 HB3 GLU A 86 23.504 -18.533 -9.825 1.00 15.14 H new ATOM 0 HG2 GLU A 86 25.339 -17.944 -8.688 1.00 44.40 H new ATOM 0 HG3 GLU A 86 24.535 -16.537 -8.022 1.00 44.40 H new ATOM 1483 N THR A 87 23.185 -16.054 -11.656 1.00 64.42 N ATOM 1484 CA THR A 87 23.975 -15.322 -12.638 1.00 4.24 C ATOM 1485 C THR A 87 23.508 -13.875 -12.750 1.00 64.12 C ATOM 1486 O THR A 87 24.128 -13.064 -13.439 1.00 25.53 O ATOM 1487 CB THR A 87 23.900 -15.983 -14.027 1.00 34.44 C ATOM 1488 OG1 THR A 87 23.043 -17.130 -13.977 1.00 51.21 O ATOM 1489 CG2 THR A 87 25.283 -16.398 -14.505 1.00 31.02 C ATOM 0 H THR A 87 22.514 -16.709 -12.058 1.00 64.42 H new ATOM 0 HA THR A 87 25.008 -15.342 -12.291 1.00 4.24 H new ATOM 0 HB THR A 87 23.494 -15.256 -14.730 1.00 34.44 H new ATOM 0 HG1 THR A 87 22.999 -17.544 -14.864 1.00 51.21 H new ATOM 0 HG21 THR A 87 25.204 -16.862 -15.488 1.00 31.02 H new ATOM 0 HG22 THR A 87 25.925 -15.519 -14.569 1.00 31.02 H new ATOM 0 HG23 THR A 87 25.713 -17.110 -13.801 1.00 31.02 H new ATOM 1497 N ASP A 88 22.413 -13.558 -12.070 1.00 13.53 N ATOM 1498 CA ASP A 88 21.863 -12.207 -12.092 1.00 3.20 C ATOM 1499 C ASP A 88 22.212 -11.457 -10.810 1.00 30.21 C ATOM 1500 O ASP A 88 22.116 -10.231 -10.751 1.00 14.02 O ATOM 1501 CB ASP A 88 20.345 -12.254 -12.273 1.00 44.44 C ATOM 1502 CG ASP A 88 19.778 -10.930 -12.747 1.00 71.13 C ATOM 1503 OD1 ASP A 88 19.693 -9.993 -11.926 1.00 73.41 O ATOM 1504 OD2 ASP A 88 19.418 -10.831 -13.939 1.00 61.14 O ATOM 0 H ASP A 88 21.888 -14.218 -11.496 1.00 13.53 H new ATOM 0 HA ASP A 88 22.305 -11.675 -12.934 1.00 3.20 H new ATOM 0 HB2 ASP A 88 20.092 -13.033 -12.992 1.00 44.44 H new ATOM 0 HB3 ASP A 88 19.877 -12.529 -11.327 1.00 44.44 H new ATOM 1509 N ILE A 89 22.616 -12.202 -9.786 1.00 51.14 N ATOM 1510 CA ILE A 89 22.979 -11.607 -8.506 1.00 34.41 C ATOM 1511 C ILE A 89 24.481 -11.700 -8.263 1.00 21.03 C ATOM 1512 O ILE A 89 25.092 -10.773 -7.731 1.00 64.01 O ATOM 1513 CB ILE A 89 22.238 -12.288 -7.339 1.00 41.14 C ATOM 1514 CG1 ILE A 89 20.773 -12.529 -7.708 1.00 71.12 C ATOM 1515 CG2 ILE A 89 22.340 -11.440 -6.080 1.00 45.25 C ATOM 1516 CD1 ILE A 89 20.016 -11.261 -8.038 1.00 63.51 C ATOM 0 H ILE A 89 22.700 -13.218 -9.818 1.00 51.14 H new ATOM 0 HA ILE A 89 22.685 -10.558 -8.550 1.00 34.41 H new ATOM 0 HB ILE A 89 22.707 -13.252 -7.143 1.00 41.14 H new ATOM 0 HG12 ILE A 89 20.728 -13.202 -8.564 1.00 71.12 H new ATOM 0 HG13 ILE A 89 20.276 -13.034 -6.879 1.00 71.12 H new ATOM 0 HG21 ILE A 89 21.812 -11.934 -5.265 1.00 45.25 H new ATOM 0 HG22 ILE A 89 23.388 -11.315 -5.810 1.00 45.25 H new ATOM 0 HG23 ILE A 89 21.893 -10.463 -6.262 1.00 45.25 H new ATOM 0 HD11 ILE A 89 18.985 -11.508 -8.290 1.00 63.51 H new ATOM 0 HD12 ILE A 89 20.029 -10.595 -7.176 1.00 63.51 H new ATOM 0 HD13 ILE A 89 20.488 -10.766 -8.886 1.00 63.51 H new ATOM 1528 N ARG A 90 25.071 -12.824 -8.657 1.00 14.01 N ATOM 1529 CA ARG A 90 26.502 -13.038 -8.482 1.00 42.34 C ATOM 1530 C ARG A 90 27.297 -11.838 -8.991 1.00 31.51 C ATOM 1531 O ARG A 90 28.053 -11.206 -8.253 1.00 50.25 O ATOM 1532 CB ARG A 90 26.944 -14.305 -9.218 1.00 14.54 C ATOM 1533 CG ARG A 90 28.376 -14.247 -9.723 1.00 70.51 C ATOM 1534 CD ARG A 90 28.879 -15.624 -10.129 1.00 74.02 C ATOM 1535 NE ARG A 90 28.741 -15.856 -11.564 1.00 54.45 N ATOM 1536 CZ ARG A 90 29.111 -16.980 -12.166 1.00 61.44 C ATOM 1537 NH1 ARG A 90 29.639 -17.971 -11.461 1.00 32.13 N ATOM 1538 NH2 ARG A 90 28.953 -17.116 -13.477 1.00 24.01 N ATOM 0 H ARG A 90 24.580 -13.601 -9.100 1.00 14.01 H new ATOM 0 HA ARG A 90 26.699 -13.158 -7.417 1.00 42.34 H new ATOM 0 HB2 ARG A 90 26.838 -15.159 -8.549 1.00 14.54 H new ATOM 0 HB3 ARG A 90 26.276 -14.476 -10.062 1.00 14.54 H new ATOM 0 HG2 ARG A 90 28.435 -13.571 -10.576 1.00 70.51 H new ATOM 0 HG3 ARG A 90 29.021 -13.837 -8.946 1.00 70.51 H new ATOM 0 HD2 ARG A 90 29.926 -15.726 -9.844 1.00 74.02 H new ATOM 0 HD3 ARG A 90 28.325 -16.388 -9.583 1.00 74.02 H new ATOM 0 HE ARG A 90 28.338 -15.113 -12.136 1.00 54.45 H new ATOM 0 HH11 ARG A 90 29.762 -17.871 -10.453 1.00 32.13 H new ATOM 0 HH12 ARG A 90 29.922 -18.833 -11.926 1.00 32.13 H new ATOM 0 HH21 ARG A 90 28.547 -16.356 -14.023 1.00 24.01 H new ATOM 0 HH22 ARG A 90 29.238 -17.980 -13.938 1.00 24.01 H new ATOM 1552 N PRO A 91 27.123 -11.518 -10.282 1.00 5.33 N ATOM 1553 CA PRO A 91 27.816 -10.393 -10.918 1.00 13.12 C ATOM 1554 C PRO A 91 27.314 -9.044 -10.414 1.00 4.13 C ATOM 1555 O PRO A 91 27.735 -7.994 -10.900 1.00 34.33 O ATOM 1556 CB PRO A 91 27.484 -10.566 -12.402 1.00 42.11 C ATOM 1557 CG PRO A 91 26.200 -11.320 -12.418 1.00 32.51 C ATOM 1558 CD PRO A 91 26.238 -12.228 -11.220 1.00 31.05 C ATOM 0 HA PRO A 91 28.884 -10.398 -10.703 1.00 13.12 H new ATOM 0 HB2 PRO A 91 27.383 -9.602 -12.900 1.00 42.11 H new ATOM 0 HB3 PRO A 91 28.270 -11.113 -12.922 1.00 42.11 H new ATOM 0 HG2 PRO A 91 25.348 -10.642 -12.367 1.00 32.51 H new ATOM 0 HG3 PRO A 91 26.096 -11.893 -13.339 1.00 32.51 H new ATOM 0 HD2 PRO A 91 25.244 -12.379 -10.799 1.00 31.05 H new ATOM 0 HD3 PRO A 91 26.629 -13.213 -11.475 1.00 31.05 H new ATOM 1566 N MET A 92 26.414 -9.080 -9.437 1.00 4.24 N ATOM 1567 CA MET A 92 25.857 -7.859 -8.866 1.00 5.31 C ATOM 1568 C MET A 92 26.434 -7.595 -7.479 1.00 2.24 C ATOM 1569 O MET A 92 26.590 -6.444 -7.069 1.00 11.34 O ATOM 1570 CB MET A 92 24.333 -7.956 -8.787 1.00 73.50 C ATOM 1571 CG MET A 92 23.618 -7.211 -9.902 1.00 55.10 C ATOM 1572 SD MET A 92 22.222 -6.238 -9.304 1.00 22.35 S ATOM 1573 CE MET A 92 20.865 -7.024 -10.169 1.00 64.33 C ATOM 0 H MET A 92 26.055 -9.941 -9.024 1.00 4.24 H new ATOM 0 HA MET A 92 26.127 -7.027 -9.517 1.00 5.31 H new ATOM 0 HB2 MET A 92 24.042 -9.006 -8.818 1.00 73.50 H new ATOM 0 HB3 MET A 92 24.001 -7.561 -7.827 1.00 73.50 H new ATOM 0 HG2 MET A 92 24.326 -6.552 -10.406 1.00 55.10 H new ATOM 0 HG3 MET A 92 23.265 -7.927 -10.644 1.00 55.10 H new ATOM 0 HE1 MET A 92 19.930 -6.532 -9.902 1.00 64.33 H new ATOM 0 HE2 MET A 92 21.023 -6.943 -11.244 1.00 64.33 H new ATOM 0 HE3 MET A 92 20.815 -8.076 -9.888 1.00 64.33 H new ATOM 1583 N LEU A 93 26.749 -8.667 -6.760 1.00 41.21 N ATOM 1584 CA LEU A 93 27.309 -8.551 -5.418 1.00 13.22 C ATOM 1585 C LEU A 93 28.661 -7.846 -5.451 1.00 21.23 C ATOM 1586 O LEU A 93 28.741 -6.650 -5.730 1.00 63.42 O ATOM 1587 CB LEU A 93 27.457 -9.935 -4.785 1.00 24.34 C ATOM 1588 CG LEU A 93 26.162 -10.720 -4.575 1.00 60.33 C ATOM 1589 CD1 LEU A 93 26.466 -12.155 -4.171 1.00 44.45 C ATOM 1590 CD2 LEU A 93 25.291 -10.043 -3.527 1.00 41.35 C ATOM 0 H LEU A 93 26.626 -9.626 -7.084 1.00 41.21 H new ATOM 0 HA LEU A 93 26.624 -7.954 -4.815 1.00 13.22 H new ATOM 0 HB2 LEU A 93 28.121 -10.530 -5.412 1.00 24.34 H new ATOM 0 HB3 LEU A 93 27.949 -9.820 -3.819 1.00 24.34 H new ATOM 0 HG LEU A 93 25.615 -10.738 -5.517 1.00 60.33 H new ATOM 0 HD11 LEU A 93 25.532 -12.698 -4.026 1.00 44.45 H new ATOM 0 HD12 LEU A 93 27.049 -12.638 -4.955 1.00 44.45 H new ATOM 0 HD13 LEU A 93 27.036 -12.158 -3.242 1.00 44.45 H new ATOM 0 HD21 LEU A 93 24.374 -10.616 -3.391 1.00 41.35 H new ATOM 0 HD22 LEU A 93 25.831 -9.993 -2.582 1.00 41.35 H new ATOM 0 HD23 LEU A 93 25.043 -9.034 -3.857 1.00 41.35 H new ATOM 1602 N GLN A 94 29.721 -8.596 -5.165 1.00 75.35 N ATOM 1603 CA GLN A 94 31.070 -8.043 -5.164 1.00 74.11 C ATOM 1604 C GLN A 94 32.057 -9.014 -5.803 1.00 72.13 C ATOM 1605 O GLN A 94 32.077 -10.200 -5.474 1.00 25.22 O ATOM 1606 CB GLN A 94 31.509 -7.718 -3.735 1.00 54.44 C ATOM 1607 CG GLN A 94 31.568 -6.227 -3.442 1.00 21.32 C ATOM 1608 CD GLN A 94 32.805 -5.836 -2.657 1.00 53.01 C ATOM 1609 OE1 GLN A 94 33.171 -6.496 -1.684 1.00 42.41 O ATOM 1610 NE2 GLN A 94 33.456 -4.758 -3.077 1.00 50.40 N ATOM 0 H GLN A 94 29.671 -9.588 -4.931 1.00 75.35 H new ATOM 0 HA GLN A 94 31.060 -7.125 -5.752 1.00 74.11 H new ATOM 0 HB2 GLN A 94 30.820 -8.191 -3.035 1.00 54.44 H new ATOM 0 HB3 GLN A 94 32.492 -8.154 -3.557 1.00 54.44 H new ATOM 0 HG2 GLN A 94 31.549 -5.675 -4.382 1.00 21.32 H new ATOM 0 HG3 GLN A 94 30.679 -5.935 -2.882 1.00 21.32 H new ATOM 0 HE21 GLN A 94 33.117 -4.241 -3.888 1.00 50.40 H new ATOM 0 HE22 GLN A 94 34.295 -4.447 -2.588 1.00 50.40 H new ATOM 1619 N ASP A 95 32.873 -8.503 -6.719 1.00 32.35 N ATOM 1620 CA ASP A 95 33.863 -9.325 -7.404 1.00 25.32 C ATOM 1621 C ASP A 95 34.846 -9.935 -6.409 1.00 2.42 C ATOM 1622 O ASP A 95 35.495 -10.940 -6.699 1.00 11.05 O ATOM 1623 CB ASP A 95 34.619 -8.493 -8.441 1.00 11.30 C ATOM 1624 CG ASP A 95 35.128 -9.331 -9.597 1.00 71.10 C ATOM 1625 OD1 ASP A 95 34.299 -9.979 -10.269 1.00 61.33 O ATOM 1626 OD2 ASP A 95 36.355 -9.340 -9.829 1.00 2.21 O ATOM 0 H ASP A 95 32.868 -7.524 -7.004 1.00 32.35 H new ATOM 0 HA ASP A 95 33.338 -10.134 -7.911 1.00 25.32 H new ATOM 0 HB2 ASP A 95 33.963 -7.712 -8.824 1.00 11.30 H new ATOM 0 HB3 ASP A 95 35.460 -7.995 -7.959 1.00 11.30 H new ATOM 1631 N ARG A 96 34.951 -9.318 -5.236 1.00 24.40 N ATOM 1632 CA ARG A 96 35.857 -9.799 -4.199 1.00 53.31 C ATOM 1633 C ARG A 96 35.093 -10.567 -3.124 1.00 64.12 C ATOM 1634 O ARG A 96 35.688 -11.097 -2.185 1.00 32.44 O ATOM 1635 CB ARG A 96 36.609 -8.627 -3.566 1.00 40.31 C ATOM 1636 CG ARG A 96 35.709 -7.467 -3.173 1.00 2.51 C ATOM 1637 CD ARG A 96 36.497 -6.354 -2.499 1.00 41.12 C ATOM 1638 NE ARG A 96 37.252 -6.838 -1.347 1.00 21.33 N ATOM 1639 CZ ARG A 96 36.697 -7.138 -0.178 1.00 0.34 C ATOM 1640 NH1 ARG A 96 35.389 -7.003 -0.007 1.00 70.53 N ATOM 1641 NH2 ARG A 96 37.451 -7.573 0.824 1.00 13.10 N ATOM 0 H ARG A 96 34.421 -8.485 -4.980 1.00 24.40 H new ATOM 0 HA ARG A 96 36.575 -10.475 -4.663 1.00 53.31 H new ATOM 0 HB2 ARG A 96 37.138 -8.981 -2.681 1.00 40.31 H new ATOM 0 HB3 ARG A 96 37.363 -8.269 -4.267 1.00 40.31 H new ATOM 0 HG2 ARG A 96 35.210 -7.076 -4.060 1.00 2.51 H new ATOM 0 HG3 ARG A 96 34.929 -7.822 -2.499 1.00 2.51 H new ATOM 0 HD2 ARG A 96 37.182 -5.907 -3.220 1.00 41.12 H new ATOM 0 HD3 ARG A 96 35.813 -5.568 -2.180 1.00 41.12 H new ATOM 0 HE ARG A 96 38.261 -6.952 -1.445 1.00 21.33 H new ATOM 0 HH11 ARG A 96 34.806 -6.668 -0.774 1.00 70.53 H new ATOM 0 HH12 ARG A 96 34.966 -7.234 0.892 1.00 70.53 H new ATOM 0 HH21 ARG A 96 38.458 -7.677 0.697 1.00 13.10 H new ATOM 0 HH22 ARG A 96 37.024 -7.803 1.721 1.00 13.10 H new ATOM 1655 N LEU A 97 33.774 -10.623 -3.268 1.00 40.45 N ATOM 1656 CA LEU A 97 32.928 -11.326 -2.310 1.00 5.31 C ATOM 1657 C LEU A 97 33.219 -12.823 -2.323 1.00 3.01 C ATOM 1658 O LEU A 97 32.895 -13.537 -1.374 1.00 14.32 O ATOM 1659 CB LEU A 97 31.452 -11.079 -2.625 1.00 1.40 C ATOM 1660 CG LEU A 97 30.447 -11.662 -1.632 1.00 30.55 C ATOM 1661 CD1 LEU A 97 30.836 -11.303 -0.206 1.00 35.33 C ATOM 1662 CD2 LEU A 97 29.041 -11.170 -1.943 1.00 43.14 C ATOM 0 H LEU A 97 33.267 -10.190 -4.040 1.00 40.45 H new ATOM 0 HA LEU A 97 33.150 -10.940 -1.315 1.00 5.31 H new ATOM 0 HB2 LEU A 97 31.289 -10.003 -2.686 1.00 1.40 H new ATOM 0 HB3 LEU A 97 31.238 -11.490 -3.611 1.00 1.40 H new ATOM 0 HG LEU A 97 30.459 -12.748 -1.728 1.00 30.55 H new ATOM 0 HD11 LEU A 97 30.109 -11.727 0.487 1.00 35.33 H new ATOM 0 HD12 LEU A 97 31.825 -11.706 0.014 1.00 35.33 H new ATOM 0 HD13 LEU A 97 30.854 -10.219 -0.096 1.00 35.33 H new ATOM 0 HD21 LEU A 97 28.340 -11.596 -1.226 1.00 43.14 H new ATOM 0 HD22 LEU A 97 29.013 -10.082 -1.876 1.00 43.14 H new ATOM 0 HD23 LEU A 97 28.762 -11.479 -2.950 1.00 43.14 H new ATOM 1674 N ARG A 98 33.835 -13.292 -3.404 1.00 12.45 N ATOM 1675 CA ARG A 98 34.171 -14.704 -3.539 1.00 54.25 C ATOM 1676 C ARG A 98 32.908 -15.557 -3.623 1.00 63.13 C ATOM 1677 O ARG A 98 31.828 -15.155 -3.191 1.00 72.11 O ATOM 1678 CB ARG A 98 35.031 -15.161 -2.360 1.00 71.21 C ATOM 1679 CG ARG A 98 36.042 -14.122 -1.904 1.00 53.33 C ATOM 1680 CD ARG A 98 36.912 -13.647 -3.058 1.00 33.42 C ATOM 1681 NE ARG A 98 38.245 -13.253 -2.611 1.00 62.14 N ATOM 1682 CZ ARG A 98 39.113 -12.600 -3.376 1.00 51.12 C ATOM 1683 NH1 ARG A 98 38.789 -12.269 -4.619 1.00 32.14 N ATOM 1684 NH2 ARG A 98 40.308 -12.276 -2.898 1.00 54.24 N ATOM 0 H ARG A 98 34.111 -12.715 -4.198 1.00 12.45 H new ATOM 0 HA ARG A 98 34.737 -14.831 -4.462 1.00 54.25 H new ATOM 0 HB2 ARG A 98 34.380 -15.414 -1.523 1.00 71.21 H new ATOM 0 HB3 ARG A 98 35.560 -16.072 -2.639 1.00 71.21 H new ATOM 0 HG2 ARG A 98 35.519 -13.271 -1.467 1.00 53.33 H new ATOM 0 HG3 ARG A 98 36.672 -14.545 -1.122 1.00 53.33 H new ATOM 0 HD2 ARG A 98 36.998 -14.442 -3.798 1.00 33.42 H new ATOM 0 HD3 ARG A 98 36.431 -12.803 -3.551 1.00 33.42 H new ATOM 0 HE ARG A 98 38.525 -13.492 -1.660 1.00 62.14 H new ATOM 0 HH11 ARG A 98 37.871 -12.516 -4.990 1.00 32.14 H new ATOM 0 HH12 ARG A 98 39.457 -11.768 -5.204 1.00 32.14 H new ATOM 0 HH21 ARG A 98 40.561 -12.528 -1.943 1.00 54.24 H new ATOM 0 HH22 ARG A 98 40.974 -11.775 -3.486 1.00 54.24 H new ATOM 1698 N PRO A 99 33.046 -16.764 -4.193 1.00 41.51 N ATOM 1699 CA PRO A 99 31.928 -17.699 -4.347 1.00 54.41 C ATOM 1700 C PRO A 99 31.464 -18.273 -3.013 1.00 25.22 C ATOM 1701 O PRO A 99 31.658 -19.457 -2.735 1.00 41.41 O ATOM 1702 CB PRO A 99 32.509 -18.804 -5.233 1.00 13.25 C ATOM 1703 CG PRO A 99 33.977 -18.753 -4.987 1.00 42.01 C ATOM 1704 CD PRO A 99 34.304 -17.308 -4.730 1.00 44.14 C ATOM 0 HA PRO A 99 31.047 -17.215 -4.769 1.00 54.41 H new ATOM 0 HB2 PRO A 99 32.097 -19.779 -4.971 1.00 13.25 H new ATOM 0 HB3 PRO A 99 32.277 -18.632 -6.284 1.00 13.25 H new ATOM 0 HG2 PRO A 99 34.251 -19.373 -4.133 1.00 42.01 H new ATOM 0 HG3 PRO A 99 34.530 -19.131 -5.847 1.00 42.01 H new ATOM 0 HD2 PRO A 99 35.124 -17.202 -4.019 1.00 44.14 H new ATOM 0 HD3 PRO A 99 34.606 -16.796 -5.644 1.00 44.14 H new ATOM 1712 N SER A 100 30.851 -17.428 -2.190 1.00 45.24 N ATOM 1713 CA SER A 100 30.364 -17.851 -0.883 1.00 75.32 C ATOM 1714 C SER A 100 28.872 -18.169 -0.937 1.00 3.02 C ATOM 1715 O SER A 100 28.326 -18.797 -0.029 1.00 45.12 O ATOM 1716 CB SER A 100 30.628 -16.764 0.160 1.00 33.01 C ATOM 1717 OG SER A 100 31.855 -16.102 -0.093 1.00 12.12 O ATOM 0 H SER A 100 30.680 -16.446 -2.406 1.00 45.24 H new ATOM 0 HA SER A 100 30.901 -18.756 -0.598 1.00 75.32 H new ATOM 0 HB2 SER A 100 29.812 -16.041 0.151 1.00 33.01 H new ATOM 0 HB3 SER A 100 30.649 -17.208 1.155 1.00 33.01 H new ATOM 0 HG SER A 100 31.678 -15.236 -0.516 1.00 12.12 H new ATOM 1723 N PHE A 101 28.218 -17.730 -2.007 1.00 65.44 N ATOM 1724 CA PHE A 101 26.790 -17.966 -2.181 1.00 31.24 C ATOM 1725 C PHE A 101 26.455 -19.443 -1.989 1.00 2.41 C ATOM 1726 O PHE A 101 25.558 -19.792 -1.223 1.00 32.12 O ATOM 1727 CB PHE A 101 26.340 -17.506 -3.569 1.00 10.23 C ATOM 1728 CG PHE A 101 25.055 -16.728 -3.555 1.00 3.31 C ATOM 1729 CD1 PHE A 101 23.933 -17.229 -2.915 1.00 41.13 C ATOM 1730 CD2 PHE A 101 24.970 -15.495 -4.182 1.00 72.22 C ATOM 1731 CE1 PHE A 101 22.749 -16.515 -2.900 1.00 64.34 C ATOM 1732 CE2 PHE A 101 23.789 -14.777 -4.170 1.00 41.13 C ATOM 1733 CZ PHE A 101 22.677 -15.288 -3.530 1.00 22.13 C ATOM 0 H PHE A 101 28.655 -17.209 -2.767 1.00 65.44 H new ATOM 0 HA PHE A 101 26.258 -17.389 -1.425 1.00 31.24 H new ATOM 0 HB2 PHE A 101 27.123 -16.890 -4.011 1.00 10.23 H new ATOM 0 HB3 PHE A 101 26.220 -18.379 -4.211 1.00 10.23 H new ATOM 0 HD1 PHE A 101 23.984 -18.189 -2.422 1.00 41.13 H new ATOM 0 HD2 PHE A 101 25.836 -15.091 -4.685 1.00 72.22 H new ATOM 0 HE1 PHE A 101 21.882 -16.916 -2.396 1.00 64.34 H new ATOM 0 HE2 PHE A 101 23.736 -13.817 -4.661 1.00 41.13 H new ATOM 0 HZ PHE A 101 21.753 -14.729 -3.522 1.00 22.13 H new ATOM 1743 N ALA A 102 27.183 -20.304 -2.691 1.00 64.24 N ATOM 1744 CA ALA A 102 26.966 -21.742 -2.598 1.00 73.52 C ATOM 1745 C ALA A 102 27.071 -22.221 -1.154 1.00 74.11 C ATOM 1746 O ALA A 102 26.548 -23.278 -0.800 1.00 14.14 O ATOM 1747 CB ALA A 102 27.962 -22.485 -3.476 1.00 60.11 C ATOM 0 H ALA A 102 27.929 -20.031 -3.331 1.00 64.24 H new ATOM 0 HA ALA A 102 25.957 -21.955 -2.952 1.00 73.52 H new ATOM 0 HB1 ALA A 102 27.788 -23.558 -3.396 1.00 60.11 H new ATOM 0 HB2 ALA A 102 27.836 -22.173 -4.513 1.00 60.11 H new ATOM 0 HB3 ALA A 102 28.976 -22.257 -3.149 1.00 60.11 H new ATOM 1753 N LYS A 103 27.750 -21.437 -0.324 1.00 23.51 N ATOM 1754 CA LYS A 103 27.924 -21.780 1.083 1.00 60.24 C ATOM 1755 C LYS A 103 26.873 -21.088 1.945 1.00 25.11 C ATOM 1756 O LYS A 103 26.621 -21.496 3.078 1.00 12.55 O ATOM 1757 CB LYS A 103 29.326 -21.388 1.555 1.00 71.20 C ATOM 1758 CG LYS A 103 30.322 -22.534 1.520 1.00 62.12 C ATOM 1759 CD LYS A 103 30.954 -22.681 0.146 1.00 64.41 C ATOM 1760 CE LYS A 103 31.525 -24.077 -0.058 1.00 52.55 C ATOM 1761 NZ LYS A 103 30.462 -25.069 -0.379 1.00 52.25 N ATOM 0 H LYS A 103 28.189 -20.559 -0.601 1.00 23.51 H new ATOM 0 HA LYS A 103 27.801 -22.858 1.187 1.00 60.24 H new ATOM 0 HB2 LYS A 103 29.697 -20.576 0.930 1.00 71.20 H new ATOM 0 HB3 LYS A 103 29.263 -21.003 2.573 1.00 71.20 H new ATOM 0 HG2 LYS A 103 31.101 -22.363 2.263 1.00 62.12 H new ATOM 0 HG3 LYS A 103 29.820 -23.462 1.792 1.00 62.12 H new ATOM 0 HD2 LYS A 103 30.209 -22.476 -0.622 1.00 64.41 H new ATOM 0 HD3 LYS A 103 31.746 -21.942 0.028 1.00 64.41 H new ATOM 0 HE2 LYS A 103 32.257 -24.056 -0.865 1.00 52.55 H new ATOM 0 HE3 LYS A 103 32.053 -24.389 0.843 1.00 52.55 H new ATOM 0 HZ1 LYS A 103 30.891 -26.007 -0.511 1.00 52.25 H new ATOM 0 HZ2 LYS A 103 29.777 -25.108 0.402 1.00 52.25 H new ATOM 0 HZ3 LYS A 103 29.975 -24.785 -1.253 1.00 52.25 H new ATOM 1775 N ALA A 104 26.264 -20.041 1.400 1.00 14.41 N ATOM 1776 CA ALA A 104 25.238 -19.295 2.119 1.00 50.43 C ATOM 1777 C ALA A 104 23.846 -19.833 1.804 1.00 2.24 C ATOM 1778 O ALA A 104 22.890 -19.569 2.533 1.00 35.14 O ATOM 1779 CB ALA A 104 25.324 -17.815 1.775 1.00 13.24 C ATOM 0 H ALA A 104 26.463 -19.690 0.463 1.00 14.41 H new ATOM 0 HA ALA A 104 25.414 -19.420 3.187 1.00 50.43 H new ATOM 0 HB1 ALA A 104 24.552 -17.270 2.319 1.00 13.24 H new ATOM 0 HB2 ALA A 104 26.305 -17.432 2.056 1.00 13.24 H new ATOM 0 HB3 ALA A 104 25.176 -17.681 0.703 1.00 13.24 H new ATOM 1785 N ILE A 105 23.741 -20.587 0.715 1.00 15.25 N ATOM 1786 CA ILE A 105 22.465 -21.162 0.306 1.00 43.21 C ATOM 1787 C ILE A 105 21.737 -21.784 1.492 1.00 34.11 C ATOM 1788 O ILE A 105 20.574 -21.483 1.766 1.00 64.52 O ATOM 1789 CB ILE A 105 22.655 -22.232 -0.785 1.00 32.42 C ATOM 1790 CG1 ILE A 105 23.020 -21.575 -2.117 1.00 62.13 C ATOM 1791 CG2 ILE A 105 21.393 -23.070 -0.930 1.00 22.24 C ATOM 1792 CD1 ILE A 105 22.110 -20.427 -2.494 1.00 61.24 C ATOM 0 H ILE A 105 24.523 -20.814 0.101 1.00 15.25 H new ATOM 0 HA ILE A 105 21.865 -20.346 -0.097 1.00 43.21 H new ATOM 0 HB ILE A 105 23.473 -22.889 -0.490 1.00 32.42 H new ATOM 0 HG12 ILE A 105 24.047 -21.212 -2.065 1.00 62.13 H new ATOM 0 HG13 ILE A 105 22.988 -22.327 -2.905 1.00 62.13 H new ATOM 0 HG21 ILE A 105 21.543 -23.822 -1.705 1.00 22.24 H new ATOM 0 HG22 ILE A 105 21.173 -23.563 0.017 1.00 22.24 H new ATOM 0 HG23 ILE A 105 20.558 -22.426 -1.206 1.00 22.24 H new ATOM 0 HD11 ILE A 105 22.428 -20.009 -3.449 1.00 61.24 H new ATOM 0 HD12 ILE A 105 21.085 -20.788 -2.579 1.00 61.24 H new ATOM 0 HD13 ILE A 105 22.160 -19.655 -1.726 1.00 61.24 H new ATOM 1804 N PRO A 106 22.435 -22.672 2.216 1.00 54.22 N ATOM 1805 CA PRO A 106 21.875 -23.354 3.387 1.00 52.44 C ATOM 1806 C PRO A 106 21.669 -22.408 4.565 1.00 52.32 C ATOM 1807 O PRO A 106 20.758 -22.596 5.373 1.00 65.44 O ATOM 1808 CB PRO A 106 22.934 -24.406 3.724 1.00 10.25 C ATOM 1809 CG PRO A 106 24.205 -23.853 3.178 1.00 10.35 C ATOM 1810 CD PRO A 106 23.824 -23.078 1.947 1.00 3.02 C ATOM 0 HA PRO A 106 20.889 -23.772 3.183 1.00 52.44 H new ATOM 0 HB2 PRO A 106 23.003 -24.568 4.800 1.00 10.25 H new ATOM 0 HB3 PRO A 106 22.694 -25.368 3.271 1.00 10.25 H new ATOM 0 HG2 PRO A 106 24.696 -23.209 3.908 1.00 10.35 H new ATOM 0 HG3 PRO A 106 24.906 -24.652 2.935 1.00 10.35 H new ATOM 0 HD2 PRO A 106 24.473 -22.215 1.798 1.00 3.02 H new ATOM 0 HD3 PRO A 106 23.897 -23.690 1.048 1.00 3.02 H new ATOM 1818 N CYS A 107 22.518 -21.391 4.656 1.00 4.24 N ATOM 1819 CA CYS A 107 22.429 -20.415 5.737 1.00 63.10 C ATOM 1820 C CYS A 107 21.246 -19.476 5.525 1.00 5.21 C ATOM 1821 O CYS A 107 20.811 -18.790 6.451 1.00 41.31 O ATOM 1822 CB CYS A 107 23.726 -19.609 5.832 1.00 35.04 C ATOM 1823 SG CYS A 107 25.227 -20.606 5.691 1.00 61.35 S ATOM 0 H CYS A 107 23.276 -21.220 3.995 1.00 4.24 H new ATOM 0 HA CYS A 107 22.277 -20.956 6.671 1.00 63.10 H new ATOM 0 HB2 CYS A 107 23.730 -18.853 5.047 1.00 35.04 H new ATOM 0 HB3 CYS A 107 23.743 -19.079 6.784 1.00 35.04 H new ATOM 0 HG CYS A 107 25.409 -20.942 4.449 1.00 61.35 H new ATOM 1829 N LEU A 108 20.732 -19.448 4.301 1.00 74.41 N ATOM 1830 CA LEU A 108 19.599 -18.592 3.966 1.00 3.51 C ATOM 1831 C LEU A 108 18.281 -19.342 4.131 1.00 4.51 C ATOM 1832 O LEU A 108 17.278 -18.767 4.553 1.00 75.11 O ATOM 1833 CB LEU A 108 19.730 -18.077 2.532 1.00 64.15 C ATOM 1834 CG LEU A 108 20.383 -16.704 2.368 1.00 54.21 C ATOM 1835 CD1 LEU A 108 19.450 -15.608 2.860 1.00 51.12 C ATOM 1836 CD2 LEU A 108 21.709 -16.651 3.112 1.00 61.34 C ATOM 0 H LEU A 108 21.081 -20.008 3.523 1.00 74.41 H new ATOM 0 HA LEU A 108 19.601 -17.745 4.652 1.00 3.51 H new ATOM 0 HB2 LEU A 108 20.307 -18.802 1.958 1.00 64.15 H new ATOM 0 HB3 LEU A 108 18.735 -18.039 2.089 1.00 64.15 H new ATOM 0 HG LEU A 108 20.578 -16.540 1.308 1.00 54.21 H new ATOM 0 HD11 LEU A 108 19.931 -14.638 2.736 1.00 51.12 H new ATOM 0 HD12 LEU A 108 18.525 -15.631 2.283 1.00 51.12 H new ATOM 0 HD13 LEU A 108 19.224 -15.769 3.914 1.00 51.12 H new ATOM 0 HD21 LEU A 108 22.159 -15.667 2.984 1.00 61.34 H new ATOM 0 HD22 LEU A 108 21.539 -16.837 4.172 1.00 61.34 H new ATOM 0 HD23 LEU A 108 22.380 -17.411 2.713 1.00 61.34 H new ATOM 1848 N ARG A 109 18.293 -20.628 3.798 1.00 52.03 N ATOM 1849 CA ARG A 109 17.099 -21.457 3.910 1.00 52.11 C ATOM 1850 C ARG A 109 16.968 -22.034 5.316 1.00 13.03 C ATOM 1851 O ARG A 109 15.871 -22.380 5.757 1.00 22.21 O ATOM 1852 CB ARG A 109 17.141 -22.591 2.884 1.00 51.22 C ATOM 1853 CG ARG A 109 18.344 -23.506 3.037 1.00 24.40 C ATOM 1854 CD ARG A 109 18.715 -24.165 1.717 1.00 1.23 C ATOM 1855 NE ARG A 109 17.739 -25.174 1.316 1.00 54.23 N ATOM 1856 CZ ARG A 109 17.996 -26.137 0.437 1.00 13.44 C ATOM 1857 NH1 ARG A 109 19.192 -26.221 -0.128 1.00 1.13 N ATOM 1858 NH2 ARG A 109 17.055 -27.018 0.123 1.00 20.11 N ATOM 0 H ARG A 109 19.116 -21.119 3.448 1.00 52.03 H new ATOM 0 HA ARG A 109 16.231 -20.828 3.711 1.00 52.11 H new ATOM 0 HB2 ARG A 109 16.231 -23.184 2.973 1.00 51.22 H new ATOM 0 HB3 ARG A 109 17.146 -22.163 1.882 1.00 51.22 H new ATOM 0 HG2 ARG A 109 19.193 -22.933 3.410 1.00 24.40 H new ATOM 0 HG3 ARG A 109 18.126 -24.274 3.780 1.00 24.40 H new ATOM 0 HD2 ARG A 109 18.790 -23.404 0.940 1.00 1.23 H new ATOM 0 HD3 ARG A 109 19.698 -24.627 1.806 1.00 1.23 H new ATOM 0 HE ARG A 109 16.809 -25.138 1.733 1.00 54.23 H new ATOM 0 HH11 ARG A 109 19.918 -25.546 0.112 1.00 1.13 H new ATOM 0 HH12 ARG A 109 19.387 -26.961 -0.802 1.00 1.13 H new ATOM 0 HH21 ARG A 109 16.134 -26.956 0.556 1.00 20.11 H new ATOM 0 HH22 ARG A 109 17.253 -27.757 -0.552 1.00 20.11 H new ATOM 1872 N HIS A 110 18.093 -22.135 6.016 1.00 23.12 N ATOM 1873 CA HIS A 110 18.104 -22.670 7.373 1.00 24.31 C ATOM 1874 C HIS A 110 17.151 -21.890 8.273 1.00 74.04 C ATOM 1875 O HIS A 110 16.676 -22.406 9.285 1.00 12.31 O ATOM 1876 CB HIS A 110 19.520 -22.625 7.950 1.00 34.41 C ATOM 1877 CG HIS A 110 19.578 -22.925 9.416 1.00 25.52 C ATOM 1878 ND1 HIS A 110 19.398 -21.965 10.389 1.00 43.21 N ATOM 1879 CD2 HIS A 110 19.797 -24.088 10.074 1.00 64.11 C ATOM 1880 CE1 HIS A 110 19.506 -22.523 11.581 1.00 34.23 C ATOM 1881 NE2 HIS A 110 19.747 -23.811 11.418 1.00 63.40 N ATOM 0 H HIS A 110 19.009 -21.854 5.666 1.00 23.12 H new ATOM 0 HA HIS A 110 17.769 -23.706 7.331 1.00 24.31 H new ATOM 0 HB2 HIS A 110 20.144 -23.341 7.416 1.00 34.41 H new ATOM 0 HB3 HIS A 110 19.945 -21.637 7.772 1.00 34.41 H new ATOM 0 HD2 HIS A 110 19.977 -25.054 9.625 1.00 64.11 H new ATOM 0 HE1 HIS A 110 19.413 -22.013 12.528 1.00 34.23 H new ATOM 0 HE2 HIS A 110 19.875 -24.490 12.168 1.00 63.40 H new ATOM 1889 N ILE A 111 16.876 -20.646 7.897 1.00 55.42 N ATOM 1890 CA ILE A 111 15.979 -19.795 8.670 1.00 74.44 C ATOM 1891 C ILE A 111 14.614 -19.683 7.999 1.00 52.03 C ATOM 1892 O ILE A 111 13.702 -19.047 8.527 1.00 34.00 O ATOM 1893 CB ILE A 111 16.564 -18.383 8.857 1.00 32.20 C ATOM 1894 CG1 ILE A 111 16.761 -17.705 7.500 1.00 51.12 C ATOM 1895 CG2 ILE A 111 17.880 -18.452 9.617 1.00 11.11 C ATOM 1896 CD1 ILE A 111 18.204 -17.663 7.049 1.00 23.30 C ATOM 0 H ILE A 111 17.261 -20.205 7.062 1.00 55.42 H new ATOM 0 HA ILE A 111 15.864 -20.264 9.647 1.00 74.44 H new ATOM 0 HB ILE A 111 15.861 -17.788 9.440 1.00 32.20 H new ATOM 0 HG12 ILE A 111 16.170 -18.232 6.751 1.00 51.12 H new ATOM 0 HG13 ILE A 111 16.375 -16.687 7.552 1.00 51.12 H new ATOM 0 HG21 ILE A 111 18.281 -17.446 9.741 1.00 11.11 H new ATOM 0 HG22 ILE A 111 17.711 -18.899 10.597 1.00 11.11 H new ATOM 0 HG23 ILE A 111 18.591 -19.060 9.058 1.00 11.11 H new ATOM 0 HD11 ILE A 111 18.268 -17.169 6.080 1.00 23.30 H new ATOM 0 HD12 ILE A 111 18.797 -17.111 7.778 1.00 23.30 H new ATOM 0 HD13 ILE A 111 18.588 -18.679 6.964 1.00 23.30 H new ATOM 1908 N ARG A 112 14.481 -20.306 6.833 1.00 73.35 N ATOM 1909 CA ARG A 112 13.227 -20.277 6.089 1.00 12.13 C ATOM 1910 C ARG A 112 12.943 -18.875 5.557 1.00 32.23 C ATOM 1911 O ARG A 112 11.897 -18.293 5.842 1.00 15.54 O ATOM 1912 CB ARG A 112 12.071 -20.740 6.978 1.00 24.43 C ATOM 1913 CG ARG A 112 12.409 -21.949 7.836 1.00 45.03 C ATOM 1914 CD ARG A 112 12.506 -21.579 9.307 1.00 11.44 C ATOM 1915 NE ARG A 112 11.998 -22.640 10.173 1.00 4.42 N ATOM 1916 CZ ARG A 112 12.258 -22.714 11.474 1.00 52.21 C ATOM 1917 NH1 ARG A 112 13.014 -21.794 12.056 1.00 45.31 N ATOM 1918 NH2 ARG A 112 11.760 -23.710 12.195 1.00 15.12 N ATOM 0 H ARG A 112 15.226 -20.837 6.383 1.00 73.35 H new ATOM 0 HA ARG A 112 13.320 -20.957 5.242 1.00 12.13 H new ATOM 0 HB2 ARG A 112 11.771 -19.917 7.627 1.00 24.43 H new ATOM 0 HB3 ARG A 112 11.214 -20.980 6.349 1.00 24.43 H new ATOM 0 HG2 ARG A 112 11.646 -22.716 7.702 1.00 45.03 H new ATOM 0 HG3 ARG A 112 13.354 -22.379 7.505 1.00 45.03 H new ATOM 0 HD2 ARG A 112 13.545 -21.371 9.561 1.00 11.44 H new ATOM 0 HD3 ARG A 112 11.944 -20.663 9.488 1.00 11.44 H new ATOM 0 HE ARG A 112 11.412 -23.363 9.756 1.00 4.42 H new ATOM 0 HH11 ARG A 112 13.398 -21.026 11.505 1.00 45.31 H new ATOM 0 HH12 ARG A 112 13.212 -21.854 13.055 1.00 45.31 H new ATOM 0 HH21 ARG A 112 11.177 -24.419 11.751 1.00 15.12 H new ATOM 0 HH22 ARG A 112 11.960 -23.766 13.194 1.00 15.12 H new ATOM 1932 N ARG A 113 13.882 -18.340 4.784 1.00 73.13 N ATOM 1933 CA ARG A 113 13.733 -17.007 4.213 1.00 2.55 C ATOM 1934 C ARG A 113 13.668 -17.071 2.690 1.00 3.43 C ATOM 1935 O ARG A 113 13.015 -16.245 2.052 1.00 51.11 O ATOM 1936 CB ARG A 113 14.895 -16.111 4.648 1.00 53.31 C ATOM 1937 CG ARG A 113 14.865 -14.727 4.020 1.00 73.04 C ATOM 1938 CD ARG A 113 14.728 -13.639 5.074 1.00 72.53 C ATOM 1939 NE ARG A 113 13.442 -13.704 5.763 1.00 20.22 N ATOM 1940 CZ ARG A 113 13.053 -12.822 6.677 1.00 31.20 C ATOM 1941 NH1 ARG A 113 13.846 -11.813 7.009 1.00 1.01 N ATOM 1942 NH2 ARG A 113 11.868 -12.948 7.260 1.00 32.44 N ATOM 0 H ARG A 113 14.754 -18.809 4.539 1.00 73.13 H new ATOM 0 HA ARG A 113 12.798 -16.584 4.581 1.00 2.55 H new ATOM 0 HB2 ARG A 113 14.877 -16.009 5.733 1.00 53.31 H new ATOM 0 HB3 ARG A 113 15.835 -16.598 4.389 1.00 53.31 H new ATOM 0 HG2 ARG A 113 15.778 -14.567 3.447 1.00 73.04 H new ATOM 0 HG3 ARG A 113 14.033 -14.663 3.319 1.00 73.04 H new ATOM 0 HD2 ARG A 113 15.534 -13.735 5.801 1.00 72.53 H new ATOM 0 HD3 ARG A 113 14.838 -12.662 4.603 1.00 72.53 H new ATOM 0 HE ARG A 113 12.808 -14.468 5.530 1.00 20.22 H new ATOM 0 HH11 ARG A 113 14.757 -11.712 6.562 1.00 1.01 H new ATOM 0 HH12 ARG A 113 13.545 -11.137 7.711 1.00 1.01 H new ATOM 0 HH21 ARG A 113 11.255 -13.723 7.007 1.00 32.44 H new ATOM 0 HH22 ARG A 113 11.570 -12.270 7.962 1.00 32.44 H new ATOM 1956 N ILE A 114 14.350 -18.055 2.115 1.00 22.43 N ATOM 1957 CA ILE A 114 14.369 -18.227 0.668 1.00 62.11 C ATOM 1958 C ILE A 114 14.500 -19.699 0.291 1.00 53.25 C ATOM 1959 O ILE A 114 14.572 -20.569 1.159 1.00 41.43 O ATOM 1960 CB ILE A 114 15.524 -17.439 0.023 1.00 44.13 C ATOM 1961 CG1 ILE A 114 16.866 -18.095 0.355 1.00 43.40 C ATOM 1962 CG2 ILE A 114 15.505 -15.992 0.492 1.00 42.21 C ATOM 1963 CD1 ILE A 114 17.415 -18.949 -0.766 1.00 21.41 C ATOM 0 H ILE A 114 14.897 -18.746 2.629 1.00 22.43 H new ATOM 0 HA ILE A 114 13.422 -17.841 0.292 1.00 62.11 H new ATOM 0 HB ILE A 114 15.393 -17.451 -1.059 1.00 44.13 H new ATOM 0 HG12 ILE A 114 17.591 -17.318 0.597 1.00 43.40 H new ATOM 0 HG13 ILE A 114 16.749 -18.711 1.247 1.00 43.40 H new ATOM 0 HG21 ILE A 114 16.327 -15.448 0.027 1.00 42.21 H new ATOM 0 HG22 ILE A 114 14.559 -15.530 0.209 1.00 42.21 H new ATOM 0 HG23 ILE A 114 15.615 -15.959 1.576 1.00 42.21 H new ATOM 0 HD11 ILE A 114 18.368 -19.382 -0.461 1.00 21.41 H new ATOM 0 HD12 ILE A 114 16.709 -19.748 -0.994 1.00 21.41 H new ATOM 0 HD13 ILE A 114 17.564 -18.333 -1.653 1.00 21.41 H new ATOM 1975 N ARG A 115 14.531 -19.970 -1.010 1.00 51.11 N ATOM 1976 CA ARG A 115 14.654 -21.336 -1.503 1.00 35.50 C ATOM 1977 C ARG A 115 15.549 -21.391 -2.737 1.00 51.03 C ATOM 1978 O ARG A 115 15.981 -20.358 -3.248 1.00 74.22 O ATOM 1979 CB ARG A 115 13.274 -21.907 -1.835 1.00 74.31 C ATOM 1980 CG ARG A 115 12.547 -22.484 -0.631 1.00 63.31 C ATOM 1981 CD ARG A 115 11.437 -23.433 -1.053 1.00 35.42 C ATOM 1982 NE ARG A 115 11.938 -24.531 -1.875 1.00 75.15 N ATOM 1983 CZ ARG A 115 11.169 -25.509 -2.343 1.00 45.33 C ATOM 1984 NH1 ARG A 115 9.872 -25.525 -2.071 1.00 51.23 N ATOM 1985 NH2 ARG A 115 11.699 -26.473 -3.086 1.00 1.25 N ATOM 0 H ARG A 115 14.473 -19.261 -1.741 1.00 51.11 H new ATOM 0 HA ARG A 115 15.110 -21.939 -0.718 1.00 35.50 H new ATOM 0 HB2 ARG A 115 12.661 -21.121 -2.276 1.00 74.31 H new ATOM 0 HB3 ARG A 115 13.384 -22.686 -2.590 1.00 74.31 H new ATOM 0 HG2 ARG A 115 13.257 -23.013 0.005 1.00 63.31 H new ATOM 0 HG3 ARG A 115 12.127 -21.673 -0.035 1.00 63.31 H new ATOM 0 HD2 ARG A 115 10.949 -23.838 -0.166 1.00 35.42 H new ATOM 0 HD3 ARG A 115 10.680 -22.880 -1.609 1.00 35.42 H new ATOM 0 HE ARG A 115 12.932 -24.548 -2.102 1.00 75.15 H new ATOM 0 HH11 ARG A 115 9.461 -24.785 -1.501 1.00 51.23 H new ATOM 0 HH12 ARG A 115 9.285 -26.277 -2.432 1.00 51.23 H new ATOM 0 HH21 ARG A 115 12.697 -26.463 -3.298 1.00 1.25 H new ATOM 0 HH22 ARG A 115 11.109 -27.223 -3.445 1.00 1.25 H new ATOM 1999 N GLU A 116 15.823 -22.603 -3.210 1.00 44.20 N ATOM 2000 CA GLU A 116 16.669 -22.791 -4.383 1.00 55.14 C ATOM 2001 C GLU A 116 16.220 -24.008 -5.187 1.00 50.15 C ATOM 2002 O GLU A 116 16.091 -25.107 -4.649 1.00 1.41 O ATOM 2003 CB GLU A 116 18.131 -22.953 -3.965 1.00 64.31 C ATOM 2004 CG GLU A 116 18.305 -23.491 -2.554 1.00 40.44 C ATOM 2005 CD GLU A 116 17.567 -24.797 -2.333 1.00 2.43 C ATOM 2006 OE1 GLU A 116 18.042 -25.838 -2.833 1.00 2.12 O ATOM 2007 OE2 GLU A 116 16.516 -24.778 -1.660 1.00 15.22 O ATOM 0 H GLU A 116 15.472 -23.468 -2.800 1.00 44.20 H new ATOM 0 HA GLU A 116 16.576 -21.906 -5.012 1.00 55.14 H new ATOM 0 HB2 GLU A 116 18.628 -23.625 -4.665 1.00 64.31 H new ATOM 0 HB3 GLU A 116 18.631 -21.987 -4.041 1.00 64.31 H new ATOM 0 HG2 GLU A 116 19.366 -23.639 -2.354 1.00 40.44 H new ATOM 0 HG3 GLU A 116 17.946 -22.750 -1.840 1.00 40.44 H new ATOM 2014 N GLU A 117 15.983 -23.802 -6.479 1.00 44.13 N ATOM 2015 CA GLU A 117 15.548 -24.882 -7.357 1.00 51.31 C ATOM 2016 C GLU A 117 16.622 -25.211 -8.389 1.00 45.35 C ATOM 2017 O GLU A 117 16.819 -24.471 -9.353 1.00 44.44 O ATOM 2018 CB GLU A 117 14.246 -24.500 -8.064 1.00 73.22 C ATOM 2019 CG GLU A 117 13.507 -25.686 -8.661 1.00 61.40 C ATOM 2020 CD GLU A 117 12.231 -26.017 -7.911 1.00 4.11 C ATOM 2021 OE1 GLU A 117 11.278 -25.214 -7.979 1.00 15.02 O ATOM 2022 OE2 GLU A 117 12.187 -27.079 -7.256 1.00 24.32 O ATOM 0 H GLU A 117 16.085 -22.898 -6.940 1.00 44.13 H new ATOM 0 HA GLU A 117 15.375 -25.767 -6.744 1.00 51.31 H new ATOM 0 HB2 GLU A 117 13.591 -23.995 -7.354 1.00 73.22 H new ATOM 0 HB3 GLU A 117 14.469 -23.785 -8.856 1.00 73.22 H new ATOM 0 HG2 GLU A 117 13.267 -25.473 -9.703 1.00 61.40 H new ATOM 0 HG3 GLU A 117 14.162 -26.557 -8.657 1.00 61.40 H new ATOM 2029 N ARG A 118 17.315 -26.325 -8.179 1.00 71.44 N ATOM 2030 CA ARG A 118 18.371 -26.752 -9.090 1.00 33.02 C ATOM 2031 C ARG A 118 17.782 -27.311 -10.382 1.00 34.24 C ATOM 2032 O ARG A 118 17.288 -28.439 -10.413 1.00 72.10 O ATOM 2033 CB ARG A 118 19.255 -27.807 -8.421 1.00 55.44 C ATOM 2034 CG ARG A 118 20.026 -28.668 -9.407 1.00 61.44 C ATOM 2035 CD ARG A 118 20.828 -27.819 -10.381 1.00 40.00 C ATOM 2036 NE ARG A 118 22.120 -28.421 -10.697 1.00 62.53 N ATOM 2037 CZ ARG A 118 23.136 -28.474 -9.842 1.00 54.14 C ATOM 2038 NH1 ARG A 118 23.009 -27.963 -8.626 1.00 0.15 N ATOM 2039 NH2 ARG A 118 24.280 -29.039 -10.204 1.00 45.10 N ATOM 0 H ARG A 118 17.165 -26.949 -7.386 1.00 71.44 H new ATOM 0 HA ARG A 118 18.979 -25.881 -9.336 1.00 33.02 H new ATOM 0 HB2 ARG A 118 19.961 -27.309 -7.757 1.00 55.44 H new ATOM 0 HB3 ARG A 118 18.632 -28.450 -7.800 1.00 55.44 H new ATOM 0 HG2 ARG A 118 20.698 -29.332 -8.864 1.00 61.44 H new ATOM 0 HG3 ARG A 118 19.331 -29.300 -9.960 1.00 61.44 H new ATOM 0 HD2 ARG A 118 20.257 -27.684 -11.299 1.00 40.00 H new ATOM 0 HD3 ARG A 118 20.984 -26.828 -9.954 1.00 40.00 H new ATOM 0 HE ARG A 118 22.250 -28.823 -11.625 1.00 62.53 H new ATOM 0 HH11 ARG A 118 22.130 -27.528 -8.345 1.00 0.15 H new ATOM 0 HH12 ARG A 118 23.790 -28.005 -7.971 1.00 0.15 H new ATOM 0 HH21 ARG A 118 24.381 -29.433 -11.139 1.00 45.10 H new ATOM 0 HH22 ARG A 118 25.059 -29.079 -9.547 1.00 45.10 H new ATOM 2053 N CYS A 119 17.837 -26.515 -11.444 1.00 33.53 N ATOM 2054 CA CYS A 119 17.307 -26.930 -12.738 1.00 63.21 C ATOM 2055 C CYS A 119 18.405 -26.937 -13.797 1.00 53.14 C ATOM 2056 O CYS A 119 18.541 -25.990 -14.571 1.00 1.24 O ATOM 2057 CB CYS A 119 16.171 -26.002 -13.169 1.00 43.51 C ATOM 2058 SG CYS A 119 14.985 -25.627 -11.857 1.00 23.45 S ATOM 0 H CYS A 119 18.243 -25.579 -11.435 1.00 33.53 H new ATOM 0 HA CYS A 119 16.918 -27.943 -12.636 1.00 63.21 H new ATOM 0 HB2 CYS A 119 16.598 -25.069 -13.535 1.00 43.51 H new ATOM 0 HB3 CYS A 119 15.640 -26.459 -14.004 1.00 43.51 H new ATOM 0 HG CYS A 119 14.948 -24.343 -11.659 1.00 23.45 H new ATOM 2064 N GLY A 120 19.187 -28.012 -13.825 1.00 53.04 N ATOM 2065 CA GLY A 120 20.263 -28.121 -14.792 1.00 64.02 C ATOM 2066 C GLY A 120 21.391 -27.146 -14.517 1.00 54.42 C ATOM 2067 O GLY A 120 21.764 -26.903 -13.369 1.00 50.14 O ATOM 0 H GLY A 120 19.094 -28.809 -13.195 1.00 53.04 H new ATOM 0 HA2 GLY A 120 20.655 -29.138 -14.781 1.00 64.02 H new ATOM 0 HA3 GLY A 120 19.868 -27.942 -15.792 1.00 64.02 H new ATOM 2071 N PRO A 121 21.954 -26.569 -15.589 1.00 52.51 N ATOM 2072 CA PRO A 121 23.054 -25.606 -15.483 1.00 41.22 C ATOM 2073 C PRO A 121 22.607 -24.278 -14.881 1.00 71.13 C ATOM 2074 O PRO A 121 23.397 -23.341 -14.763 1.00 42.30 O ATOM 2075 CB PRO A 121 23.497 -25.412 -16.936 1.00 21.34 C ATOM 2076 CG PRO A 121 22.291 -25.739 -17.746 1.00 54.13 C ATOM 2077 CD PRO A 121 21.559 -26.811 -16.987 1.00 23.11 C ATOM 0 HA PRO A 121 23.846 -25.964 -14.825 1.00 41.22 H new ATOM 0 HB2 PRO A 121 23.829 -24.389 -17.115 1.00 21.34 H new ATOM 0 HB3 PRO A 121 24.332 -26.067 -17.186 1.00 21.34 H new ATOM 0 HG2 PRO A 121 21.662 -24.859 -17.882 1.00 54.13 H new ATOM 0 HG3 PRO A 121 22.571 -26.087 -18.740 1.00 54.13 H new ATOM 0 HD2 PRO A 121 20.480 -26.732 -17.119 1.00 23.11 H new ATOM 0 HD3 PRO A 121 21.848 -27.808 -17.320 1.00 23.11 H new ATOM 2085 N LEU A 122 21.336 -24.204 -14.502 1.00 30.21 N ATOM 2086 CA LEU A 122 20.783 -22.990 -13.911 1.00 22.41 C ATOM 2087 C LEU A 122 20.329 -23.241 -12.477 1.00 34.23 C ATOM 2088 O LEU A 122 20.387 -24.368 -11.983 1.00 15.00 O ATOM 2089 CB LEU A 122 19.609 -22.481 -14.748 1.00 41.25 C ATOM 2090 CG LEU A 122 19.891 -22.261 -16.235 1.00 75.33 C ATOM 2091 CD1 LEU A 122 18.965 -23.118 -17.086 1.00 2.42 C ATOM 2092 CD2 LEU A 122 19.740 -20.790 -16.595 1.00 72.42 C ATOM 0 H LEU A 122 20.669 -24.970 -14.593 1.00 30.21 H new ATOM 0 HA LEU A 122 21.567 -22.232 -13.897 1.00 22.41 H new ATOM 0 HB2 LEU A 122 18.788 -23.192 -14.656 1.00 41.25 H new ATOM 0 HB3 LEU A 122 19.265 -21.539 -14.321 1.00 41.25 H new ATOM 0 HG LEU A 122 20.919 -22.560 -16.438 1.00 75.33 H new ATOM 0 HD11 LEU A 122 19.180 -22.949 -18.141 1.00 2.42 H new ATOM 0 HD12 LEU A 122 19.122 -24.170 -16.848 1.00 2.42 H new ATOM 0 HD13 LEU A 122 17.929 -22.850 -16.879 1.00 2.42 H new ATOM 0 HD21 LEU A 122 19.944 -20.652 -17.657 1.00 72.42 H new ATOM 0 HD22 LEU A 122 18.723 -20.464 -16.376 1.00 72.42 H new ATOM 0 HD23 LEU A 122 20.444 -20.198 -16.010 1.00 72.42 H new ATOM 2104 N THR A 123 19.874 -22.184 -11.812 1.00 14.41 N ATOM 2105 CA THR A 123 19.408 -22.289 -10.435 1.00 13.30 C ATOM 2106 C THR A 123 18.540 -21.094 -10.056 1.00 34.54 C ATOM 2107 O THR A 123 18.988 -19.949 -10.102 1.00 10.34 O ATOM 2108 CB THR A 123 20.587 -22.386 -9.449 1.00 0.42 C ATOM 2109 OG1 THR A 123 21.659 -23.130 -10.038 1.00 52.14 O ATOM 2110 CG2 THR A 123 20.154 -23.052 -8.151 1.00 41.53 C ATOM 0 H THR A 123 19.818 -21.245 -12.205 1.00 14.41 H new ATOM 0 HA THR A 123 18.814 -23.201 -10.371 1.00 13.30 H new ATOM 0 HB THR A 123 20.928 -21.375 -9.224 1.00 0.42 H new ATOM 0 HG1 THR A 123 21.296 -23.909 -10.510 1.00 52.14 H new ATOM 0 HG21 THR A 123 21.004 -23.109 -7.470 1.00 41.53 H new ATOM 0 HG22 THR A 123 19.358 -22.467 -7.690 1.00 41.53 H new ATOM 0 HG23 THR A 123 19.790 -24.057 -8.362 1.00 41.53 H new ATOM 2118 N PHE A 124 17.295 -21.369 -9.680 1.00 31.31 N ATOM 2119 CA PHE A 124 16.363 -20.317 -9.292 1.00 42.53 C ATOM 2120 C PHE A 124 16.329 -20.152 -7.776 1.00 33.03 C ATOM 2121 O PHE A 124 16.849 -20.989 -7.038 1.00 34.25 O ATOM 2122 CB PHE A 124 14.960 -20.631 -9.815 1.00 12.43 C ATOM 2123 CG PHE A 124 14.918 -20.912 -11.289 1.00 61.24 C ATOM 2124 CD1 PHE A 124 15.410 -22.105 -11.795 1.00 5.34 C ATOM 2125 CD2 PHE A 124 14.387 -19.984 -12.171 1.00 20.14 C ATOM 2126 CE1 PHE A 124 15.373 -22.367 -13.151 1.00 63.22 C ATOM 2127 CE2 PHE A 124 14.347 -20.241 -13.528 1.00 32.21 C ATOM 2128 CZ PHE A 124 14.842 -21.434 -14.019 1.00 13.40 C ATOM 0 H PHE A 124 16.908 -22.312 -9.636 1.00 31.31 H new ATOM 0 HA PHE A 124 16.706 -19.381 -9.733 1.00 42.53 H new ATOM 0 HB2 PHE A 124 14.565 -21.493 -9.278 1.00 12.43 H new ATOM 0 HB3 PHE A 124 14.302 -19.790 -9.595 1.00 12.43 H new ATOM 0 HD1 PHE A 124 15.827 -22.839 -11.121 1.00 5.34 H new ATOM 0 HD2 PHE A 124 14.000 -19.049 -11.793 1.00 20.14 H new ATOM 0 HE1 PHE A 124 15.759 -23.301 -13.532 1.00 63.22 H new ATOM 0 HE2 PHE A 124 13.929 -19.510 -14.204 1.00 32.21 H new ATOM 0 HZ PHE A 124 14.814 -21.636 -15.080 1.00 13.40 H new ATOM 2138 N TYR A 125 15.713 -19.067 -7.318 1.00 64.34 N ATOM 2139 CA TYR A 125 15.613 -18.790 -5.890 1.00 61.34 C ATOM 2140 C TYR A 125 14.361 -17.977 -5.580 1.00 14.51 C ATOM 2141 O TYR A 125 14.213 -16.844 -6.039 1.00 12.41 O ATOM 2142 CB TYR A 125 16.855 -18.040 -5.407 1.00 22.04 C ATOM 2143 CG TYR A 125 18.155 -18.683 -5.834 1.00 4.24 C ATOM 2144 CD1 TYR A 125 18.737 -19.690 -5.075 1.00 25.54 C ATOM 2145 CD2 TYR A 125 18.801 -18.283 -6.997 1.00 45.11 C ATOM 2146 CE1 TYR A 125 19.926 -20.280 -5.461 1.00 13.24 C ATOM 2147 CE2 TYR A 125 19.989 -18.868 -7.392 1.00 3.34 C ATOM 2148 CZ TYR A 125 20.548 -19.865 -6.620 1.00 34.31 C ATOM 2149 OH TYR A 125 21.731 -20.451 -7.009 1.00 14.14 O ATOM 0 H TYR A 125 15.276 -18.365 -7.915 1.00 64.34 H new ATOM 0 HA TYR A 125 15.545 -19.742 -5.364 1.00 61.34 H new ATOM 0 HB2 TYR A 125 16.823 -17.019 -5.786 1.00 22.04 H new ATOM 0 HB3 TYR A 125 16.831 -17.977 -4.319 1.00 22.04 H new ATOM 0 HD1 TYR A 125 18.252 -20.018 -4.167 1.00 25.54 H new ATOM 0 HD2 TYR A 125 18.367 -17.501 -7.603 1.00 45.11 H new ATOM 0 HE1 TYR A 125 20.365 -21.061 -4.859 1.00 13.24 H new ATOM 0 HE2 TYR A 125 20.477 -18.546 -8.300 1.00 3.34 H new ATOM 0 HH TYR A 125 21.866 -21.281 -6.505 1.00 14.14 H new ATOM 2159 N TYR A 126 13.462 -18.562 -4.797 1.00 74.51 N ATOM 2160 CA TYR A 126 12.220 -17.894 -4.426 1.00 22.05 C ATOM 2161 C TYR A 126 12.105 -17.762 -2.910 1.00 2.30 C ATOM 2162 O TYR A 126 12.546 -18.624 -2.150 1.00 62.43 O ATOM 2163 CB TYR A 126 11.018 -18.664 -4.974 1.00 72.11 C ATOM 2164 CG TYR A 126 11.282 -20.140 -5.169 1.00 72.03 C ATOM 2165 CD1 TYR A 126 11.869 -20.613 -6.336 1.00 51.55 C ATOM 2166 CD2 TYR A 126 10.945 -21.062 -4.186 1.00 11.02 C ATOM 2167 CE1 TYR A 126 12.111 -21.960 -6.519 1.00 61.23 C ATOM 2168 CE2 TYR A 126 11.185 -22.411 -4.359 1.00 72.44 C ATOM 2169 CZ TYR A 126 11.768 -22.856 -5.528 1.00 14.51 C ATOM 2170 OH TYR A 126 12.009 -24.199 -5.706 1.00 14.44 O ATOM 0 H TYR A 126 13.570 -19.498 -4.407 1.00 74.51 H new ATOM 0 HA TYR A 126 12.231 -16.894 -4.861 1.00 22.05 H new ATOM 0 HB2 TYR A 126 10.177 -18.541 -4.292 1.00 72.11 H new ATOM 0 HB3 TYR A 126 10.722 -18.227 -5.928 1.00 72.11 H new ATOM 0 HD1 TYR A 126 12.141 -19.915 -7.114 1.00 51.55 H new ATOM 0 HD2 TYR A 126 10.487 -20.718 -3.270 1.00 11.02 H new ATOM 0 HE1 TYR A 126 12.567 -22.310 -7.433 1.00 61.23 H new ATOM 0 HE2 TYR A 126 10.918 -23.114 -3.584 1.00 72.44 H new ATOM 0 HH TYR A 126 11.389 -24.557 -6.375 1.00 14.44 H new ATOM 2180 N PRO A 127 11.497 -16.655 -2.458 1.00 42.33 N ATOM 2181 CA PRO A 127 11.308 -16.382 -1.030 1.00 71.14 C ATOM 2182 C PRO A 127 10.290 -17.320 -0.391 1.00 60.31 C ATOM 2183 O PRO A 127 9.096 -17.027 -0.358 1.00 12.31 O ATOM 2184 CB PRO A 127 10.793 -14.941 -1.010 1.00 3.43 C ATOM 2185 CG PRO A 127 10.154 -14.747 -2.341 1.00 61.44 C ATOM 2186 CD PRO A 127 10.947 -15.584 -3.307 1.00 21.22 C ATOM 0 HA PRO A 127 12.226 -16.529 -0.462 1.00 71.14 H new ATOM 0 HB2 PRO A 127 10.078 -14.788 -0.202 1.00 3.43 H new ATOM 0 HB3 PRO A 127 11.606 -14.232 -0.855 1.00 3.43 H new ATOM 0 HG2 PRO A 127 9.109 -15.058 -2.321 1.00 61.44 H new ATOM 0 HG3 PRO A 127 10.169 -13.697 -2.632 1.00 61.44 H new ATOM 0 HD2 PRO A 127 10.318 -15.984 -4.102 1.00 21.22 H new ATOM 0 HD3 PRO A 127 11.737 -15.005 -3.786 1.00 21.22 H new ATOM 2194 N GLY A 128 10.771 -18.451 0.117 1.00 62.13 N ATOM 2195 CA GLY A 128 9.889 -19.415 0.749 1.00 44.13 C ATOM 2196 C GLY A 128 8.652 -19.698 -0.079 1.00 73.43 C ATOM 2197 O GLY A 128 7.606 -19.082 0.124 1.00 32.24 O ATOM 0 H GLY A 128 11.756 -18.717 0.102 1.00 62.13 H new ATOM 0 HA2 GLY A 128 10.432 -20.345 0.915 1.00 44.13 H new ATOM 0 HA3 GLY A 128 9.589 -19.042 1.728 1.00 44.13 H new