USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 909 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 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 104 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 37 SER OG : rot -143:sc= 1.25 USER MOD Set 2.2: A 42 ASN : amide:sc= 0.973 K(o=2.2,f=1.7) USER MOD Single : A 1 ALA N :NH3+ -119:sc= 0.252 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 171:sc= 0.0441 USER MOD Single : A 7 LYS NZ :NH3+ -148:sc= 0.305 (180deg=0.028) USER MOD Single : A 11 ASN : amide:sc= -1.49 K(o=-1.5,f=-4.7!) USER MOD Single : A 13 ASN : amide:sc= -0.0047 X(o=-0.0047,f=0.12) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS :FLIP no HD1:sc= -0.325 F(o=-1.1,f=-0.33) USER MOD Single : A 20 ASN : amide:sc= -1.31 K(o=-1.3,f=-7.1!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 64:sc= -0.425! USER MOD Single : A 26 THR OG1 : rot 178:sc= -2.23! USER MOD Single : A 27 GLN : amide:sc= -0.326 K(o=-0.33,f=-1.5) USER MOD Single : A 30 ASN : amide:sc= -0.0105 X(o=-0.011,f=-0.31) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= -2.1 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0.171 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -115:sc= 0.534 USER MOD Single : A 61 THR OG1 : rot 21:sc= -0.38 USER MOD Single : A 64 THR OG1 : rot 180:sc=0.000413 USER MOD Single : A 66 THR OG1 : rot 180:sc=-0.00652 USER MOD Single : A 68 THR OG1 : rot 62:sc= 0.546 USER MOD Single : A 69 MET CE :methyl -178:sc= -0.107 (180deg=-0.146) USER MOD Single : A 72 ASN : amide:sc= -0.135 K(o=-0.14,f=-4.4!) USER MOD Single : A 73 LYS NZ :NH3+ 177:sc= 0.00641 (180deg=0.0059) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= -0.137 (180deg=-0.137) USER MOD Single : A 83 ASN : amide:sc= -0.426 K(o=-0.43,f=-3.8!) USER MOD Single : A 94 SER OG : rot 39:sc= 1.14 USER MOD Single : A 96 ASN : amide:sc= -0.405 K(o=-0.41,f=-3.7!) USER MOD Single : A 100 GLN : amide:sc= -1.23 K(o=-1.2,f=-2.8!) USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.828 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -168:sc= 0.171 (180deg=0.0967) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 12.415 -14.258 2.091 1.00 0.00 N ATOM 2 CA ALA A 1 12.671 -13.402 3.237 1.00 0.00 C ATOM 3 C ALA A 1 11.735 -12.191 3.182 1.00 0.00 C ATOM 4 O ALA A 1 10.995 -12.082 2.206 1.00 0.00 O ATOM 5 CB ALA A 1 14.122 -12.951 3.209 1.00 0.00 C ATOM 0 H1 ALA A 1 12.105 -15.195 2.420 1.00 0.00 H new ATOM 0 H2 ALA A 1 11.671 -13.835 1.501 1.00 0.00 H new ATOM 0 H3 ALA A 1 13.286 -14.358 1.531 1.00 0.00 H new ATOM 0 HA ALA A 1 12.487 -13.949 4.162 1.00 0.00 H new ATOM 0 HB1 ALA A 1 14.320 -12.308 4.067 1.00 0.00 H new ATOM 0 HB2 ALA A 1 14.775 -13.823 3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 1 14.313 -12.398 2.289 1.00 0.00 H new ATOM 13 N PHE A 2 11.849 -11.365 4.243 1.00 0.00 N ATOM 14 CA PHE A 2 11.025 -10.169 4.340 1.00 0.00 C ATOM 15 C PHE A 2 11.044 -9.786 5.850 1.00 0.00 C ATOM 16 O PHE A 2 11.060 -8.597 6.149 1.00 0.00 O ATOM 17 CB PHE A 2 9.595 -10.363 3.915 1.00 0.00 C ATOM 18 CG PHE A 2 9.303 -9.790 2.538 1.00 0.00 C ATOM 19 CD1 PHE A 2 10.265 -9.378 1.676 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.006 -9.666 2.094 1.00 0.00 C ATOM 21 CE1 PHE A 2 9.880 -8.883 0.456 1.00 0.00 C ATOM 22 CE2 PHE A 2 7.729 -9.145 0.830 1.00 0.00 C ATOM 23 CZ PHE A 2 8.560 -8.766 0.028 1.00 0.00 C ATOM 0 H PHE A 2 12.492 -11.509 5.022 1.00 0.00 H new ATOM 0 HA PHE A 2 11.427 -9.408 3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.362 -11.428 3.916 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.937 -9.892 4.646 1.00 0.00 H new ATOM 0 HD1 PHE A 2 11.310 -9.438 1.944 1.00 0.00 H new ATOM 0 HD2 PHE A 2 7.192 -9.976 2.733 1.00 0.00 H new ATOM 0 HE1 PHE A 2 10.657 -8.561 -0.222 1.00 0.00 H new ATOM 0 HE2 PHE A 2 6.691 -9.072 0.540 1.00 0.00 H new ATOM 0 HZ PHE A 2 8.295 -8.369 -0.941 1.00 0.00 H new ATOM 33 N ASP A 3 11.042 -10.882 6.630 1.00 0.00 N ATOM 34 CA ASP A 3 11.069 -10.720 8.042 1.00 0.00 C ATOM 35 C ASP A 3 11.855 -9.552 8.603 1.00 0.00 C ATOM 36 O ASP A 3 13.036 -9.693 8.937 1.00 0.00 O ATOM 37 CB ASP A 3 11.835 -11.970 8.577 1.00 0.00 C ATOM 38 CG ASP A 3 13.113 -12.251 7.804 1.00 0.00 C ATOM 39 OD1 ASP A 3 13.115 -12.396 6.573 1.00 0.00 O ATOM 40 OD2 ASP A 3 14.150 -12.329 8.448 1.00 0.00 O ATOM 0 H ASP A 3 11.022 -11.845 6.295 1.00 0.00 H new ATOM 0 HA ASP A 3 10.030 -10.569 8.336 1.00 0.00 H new ATOM 0 HB2 ASP A 3 12.077 -11.820 9.629 1.00 0.00 H new ATOM 0 HB3 ASP A 3 11.183 -12.842 8.522 1.00 0.00 H new ATOM 45 N GLY A 4 11.188 -8.407 8.692 1.00 0.00 N ATOM 46 CA GLY A 4 12.022 -7.315 9.235 1.00 0.00 C ATOM 47 C GLY A 4 11.189 -6.065 9.012 1.00 0.00 C ATOM 48 O GLY A 4 10.078 -6.230 8.489 1.00 0.00 O ATOM 0 H GLY A 4 10.219 -8.210 8.441 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.238 -7.467 10.293 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.981 -7.252 8.720 1.00 0.00 H new ATOM 52 N THR A 5 11.707 -4.894 9.398 1.00 0.00 N ATOM 53 CA THR A 5 10.825 -3.742 9.140 1.00 0.00 C ATOM 54 C THR A 5 11.111 -3.231 7.738 1.00 0.00 C ATOM 55 O THR A 5 12.084 -3.761 7.165 1.00 0.00 O ATOM 56 CB THR A 5 11.328 -2.657 10.123 1.00 0.00 C ATOM 57 OG1 THR A 5 12.718 -2.654 10.186 1.00 0.00 O ATOM 58 CG2 THR A 5 10.716 -2.887 11.508 1.00 0.00 C ATOM 0 H THR A 5 12.612 -4.720 9.835 1.00 0.00 H new ATOM 0 HA THR A 5 9.768 -3.985 9.247 1.00 0.00 H new ATOM 0 HB THR A 5 11.012 -1.679 9.761 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.021 -1.873 10.695 1.00 0.00 H new ATOM 0 HG21 THR A 5 11.074 -2.121 12.196 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.629 -2.834 11.439 1.00 0.00 H new ATOM 0 HG23 THR A 5 11.009 -3.870 11.876 1.00 0.00 H new ATOM 66 N TRP A 6 10.331 -2.264 7.211 1.00 0.00 N ATOM 67 CA TRP A 6 10.521 -1.717 5.923 1.00 0.00 C ATOM 68 C TRP A 6 10.034 -0.260 5.745 1.00 0.00 C ATOM 69 O TRP A 6 8.861 -0.044 5.869 1.00 0.00 O ATOM 70 CB TRP A 6 9.745 -2.420 4.766 1.00 0.00 C ATOM 71 CG TRP A 6 10.120 -3.812 4.488 1.00 0.00 C ATOM 72 CD1 TRP A 6 9.799 -4.967 5.206 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.919 -4.427 3.413 1.00 0.00 C ATOM 74 NE1 TRP A 6 10.321 -6.025 4.641 1.00 0.00 N ATOM 75 CE2 TRP A 6 11.054 -5.807 3.501 1.00 0.00 C ATOM 76 CE3 TRP A 6 11.548 -3.845 2.355 1.00 0.00 C ATOM 77 CZ2 TRP A 6 11.741 -6.586 2.635 1.00 0.00 C ATOM 78 CZ3 TRP A 6 12.251 -4.633 1.468 1.00 0.00 C ATOM 79 CH2 TRP A 6 12.372 -5.988 1.571 1.00 0.00 C ATOM 0 H TRP A 6 9.541 -1.856 7.712 1.00 0.00 H new ATOM 0 HA TRP A 6 11.603 -1.836 5.860 1.00 0.00 H new ATOM 0 HB2 TRP A 6 8.681 -2.392 5.000 1.00 0.00 H new ATOM 0 HB3 TRP A 6 9.887 -1.838 3.855 1.00 0.00 H new ATOM 0 HD1 TRP A 6 9.201 -4.984 6.105 1.00 0.00 H new ATOM 0 HE1 TRP A 6 10.191 -6.960 5.026 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.497 -2.776 2.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 11.793 -7.655 2.777 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 12.738 -4.145 0.637 1.00 0.00 H new ATOM 0 HH2 TRP A 6 12.936 -6.563 0.851 1.00 0.00 H new ATOM 90 N LYS A 7 10.947 0.654 5.439 1.00 0.00 N ATOM 91 CA LYS A 7 10.743 2.045 5.188 1.00 0.00 C ATOM 92 C LYS A 7 10.802 3.008 6.386 1.00 0.00 C ATOM 93 O LYS A 7 10.843 2.635 7.518 1.00 0.00 O ATOM 94 CB LYS A 7 9.376 2.399 4.491 1.00 0.00 C ATOM 95 CG LYS A 7 9.465 1.574 3.247 1.00 0.00 C ATOM 96 CD LYS A 7 8.106 1.393 2.533 1.00 0.00 C ATOM 97 CE LYS A 7 6.856 1.592 3.382 1.00 0.00 C ATOM 98 NZ LYS A 7 5.641 1.637 2.569 1.00 0.00 N ATOM 0 H LYS A 7 11.932 0.401 5.357 1.00 0.00 H new ATOM 0 HA LYS A 7 11.608 2.200 4.543 1.00 0.00 H new ATOM 0 HB2 LYS A 7 8.518 2.127 5.105 1.00 0.00 H new ATOM 0 HB3 LYS A 7 9.288 3.464 4.274 1.00 0.00 H new ATOM 0 HG2 LYS A 7 10.169 2.042 2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.869 0.593 3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 7 8.065 2.092 1.697 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.074 0.389 2.111 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.777 0.781 4.106 1.00 0.00 H new ATOM 0 HE3 LYS A 7 6.947 2.518 3.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 4.947 2.269 3.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 5.872 1.993 1.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 5.239 0.681 2.492 1.00 0.00 H new ATOM 112 N VAL A 8 10.769 4.229 5.853 1.00 0.00 N ATOM 113 CA VAL A 8 10.697 5.371 6.740 1.00 0.00 C ATOM 114 C VAL A 8 11.605 5.471 7.903 1.00 0.00 C ATOM 115 O VAL A 8 11.589 5.094 9.052 1.00 0.00 O ATOM 116 CB VAL A 8 9.193 5.257 7.163 1.00 0.00 C ATOM 117 CG1 VAL A 8 8.912 4.906 8.604 1.00 0.00 C ATOM 118 CG2 VAL A 8 8.412 6.548 6.932 1.00 0.00 C ATOM 0 H VAL A 8 10.790 4.441 4.855 1.00 0.00 H new ATOM 0 HA VAL A 8 11.035 6.276 6.234 1.00 0.00 H new ATOM 0 HB VAL A 8 8.878 4.433 6.523 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.835 4.859 8.764 1.00 0.00 H new ATOM 0 HG12 VAL A 8 9.356 3.938 8.836 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.342 5.667 9.255 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.377 6.408 7.244 1.00 0.00 H new ATOM 0 HG22 VAL A 8 8.860 7.353 7.514 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.440 6.806 5.873 1.00 0.00 H new ATOM 128 N ASP A 9 12.714 6.176 7.506 1.00 0.00 N ATOM 129 CA ASP A 9 13.804 6.455 8.412 1.00 0.00 C ATOM 130 C ASP A 9 13.372 7.593 9.354 1.00 0.00 C ATOM 131 O ASP A 9 12.207 7.831 9.651 1.00 0.00 O ATOM 132 CB ASP A 9 15.010 6.809 7.549 1.00 0.00 C ATOM 133 CG ASP A 9 15.184 5.805 6.413 1.00 0.00 C ATOM 134 OD1 ASP A 9 15.819 4.759 6.639 1.00 0.00 O ATOM 135 OD2 ASP A 9 14.685 6.093 5.351 1.00 0.00 O ATOM 0 H ASP A 9 12.845 6.545 6.564 1.00 0.00 H new ATOM 0 HA ASP A 9 14.070 5.608 9.044 1.00 0.00 H new ATOM 0 HB2 ASP A 9 14.886 7.811 7.138 1.00 0.00 H new ATOM 0 HB3 ASP A 9 15.909 6.826 8.164 1.00 0.00 H new ATOM 140 N ARG A 10 14.360 8.354 9.865 1.00 0.00 N ATOM 141 CA ARG A 10 14.111 9.451 10.760 1.00 0.00 C ATOM 142 C ARG A 10 14.711 10.770 10.237 1.00 0.00 C ATOM 143 O ARG A 10 15.654 10.758 9.487 1.00 0.00 O ATOM 144 CB ARG A 10 14.759 9.205 12.145 1.00 0.00 C ATOM 145 CG ARG A 10 14.534 7.829 12.770 1.00 0.00 C ATOM 146 CD ARG A 10 15.617 6.798 12.490 1.00 0.00 C ATOM 147 NE ARG A 10 15.633 5.821 13.581 1.00 0.00 N ATOM 148 CZ ARG A 10 16.330 4.685 13.503 1.00 0.00 C ATOM 149 NH1 ARG A 10 17.024 4.440 12.387 1.00 0.00 N ATOM 150 NH2 ARG A 10 16.369 3.775 14.475 1.00 0.00 N ATOM 0 H ARG A 10 15.347 8.208 9.655 1.00 0.00 H new ATOM 0 HA ARG A 10 13.026 9.524 10.835 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.833 9.366 12.052 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.383 9.959 12.836 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.442 7.950 13.849 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.582 7.437 12.411 1.00 0.00 H new ATOM 0 HD2 ARG A 10 15.426 6.299 11.540 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.589 7.285 12.405 1.00 0.00 H new ATOM 0 HE ARG A 10 15.095 6.014 14.426 1.00 0.00 H new ATOM 0 HH11 ARG A 10 17.013 5.114 11.621 1.00 0.00 H new ATOM 0 HH12 ARG A 10 17.565 3.580 12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.847 3.928 15.338 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.921 2.925 14.356 1.00 0.00 H new ATOM 164 N ASN A 11 14.066 11.872 10.711 1.00 0.00 N ATOM 165 CA ASN A 11 14.515 13.212 10.309 1.00 0.00 C ATOM 166 C ASN A 11 15.445 13.833 11.363 1.00 0.00 C ATOM 167 O ASN A 11 16.398 14.487 10.980 1.00 0.00 O ATOM 168 CB ASN A 11 13.324 14.119 10.102 1.00 0.00 C ATOM 169 CG ASN A 11 12.472 14.186 11.383 1.00 0.00 C ATOM 170 OD1 ASN A 11 12.813 14.839 12.362 1.00 0.00 O ATOM 171 ND2 ASN A 11 11.343 13.457 11.294 1.00 0.00 N ATOM 0 H ASN A 11 13.267 11.853 11.345 1.00 0.00 H new ATOM 0 HA ASN A 11 15.069 13.107 9.376 1.00 0.00 H new ATOM 0 HB2 ASN A 11 13.663 15.119 9.830 1.00 0.00 H new ATOM 0 HB3 ASN A 11 12.718 13.751 9.274 1.00 0.00 H new ATOM 0 HD21 ASN A 11 10.696 13.421 12.082 1.00 0.00 H new ATOM 0 HD22 ASN A 11 11.135 12.941 10.439 1.00 0.00 H new ATOM 178 N GLU A 12 15.156 13.620 12.652 1.00 0.00 N ATOM 179 CA GLU A 12 16.011 14.194 13.671 1.00 0.00 C ATOM 180 C GLU A 12 16.908 13.083 14.252 1.00 0.00 C ATOM 181 O GLU A 12 16.945 12.016 13.641 1.00 0.00 O ATOM 182 CB GLU A 12 15.042 14.798 14.695 1.00 0.00 C ATOM 183 CG GLU A 12 14.649 16.244 14.341 1.00 0.00 C ATOM 184 CD GLU A 12 14.969 17.169 15.518 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.059 17.151 16.089 1.00 0.00 O ATOM 186 OE2 GLU A 12 14.064 17.925 15.854 1.00 0.00 O ATOM 0 H GLU A 12 14.366 13.074 12.996 1.00 0.00 H new ATOM 0 HA GLU A 12 16.692 14.964 13.308 1.00 0.00 H new ATOM 0 HB2 GLU A 12 14.144 14.182 14.750 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.502 14.780 15.683 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.189 16.571 13.452 1.00 0.00 H new ATOM 0 HG3 GLU A 12 13.586 16.295 14.105 1.00 0.00 H new ATOM 193 N ASN A 13 17.534 13.459 15.377 1.00 0.00 N ATOM 194 CA ASN A 13 18.412 12.498 16.035 1.00 0.00 C ATOM 195 C ASN A 13 17.819 12.218 17.420 1.00 0.00 C ATOM 196 O ASN A 13 18.392 12.289 18.489 1.00 0.00 O ATOM 197 CB ASN A 13 19.831 13.063 16.110 1.00 0.00 C ATOM 198 CG ASN A 13 20.773 11.894 16.484 1.00 0.00 C ATOM 199 OD1 ASN A 13 20.950 11.593 17.638 1.00 0.00 O ATOM 200 ND2 ASN A 13 21.359 11.254 15.458 1.00 0.00 N ATOM 0 H ASN A 13 17.453 14.371 15.826 1.00 0.00 H new ATOM 0 HA ASN A 13 18.479 11.562 15.480 1.00 0.00 H new ATOM 0 HB2 ASN A 13 20.122 13.500 15.155 1.00 0.00 H new ATOM 0 HB3 ASN A 13 19.890 13.857 16.855 1.00 0.00 H new ATOM 0 HD21 ASN A 13 21.989 10.472 15.638 1.00 0.00 H new ATOM 0 HD22 ASN A 13 21.174 11.550 14.500 1.00 0.00 H new ATOM 207 N TYR A 14 16.542 11.869 17.267 1.00 0.00 N ATOM 208 CA TYR A 14 15.748 11.545 18.451 1.00 0.00 C ATOM 209 C TYR A 14 14.435 10.934 17.941 1.00 0.00 C ATOM 210 O TYR A 14 14.086 11.138 16.793 1.00 0.00 O ATOM 211 CB TYR A 14 15.469 12.815 19.266 1.00 0.00 C ATOM 212 CG TYR A 14 14.380 12.596 20.261 1.00 0.00 C ATOM 213 CD1 TYR A 14 14.536 11.805 21.378 1.00 0.00 C ATOM 214 CD2 TYR A 14 13.097 13.157 20.169 1.00 0.00 C ATOM 215 CE1 TYR A 14 13.506 11.604 22.298 1.00 0.00 C ATOM 216 CE2 TYR A 14 12.149 12.889 21.150 1.00 0.00 C ATOM 217 CZ TYR A 14 12.386 12.076 22.246 1.00 0.00 C ATOM 218 OH TYR A 14 11.433 11.809 23.211 1.00 0.00 O ATOM 0 H TYR A 14 16.051 11.805 16.375 1.00 0.00 H new ATOM 0 HA TYR A 14 16.276 10.849 19.104 1.00 0.00 H new ATOM 0 HB2 TYR A 14 16.378 13.125 19.782 1.00 0.00 H new ATOM 0 HB3 TYR A 14 15.191 13.627 18.594 1.00 0.00 H new ATOM 0 HD1 TYR A 14 15.488 11.324 21.548 1.00 0.00 H new ATOM 0 HD2 TYR A 14 12.846 13.797 19.336 1.00 0.00 H new ATOM 0 HE1 TYR A 14 13.725 10.965 23.141 1.00 0.00 H new ATOM 0 HE2 TYR A 14 11.173 13.340 21.052 1.00 0.00 H new ATOM 0 HH TYR A 14 10.603 12.281 22.990 1.00 0.00 H new ATOM 228 N SER A 15 13.750 10.193 18.844 1.00 0.00 N ATOM 229 CA SER A 15 12.492 9.591 18.405 1.00 0.00 C ATOM 230 C SER A 15 11.441 9.849 19.474 1.00 0.00 C ATOM 231 O SER A 15 11.679 9.504 20.632 1.00 0.00 O ATOM 232 CB SER A 15 12.744 8.086 18.258 1.00 0.00 C ATOM 233 OG SER A 15 12.977 7.787 16.899 1.00 0.00 O ATOM 0 H SER A 15 14.028 10.012 19.809 1.00 0.00 H new ATOM 0 HA SER A 15 12.144 10.008 17.460 1.00 0.00 H new ATOM 0 HB2 SER A 15 13.602 7.788 18.861 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.885 7.523 18.625 1.00 0.00 H new ATOM 0 HG SER A 15 13.141 6.826 16.799 1.00 0.00 H new ATOM 239 N GLY A 16 10.324 10.450 19.019 1.00 0.00 N ATOM 240 CA GLY A 16 9.256 10.741 19.962 1.00 0.00 C ATOM 241 C GLY A 16 7.979 9.927 19.645 1.00 0.00 C ATOM 242 O GLY A 16 7.820 8.786 20.043 1.00 0.00 O ATOM 0 H GLY A 16 10.152 10.727 18.053 1.00 0.00 H new ATOM 0 HA2 GLY A 16 9.591 10.514 20.974 1.00 0.00 H new ATOM 0 HA3 GLY A 16 9.026 11.806 19.934 1.00 0.00 H new ATOM 246 N ALA A 17 7.107 10.652 18.893 1.00 0.00 N ATOM 247 CA ALA A 17 5.861 10.018 18.523 1.00 0.00 C ATOM 248 C ALA A 17 5.625 10.384 17.055 1.00 0.00 C ATOM 249 O ALA A 17 5.828 11.559 16.693 1.00 0.00 O ATOM 250 CB ALA A 17 4.795 10.608 19.424 1.00 0.00 C ATOM 0 H ALA A 17 7.247 11.607 18.562 1.00 0.00 H new ATOM 0 HA ALA A 17 5.857 8.934 18.633 1.00 0.00 H new ATOM 0 HB1 ALA A 17 3.829 10.162 19.186 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.043 10.401 20.465 1.00 0.00 H new ATOM 0 HB3 ALA A 17 4.744 11.686 19.270 1.00 0.00 H new ATOM 256 N HIS A 18 5.209 9.388 16.260 1.00 0.00 N ATOM 257 CA HIS A 18 4.963 9.633 14.856 1.00 0.00 C ATOM 258 C HIS A 18 3.923 8.619 14.343 1.00 0.00 C ATOM 259 O HIS A 18 3.532 7.761 15.126 1.00 0.00 O ATOM 260 CB HIS A 18 6.294 9.512 14.104 1.00 0.00 C ATOM 261 CG HIS A 18 6.876 8.147 14.467 1.00 0.00 C ATOM 262 ND1 HIS A 18 6.432 6.908 14.000 1.00 0.00 N flip ATOM 263 CD2 HIS A 18 7.911 8.124 15.315 1.00 0.00 C flip ATOM 264 CE1 HIS A 18 7.239 6.032 14.593 1.00 0.00 C flip ATOM 265 NE2 HIS A 18 8.199 6.817 15.445 1.00 0.00 N flip ATOM 0 H HIS A 18 5.042 8.430 16.568 1.00 0.00 H new ATOM 0 HA HIS A 18 4.562 10.634 14.693 1.00 0.00 H new ATOM 0 HB2 HIS A 18 6.140 9.594 13.028 1.00 0.00 H new ATOM 0 HB3 HIS A 18 6.976 10.313 14.391 1.00 0.00 H new ATOM 0 HD2 HIS A 18 8.402 8.962 15.787 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.210 4.958 14.483 1.00 0.00 H new ATOM 0 HE2 HIS A 18 8.942 6.424 16.023 1.00 0.00 H new ATOM 274 N ASP A 19 3.562 8.817 13.048 1.00 0.00 N ATOM 275 CA ASP A 19 2.578 7.913 12.450 1.00 0.00 C ATOM 276 C ASP A 19 2.724 7.940 10.906 1.00 0.00 C ATOM 277 O ASP A 19 1.902 8.571 10.287 1.00 0.00 O ATOM 278 CB ASP A 19 1.220 8.347 12.951 1.00 0.00 C ATOM 279 CG ASP A 19 0.872 7.465 14.167 1.00 0.00 C ATOM 280 OD1 ASP A 19 0.952 6.243 14.010 1.00 0.00 O ATOM 281 OD2 ASP A 19 0.527 7.905 15.254 1.00 0.00 O ATOM 0 H ASP A 19 3.919 9.553 12.438 1.00 0.00 H new ATOM 0 HA ASP A 19 2.727 6.872 12.738 1.00 0.00 H new ATOM 0 HB2 ASP A 19 1.234 9.400 13.232 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.469 8.236 12.169 1.00 0.00 H new ATOM 286 N ASN A 20 3.791 7.234 10.454 1.00 0.00 N ATOM 287 CA ASN A 20 4.027 7.182 9.010 1.00 0.00 C ATOM 288 C ASN A 20 3.602 5.809 8.476 1.00 0.00 C ATOM 289 O ASN A 20 2.768 5.126 9.055 1.00 0.00 O ATOM 290 CB ASN A 20 5.499 7.494 8.820 1.00 0.00 C ATOM 291 CG ASN A 20 5.927 8.786 9.553 1.00 0.00 C ATOM 292 OD1 ASN A 20 5.459 9.147 10.610 1.00 0.00 O ATOM 293 ND2 ASN A 20 6.880 9.372 8.791 1.00 0.00 N ATOM 0 H ASN A 20 4.458 6.726 11.035 1.00 0.00 H new ATOM 0 HA ASN A 20 3.439 7.905 8.444 1.00 0.00 H new ATOM 0 HB2 ASN A 20 6.095 6.658 9.186 1.00 0.00 H new ATOM 0 HB3 ASN A 20 5.712 7.596 7.756 1.00 0.00 H new ATOM 0 HD21 ASN A 20 7.308 10.247 9.093 1.00 0.00 H new ATOM 0 HD22 ASN A 20 7.170 8.938 7.915 1.00 0.00 H new ATOM 300 N LEU A 21 4.231 5.480 7.350 1.00 0.00 N ATOM 301 CA LEU A 21 3.941 4.209 6.713 1.00 0.00 C ATOM 302 C LEU A 21 5.178 3.339 7.104 1.00 0.00 C ATOM 303 O LEU A 21 5.960 3.773 7.924 1.00 0.00 O ATOM 304 CB LEU A 21 3.914 4.300 5.186 1.00 0.00 C ATOM 305 CG LEU A 21 4.004 5.674 4.528 1.00 0.00 C ATOM 306 CD1 LEU A 21 3.046 6.695 5.139 1.00 0.00 C ATOM 307 CD2 LEU A 21 5.429 6.286 4.581 1.00 0.00 C ATOM 0 H LEU A 21 4.924 6.059 6.875 1.00 0.00 H new ATOM 0 HA LEU A 21 2.967 3.830 7.022 1.00 0.00 H new ATOM 0 HB2 LEU A 21 4.739 3.697 4.805 1.00 0.00 H new ATOM 0 HB3 LEU A 21 2.992 3.830 4.844 1.00 0.00 H new ATOM 0 HG LEU A 21 3.726 5.480 3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 21 3.159 7.651 4.628 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.020 6.343 5.029 1.00 0.00 H new ATOM 0 HD13 LEU A 21 3.275 6.821 6.197 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.424 7.262 4.096 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.738 6.398 5.620 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.127 5.628 4.064 1.00 0.00 H new ATOM 319 N LYS A 22 5.139 2.203 6.390 1.00 0.00 N ATOM 320 CA LYS A 22 6.203 1.258 6.530 1.00 0.00 C ATOM 321 C LYS A 22 5.568 -0.160 6.344 1.00 0.00 C ATOM 322 O LYS A 22 4.485 -0.436 6.804 1.00 0.00 O ATOM 323 CB LYS A 22 6.785 1.087 7.941 1.00 0.00 C ATOM 324 CG LYS A 22 8.201 1.624 8.216 1.00 0.00 C ATOM 325 CD LYS A 22 8.830 0.990 9.451 1.00 0.00 C ATOM 326 CE LYS A 22 9.735 1.881 10.307 1.00 0.00 C ATOM 327 NZ LYS A 22 10.274 1.150 11.460 1.00 0.00 N ATOM 0 H LYS A 22 4.400 1.942 5.737 1.00 0.00 H new ATOM 0 HA LYS A 22 6.966 1.611 5.836 1.00 0.00 H new ATOM 0 HB2 LYS A 22 6.104 1.570 8.642 1.00 0.00 H new ATOM 0 HB3 LYS A 22 6.782 0.022 8.175 1.00 0.00 H new ATOM 0 HG2 LYS A 22 8.834 1.433 7.350 1.00 0.00 H new ATOM 0 HG3 LYS A 22 8.158 2.705 8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 22 8.027 0.615 10.085 1.00 0.00 H new ATOM 0 HD3 LYS A 22 9.412 0.126 9.129 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.556 2.259 9.698 1.00 0.00 H new ATOM 0 HE3 LYS A 22 9.171 2.747 10.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 10.882 1.782 12.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 9.490 0.811 12.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 10.832 0.338 11.126 1.00 0.00 H new ATOM 341 N LEU A 23 6.454 -0.859 5.655 1.00 0.00 N ATOM 342 CA LEU A 23 6.136 -2.255 5.370 1.00 0.00 C ATOM 343 C LEU A 23 6.937 -2.872 6.565 1.00 0.00 C ATOM 344 O LEU A 23 7.764 -2.082 7.030 1.00 0.00 O ATOM 345 CB LEU A 23 6.533 -2.654 3.999 1.00 0.00 C ATOM 346 CG LEU A 23 5.373 -2.659 2.967 1.00 0.00 C ATOM 347 CD1 LEU A 23 5.936 -2.877 1.542 1.00 0.00 C ATOM 348 CD2 LEU A 23 4.340 -3.724 3.177 1.00 0.00 C ATOM 0 H LEU A 23 7.346 -0.515 5.300 1.00 0.00 H new ATOM 0 HA LEU A 23 5.091 -2.562 5.335 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.311 -1.976 3.648 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.972 -3.651 4.037 1.00 0.00 H new ATOM 0 HG LEU A 23 4.892 -1.690 3.099 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.116 -2.879 0.823 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.630 -2.073 1.298 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.459 -3.833 1.499 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.573 -3.644 2.406 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.812 -4.705 3.119 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.882 -3.599 4.158 1.00 0.00 H new ATOM 360 N THR A 24 6.658 -4.085 6.937 1.00 0.00 N ATOM 361 CA THR A 24 7.368 -4.708 8.070 1.00 0.00 C ATOM 362 C THR A 24 6.566 -6.015 8.249 1.00 0.00 C ATOM 363 O THR A 24 5.666 -6.168 9.032 1.00 0.00 O ATOM 364 CB THR A 24 7.249 -3.816 9.286 1.00 0.00 C ATOM 365 OG1 THR A 24 8.091 -2.686 9.357 1.00 0.00 O ATOM 366 CG2 THR A 24 7.300 -4.540 10.645 1.00 0.00 C ATOM 0 H THR A 24 5.956 -4.677 6.494 1.00 0.00 H new ATOM 0 HA THR A 24 8.435 -4.872 7.920 1.00 0.00 H new ATOM 0 HB THR A 24 6.240 -3.447 9.103 1.00 0.00 H new ATOM 0 HG1 THR A 24 7.875 -2.071 8.625 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.206 -3.811 11.450 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.480 -5.256 10.707 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.249 -5.067 10.741 1.00 0.00 H new ATOM 374 N ILE A 25 7.030 -6.916 7.401 1.00 0.00 N ATOM 375 CA ILE A 25 6.387 -8.210 7.423 1.00 0.00 C ATOM 376 C ILE A 25 7.244 -9.285 8.080 1.00 0.00 C ATOM 377 O ILE A 25 8.293 -9.595 7.583 1.00 0.00 O ATOM 378 CB ILE A 25 6.162 -8.533 5.943 1.00 0.00 C ATOM 379 CG1 ILE A 25 5.524 -7.374 5.177 1.00 0.00 C ATOM 380 CG2 ILE A 25 5.283 -9.797 5.788 1.00 0.00 C ATOM 381 CD1 ILE A 25 6.518 -6.457 4.446 1.00 0.00 C ATOM 0 H ILE A 25 7.793 -6.790 6.736 1.00 0.00 H new ATOM 0 HA ILE A 25 5.469 -8.188 8.010 1.00 0.00 H new ATOM 0 HB ILE A 25 7.148 -8.712 5.514 1.00 0.00 H new ATOM 0 HG12 ILE A 25 4.824 -7.781 4.448 1.00 0.00 H new ATOM 0 HG13 ILE A 25 4.943 -6.772 5.875 1.00 0.00 H new ATOM 0 HG21 ILE A 25 5.135 -10.010 4.729 1.00 0.00 H new ATOM 0 HG22 ILE A 25 5.778 -10.645 6.263 1.00 0.00 H new ATOM 0 HG23 ILE A 25 4.316 -9.629 6.263 1.00 0.00 H new ATOM 0 HD11 ILE A 25 5.973 -5.666 3.932 1.00 0.00 H new ATOM 0 HD12 ILE A 25 7.204 -6.015 5.168 1.00 0.00 H new ATOM 0 HD13 ILE A 25 7.083 -7.040 3.718 1.00 0.00 H new ATOM 393 N THR A 26 6.703 -9.782 9.187 1.00 0.00 N ATOM 394 CA THR A 26 7.406 -10.810 9.912 1.00 0.00 C ATOM 395 C THR A 26 6.414 -11.511 10.847 1.00 0.00 C ATOM 396 O THR A 26 6.373 -11.287 12.048 1.00 0.00 O ATOM 397 CB THR A 26 8.549 -10.252 10.746 1.00 0.00 C ATOM 398 OG1 THR A 26 9.306 -9.236 10.174 1.00 0.00 O ATOM 399 CG2 THR A 26 9.525 -11.383 11.170 1.00 0.00 C ATOM 0 H THR A 26 5.809 -9.495 9.585 1.00 0.00 H new ATOM 0 HA THR A 26 7.832 -11.501 9.185 1.00 0.00 H new ATOM 0 HB THR A 26 8.029 -9.803 11.592 1.00 0.00 H new ATOM 0 HG1 THR A 26 9.986 -8.936 10.812 1.00 0.00 H new ATOM 0 HG21 THR A 26 10.334 -10.961 11.765 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.988 -12.124 11.762 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.939 -11.859 10.281 1.00 0.00 H new ATOM 407 N GLN A 27 5.654 -12.362 10.115 1.00 0.00 N ATOM 408 CA GLN A 27 4.684 -13.054 10.958 1.00 0.00 C ATOM 409 C GLN A 27 5.315 -14.025 11.926 1.00 0.00 C ATOM 410 O GLN A 27 5.722 -13.697 13.029 1.00 0.00 O ATOM 411 CB GLN A 27 3.559 -13.657 10.059 1.00 0.00 C ATOM 412 CG GLN A 27 2.285 -12.825 10.106 1.00 0.00 C ATOM 413 CD GLN A 27 1.651 -12.831 11.484 1.00 0.00 C ATOM 414 OE1 GLN A 27 1.289 -13.895 11.969 1.00 0.00 O ATOM 415 NE2 GLN A 27 1.570 -11.602 12.013 1.00 0.00 N ATOM 0 H GLN A 27 5.681 -12.559 9.115 1.00 0.00 H new ATOM 0 HA GLN A 27 4.213 -12.331 11.624 1.00 0.00 H new ATOM 0 HB2 GLN A 27 3.912 -13.721 9.030 1.00 0.00 H new ATOM 0 HB3 GLN A 27 3.340 -14.674 10.385 1.00 0.00 H new ATOM 0 HG2 GLN A 27 2.512 -11.799 9.816 1.00 0.00 H new ATOM 0 HG3 GLN A 27 1.572 -13.212 9.378 1.00 0.00 H new ATOM 0 HE21 GLN A 27 1.916 -10.798 11.490 1.00 0.00 H new ATOM 0 HE22 GLN A 27 1.163 -11.471 12.939 1.00 0.00 H new ATOM 424 N GLU A 28 5.370 -15.275 11.413 1.00 0.00 N ATOM 425 CA GLU A 28 5.949 -16.391 12.168 1.00 0.00 C ATOM 426 C GLU A 28 7.003 -17.042 11.257 1.00 0.00 C ATOM 427 O GLU A 28 7.685 -17.915 11.833 1.00 0.00 O ATOM 428 CB GLU A 28 4.747 -17.275 12.494 1.00 0.00 C ATOM 429 CG GLU A 28 3.492 -16.489 12.842 1.00 0.00 C ATOM 430 CD GLU A 28 2.633 -17.403 13.718 1.00 0.00 C ATOM 431 OE1 GLU A 28 2.765 -18.610 13.535 1.00 0.00 O ATOM 432 OE2 GLU A 28 1.873 -16.907 14.539 1.00 0.00 O ATOM 0 H GLU A 28 5.022 -15.527 10.488 1.00 0.00 H new ATOM 0 HA GLU A 28 6.464 -16.141 13.095 1.00 0.00 H new ATOM 0 HB2 GLU A 28 4.538 -17.919 11.640 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.001 -17.927 13.330 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.745 -15.570 13.371 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.954 -16.199 11.940 1.00 0.00 H new ATOM 439 N GLY A 29 7.091 -16.636 9.985 1.00 0.00 N ATOM 440 CA GLY A 29 8.121 -17.305 9.176 1.00 0.00 C ATOM 441 C GLY A 29 7.231 -18.118 8.221 1.00 0.00 C ATOM 442 O GLY A 29 7.731 -18.656 7.246 1.00 0.00 O ATOM 0 H GLY A 29 6.526 -15.921 9.526 1.00 0.00 H new ATOM 0 HA2 GLY A 29 8.760 -16.597 8.648 1.00 0.00 H new ATOM 0 HA3 GLY A 29 8.775 -17.938 9.776 1.00 0.00 H new ATOM 446 N ASN A 30 5.932 -18.121 8.617 1.00 0.00 N ATOM 447 CA ASN A 30 4.968 -18.816 7.857 1.00 0.00 C ATOM 448 C ASN A 30 3.741 -17.929 7.549 1.00 0.00 C ATOM 449 O ASN A 30 3.215 -18.233 6.458 1.00 0.00 O ATOM 450 CB ASN A 30 4.337 -20.075 8.505 1.00 0.00 C ATOM 451 CG ASN A 30 5.306 -20.875 9.322 1.00 0.00 C ATOM 452 OD1 ASN A 30 5.816 -20.442 10.357 1.00 0.00 O ATOM 453 ND2 ASN A 30 5.594 -22.117 8.865 1.00 0.00 N ATOM 0 H ASN A 30 5.574 -17.648 9.447 1.00 0.00 H new ATOM 0 HA ASN A 30 5.561 -19.107 6.990 1.00 0.00 H new ATOM 0 HB2 ASN A 30 3.505 -19.769 9.139 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.924 -20.710 7.721 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.243 -22.712 9.380 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.162 -22.457 8.006 1.00 0.00 H new ATOM 460 N LYS A 31 3.374 -16.986 8.392 1.00 0.00 N ATOM 461 CA LYS A 31 2.207 -16.206 7.981 1.00 0.00 C ATOM 462 C LYS A 31 2.955 -14.932 7.537 1.00 0.00 C ATOM 463 O LYS A 31 4.185 -15.094 7.421 1.00 0.00 O ATOM 464 CB LYS A 31 1.256 -15.933 9.105 1.00 0.00 C ATOM 465 CG LYS A 31 1.144 -17.221 9.972 1.00 0.00 C ATOM 466 CD LYS A 31 -0.055 -17.151 10.875 1.00 0.00 C ATOM 467 CE LYS A 31 -0.205 -18.392 11.742 1.00 0.00 C ATOM 468 NZ LYS A 31 -1.558 -18.630 12.246 1.00 0.00 N ATOM 0 H LYS A 31 3.810 -16.748 9.283 1.00 0.00 H new ATOM 0 HA LYS A 31 1.562 -16.679 7.240 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.611 -15.098 9.709 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.278 -15.651 8.715 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.068 -18.095 9.325 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.048 -17.344 10.568 1.00 0.00 H new ATOM 0 HD2 LYS A 31 0.027 -16.272 11.515 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.953 -17.023 10.271 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.110 -19.261 11.165 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.474 -18.309 12.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -1.566 -19.494 12.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.859 -17.821 12.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.212 -18.744 11.445 1.00 0.00 H new ATOM 482 N PHE A 32 2.287 -13.819 7.335 1.00 0.00 N ATOM 483 CA PHE A 32 3.041 -12.650 6.937 1.00 0.00 C ATOM 484 C PHE A 32 1.908 -11.600 7.149 1.00 0.00 C ATOM 485 O PHE A 32 0.785 -12.028 7.105 1.00 0.00 O ATOM 486 CB PHE A 32 3.472 -12.652 5.494 1.00 0.00 C ATOM 487 CG PHE A 32 4.739 -13.467 5.334 1.00 0.00 C ATOM 488 CD1 PHE A 32 5.909 -13.050 5.938 1.00 0.00 C ATOM 489 CD2 PHE A 32 4.873 -14.634 4.633 1.00 0.00 C ATOM 490 CE1 PHE A 32 7.056 -13.787 5.801 1.00 0.00 C ATOM 491 CE2 PHE A 32 6.062 -15.344 4.524 1.00 0.00 C ATOM 492 CZ PHE A 32 7.145 -14.816 5.174 1.00 0.00 C ATOM 0 H PHE A 32 1.279 -13.697 7.432 1.00 0.00 H new ATOM 0 HA PHE A 32 3.981 -12.517 7.472 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.681 -13.068 4.870 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.642 -11.630 5.155 1.00 0.00 H new ATOM 0 HD1 PHE A 32 5.920 -12.140 6.520 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.000 -15.028 4.133 1.00 0.00 H new ATOM 0 HE1 PHE A 32 7.947 -13.421 6.290 1.00 0.00 H new ATOM 0 HE2 PHE A 32 6.128 -16.261 3.958 1.00 0.00 H new ATOM 0 HZ PHE A 32 8.095 -15.328 5.126 1.00 0.00 H new ATOM 502 N THR A 33 2.482 -10.424 7.335 1.00 0.00 N ATOM 503 CA THR A 33 1.454 -9.380 7.539 1.00 0.00 C ATOM 504 C THR A 33 2.152 -8.251 6.818 1.00 0.00 C ATOM 505 O THR A 33 3.315 -7.944 7.065 1.00 0.00 O ATOM 506 CB THR A 33 1.174 -9.235 9.003 1.00 0.00 C ATOM 507 OG1 THR A 33 -0.186 -9.396 9.343 1.00 0.00 O ATOM 508 CG2 THR A 33 1.514 -7.822 9.415 1.00 0.00 C ATOM 0 H THR A 33 3.471 -10.174 7.353 1.00 0.00 H new ATOM 0 HA THR A 33 0.442 -9.525 7.161 1.00 0.00 H new ATOM 0 HB THR A 33 1.762 -10.008 9.498 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.296 -9.291 10.311 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.317 -7.696 10.480 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.568 -7.629 9.216 1.00 0.00 H new ATOM 0 HG23 THR A 33 0.903 -7.120 8.847 1.00 0.00 H new ATOM 516 N VAL A 34 1.413 -7.639 5.920 1.00 0.00 N ATOM 517 CA VAL A 34 2.106 -6.524 5.213 1.00 0.00 C ATOM 518 C VAL A 34 1.787 -5.402 6.158 1.00 0.00 C ATOM 519 O VAL A 34 0.650 -5.087 6.435 1.00 0.00 O ATOM 520 CB VAL A 34 1.369 -6.611 3.882 1.00 0.00 C ATOM 521 CG1 VAL A 34 1.313 -5.400 2.969 1.00 0.00 C ATOM 522 CG2 VAL A 34 1.923 -7.720 2.969 1.00 0.00 C ATOM 0 H VAL A 34 0.446 -7.840 5.664 1.00 0.00 H new ATOM 0 HA VAL A 34 3.174 -6.471 5.001 1.00 0.00 H new ATOM 0 HB VAL A 34 0.368 -6.778 4.280 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.748 -5.648 2.070 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.825 -4.575 3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.325 -5.106 2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 34 1.361 -7.737 2.035 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.974 -7.525 2.757 1.00 0.00 H new ATOM 0 HG23 VAL A 34 1.826 -8.684 3.468 1.00 0.00 H new ATOM 532 N LYS A 35 2.942 -4.834 6.628 1.00 0.00 N ATOM 533 CA LYS A 35 2.799 -3.748 7.554 1.00 0.00 C ATOM 534 C LYS A 35 1.978 -2.531 7.152 1.00 0.00 C ATOM 535 O LYS A 35 1.528 -1.746 7.957 1.00 0.00 O ATOM 536 CB LYS A 35 4.084 -3.346 8.293 1.00 0.00 C ATOM 537 CG LYS A 35 3.826 -2.309 9.404 1.00 0.00 C ATOM 538 CD LYS A 35 4.831 -2.145 10.521 1.00 0.00 C ATOM 539 CE LYS A 35 4.210 -1.795 11.885 1.00 0.00 C ATOM 540 NZ LYS A 35 4.857 -0.686 12.562 1.00 0.00 N ATOM 0 H LYS A 35 3.894 -5.107 6.385 1.00 0.00 H new ATOM 0 HA LYS A 35 2.142 -4.251 8.263 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.542 -4.234 8.729 1.00 0.00 H new ATOM 0 HB3 LYS A 35 4.798 -2.938 7.578 1.00 0.00 H new ATOM 0 HG2 LYS A 35 3.712 -1.338 8.923 1.00 0.00 H new ATOM 0 HG3 LYS A 35 2.867 -2.553 9.861 1.00 0.00 H new ATOM 0 HD2 LYS A 35 5.400 -3.069 10.620 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.539 -1.363 10.246 1.00 0.00 H new ATOM 0 HE2 LYS A 35 3.156 -1.555 11.742 1.00 0.00 H new ATOM 0 HE3 LYS A 35 4.252 -2.674 12.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 4.384 -0.511 13.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 5.857 -0.918 12.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.795 0.166 11.969 1.00 0.00 H new ATOM 554 N GLU A 36 1.846 -2.493 5.815 1.00 0.00 N ATOM 555 CA GLU A 36 1.156 -1.522 5.037 1.00 0.00 C ATOM 556 C GLU A 36 0.607 -0.400 5.910 1.00 0.00 C ATOM 557 O GLU A 36 -0.584 -0.197 6.124 1.00 0.00 O ATOM 558 CB GLU A 36 -0.058 -2.250 4.374 1.00 0.00 C ATOM 559 CG GLU A 36 -0.296 -1.890 2.891 1.00 0.00 C ATOM 560 CD GLU A 36 -0.606 -0.394 2.817 1.00 0.00 C ATOM 561 OE1 GLU A 36 0.300 0.454 2.807 1.00 0.00 O ATOM 562 OE2 GLU A 36 -1.789 -0.080 2.767 1.00 0.00 O ATOM 0 H GLU A 36 2.265 -3.214 5.228 1.00 0.00 H new ATOM 0 HA GLU A 36 1.840 -1.090 4.307 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.095 -3.326 4.452 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -0.959 -2.014 4.940 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.585 -2.128 2.294 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.123 -2.472 2.485 1.00 0.00 H new ATOM 569 N SER A 37 1.564 0.375 6.461 1.00 0.00 N ATOM 570 CA SER A 37 1.117 1.453 7.325 1.00 0.00 C ATOM 571 C SER A 37 0.437 2.570 6.573 1.00 0.00 C ATOM 572 O SER A 37 1.003 3.075 5.619 1.00 0.00 O ATOM 573 CB SER A 37 2.301 1.871 8.211 1.00 0.00 C ATOM 574 OG SER A 37 2.444 0.878 9.207 1.00 0.00 O ATOM 0 H SER A 37 2.571 0.279 6.331 1.00 0.00 H new ATOM 0 HA SER A 37 0.319 1.109 7.983 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.213 1.958 7.620 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.119 2.846 8.662 1.00 0.00 H new ATOM 0 HG SER A 37 2.702 1.299 10.054 1.00 0.00 H new ATOM 580 N SER A 38 -0.795 2.926 7.051 1.00 0.00 N ATOM 581 CA SER A 38 -1.528 4.004 6.390 1.00 0.00 C ATOM 582 C SER A 38 -1.957 5.088 7.362 1.00 0.00 C ATOM 583 O SER A 38 -1.538 5.158 8.528 1.00 0.00 O ATOM 584 CB SER A 38 -2.752 3.292 5.780 1.00 0.00 C ATOM 585 OG SER A 38 -3.419 4.146 4.890 1.00 0.00 O ATOM 0 H SER A 38 -1.264 2.497 7.849 1.00 0.00 H new ATOM 0 HA SER A 38 -0.917 4.520 5.649 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.434 2.389 5.259 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.432 2.979 6.573 1.00 0.00 H new ATOM 0 HG SER A 38 -4.193 3.681 4.509 1.00 0.00 H new ATOM 591 N ASN A 39 -2.845 5.962 6.815 1.00 0.00 N ATOM 592 CA ASN A 39 -3.349 7.064 7.654 1.00 0.00 C ATOM 593 C ASN A 39 -4.357 6.403 8.601 1.00 0.00 C ATOM 594 O ASN A 39 -4.669 6.816 9.695 1.00 0.00 O ATOM 595 CB ASN A 39 -4.029 8.091 6.778 1.00 0.00 C ATOM 596 CG ASN A 39 -3.033 9.200 6.403 1.00 0.00 C ATOM 597 OD1 ASN A 39 -3.068 10.274 6.974 1.00 0.00 O ATOM 598 ND2 ASN A 39 -2.170 8.829 5.421 1.00 0.00 N ATOM 0 H ASN A 39 -3.203 5.927 5.860 1.00 0.00 H new ATOM 0 HA ASN A 39 -2.560 7.579 8.202 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -4.413 7.615 5.876 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -4.884 8.519 7.301 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -1.459 9.483 5.093 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -2.233 7.897 5.012 1.00 0.00 H new ATOM 605 N PHE A 40 -4.811 5.288 7.970 1.00 0.00 N ATOM 606 CA PHE A 40 -5.779 4.497 8.679 1.00 0.00 C ATOM 607 C PHE A 40 -5.000 3.458 9.502 1.00 0.00 C ATOM 608 O PHE A 40 -5.102 2.310 9.139 1.00 0.00 O ATOM 609 CB PHE A 40 -6.728 3.815 7.676 1.00 0.00 C ATOM 610 CG PHE A 40 -7.337 4.801 6.755 1.00 0.00 C ATOM 611 CD1 PHE A 40 -7.590 6.100 7.133 1.00 0.00 C ATOM 612 CD2 PHE A 40 -7.683 4.465 5.461 1.00 0.00 C ATOM 613 CE1 PHE A 40 -8.154 6.979 6.241 1.00 0.00 C ATOM 614 CE2 PHE A 40 -8.246 5.399 4.640 1.00 0.00 C ATOM 615 CZ PHE A 40 -8.469 6.536 4.971 1.00 0.00 C ATOM 0 H PHE A 40 -4.534 4.957 7.046 1.00 0.00 H new ATOM 0 HA PHE A 40 -6.390 5.113 9.339 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -6.178 3.069 7.102 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.513 3.286 8.217 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -7.345 6.429 8.132 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -7.508 3.463 5.098 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -8.348 8.002 6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -8.507 5.102 3.635 1.00 0.00 H new ATOM 0 HZ PHE A 40 -8.921 7.218 4.266 1.00 0.00 H new ATOM 625 N ARG A 41 -4.306 3.961 10.514 1.00 0.00 N ATOM 626 CA ARG A 41 -3.521 3.137 11.389 1.00 0.00 C ATOM 627 C ARG A 41 -2.408 2.373 10.707 1.00 0.00 C ATOM 628 O ARG A 41 -2.248 2.440 9.476 1.00 0.00 O ATOM 629 CB ARG A 41 -4.417 2.024 12.005 1.00 0.00 C ATOM 630 CG ARG A 41 -5.833 2.406 12.364 1.00 0.00 C ATOM 631 CD ARG A 41 -6.937 1.706 11.530 1.00 0.00 C ATOM 632 NE ARG A 41 -8.153 1.969 12.280 1.00 0.00 N ATOM 633 CZ ARG A 41 -9.374 1.967 11.730 1.00 0.00 C ATOM 634 NH1 ARG A 41 -9.562 1.719 10.450 1.00 0.00 N ATOM 635 NH2 ARG A 41 -10.445 2.216 12.493 1.00 0.00 N ATOM 0 H ARG A 41 -4.279 4.955 10.742 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.101 3.838 12.110 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.458 1.193 11.300 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.927 1.654 12.906 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.997 2.180 13.418 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.942 3.484 12.249 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -6.994 2.112 10.520 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -6.749 0.637 11.434 1.00 0.00 H new ATOM 0 HE ARG A 41 -8.073 2.165 13.278 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -8.764 1.521 9.846 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -10.506 1.725 10.063 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -10.329 2.406 13.488 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -11.377 2.216 12.079 1.00 0.00 H new ATOM 649 N ASN A 42 -1.645 1.643 11.543 1.00 0.00 N ATOM 650 CA ASN A 42 -0.587 0.924 10.826 1.00 0.00 C ATOM 651 C ASN A 42 -1.375 -0.170 10.075 1.00 0.00 C ATOM 652 O ASN A 42 -1.155 -0.434 8.907 1.00 0.00 O ATOM 653 CB ASN A 42 0.494 0.363 11.745 1.00 0.00 C ATOM 654 CG ASN A 42 1.423 1.492 12.209 1.00 0.00 C ATOM 655 OD1 ASN A 42 2.525 1.746 11.743 1.00 0.00 O ATOM 656 ND2 ASN A 42 0.836 2.176 13.229 1.00 0.00 N ATOM 0 H ASN A 42 -1.717 1.541 12.555 1.00 0.00 H new ATOM 0 HA ASN A 42 -0.012 1.568 10.161 1.00 0.00 H new ATOM 0 HB2 ASN A 42 0.035 -0.120 12.608 1.00 0.00 H new ATOM 0 HB3 ASN A 42 1.069 -0.400 11.221 1.00 0.00 H new ATOM 0 HD21 ASN A 42 1.320 2.963 13.660 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -0.088 1.901 13.562 1.00 0.00 H new ATOM 663 N ILE A 43 -2.259 -0.703 10.921 1.00 0.00 N ATOM 664 CA ILE A 43 -3.128 -1.770 10.448 1.00 0.00 C ATOM 665 C ILE A 43 -2.240 -2.951 10.112 1.00 0.00 C ATOM 666 O ILE A 43 -1.041 -2.995 9.895 1.00 0.00 O ATOM 667 CB ILE A 43 -3.856 -1.153 9.259 1.00 0.00 C ATOM 668 CG1 ILE A 43 -5.372 -1.325 9.312 1.00 0.00 C ATOM 669 CG2 ILE A 43 -3.445 -1.858 7.948 1.00 0.00 C ATOM 670 CD1 ILE A 43 -6.093 -0.519 8.237 1.00 0.00 C ATOM 0 H ILE A 43 -2.387 -0.426 11.894 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.867 -2.145 11.156 1.00 0.00 H new ATOM 0 HB ILE A 43 -3.586 -0.098 9.296 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.618 -2.380 9.196 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.734 -1.020 10.294 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.974 -1.405 7.110 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.370 -1.752 7.799 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.700 -2.916 8.009 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -7.168 -0.679 8.322 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.873 0.540 8.367 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.755 -0.841 7.252 1.00 0.00 H new ATOM 682 N ASP A 44 -3.056 -4.055 10.088 1.00 0.00 N ATOM 683 CA ASP A 44 -2.463 -5.329 9.787 1.00 0.00 C ATOM 684 C ASP A 44 -3.371 -6.058 8.805 1.00 0.00 C ATOM 685 O ASP A 44 -4.582 -6.044 8.925 1.00 0.00 O ATOM 686 CB ASP A 44 -2.376 -6.268 11.004 1.00 0.00 C ATOM 687 CG ASP A 44 -2.111 -5.535 12.314 1.00 0.00 C ATOM 688 OD1 ASP A 44 -1.517 -4.452 12.348 1.00 0.00 O ATOM 689 OD2 ASP A 44 -2.512 -6.063 13.365 1.00 0.00 O ATOM 0 H ASP A 44 -4.060 -4.058 10.266 1.00 0.00 H new ATOM 0 HA ASP A 44 -1.461 -5.117 9.413 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.308 -6.827 11.090 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.582 -6.996 10.836 1.00 0.00 H new ATOM 694 N VAL A 45 -2.640 -6.648 7.886 1.00 0.00 N ATOM 695 CA VAL A 45 -3.345 -7.412 6.832 1.00 0.00 C ATOM 696 C VAL A 45 -2.638 -8.779 6.981 1.00 0.00 C ATOM 697 O VAL A 45 -1.676 -8.966 6.253 1.00 0.00 O ATOM 698 CB VAL A 45 -3.215 -6.820 5.472 1.00 0.00 C ATOM 699 CG1 VAL A 45 -4.443 -6.974 4.539 1.00 0.00 C ATOM 700 CG2 VAL A 45 -3.076 -5.271 5.594 1.00 0.00 C ATOM 0 H VAL A 45 -1.622 -6.631 7.827 1.00 0.00 H new ATOM 0 HA VAL A 45 -4.429 -7.443 6.944 1.00 0.00 H new ATOM 0 HB VAL A 45 -2.363 -7.355 5.052 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -4.231 -6.505 3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -4.654 -8.033 4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.309 -6.493 4.995 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.981 -4.835 4.600 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -3.960 -4.864 6.086 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.190 -5.030 6.182 1.00 0.00 H new ATOM 710 N VAL A 46 -3.164 -9.610 7.893 1.00 0.00 N ATOM 711 CA VAL A 46 -2.427 -10.846 7.951 1.00 0.00 C ATOM 712 C VAL A 46 -3.125 -11.997 7.242 1.00 0.00 C ATOM 713 O VAL A 46 -4.324 -11.873 6.989 1.00 0.00 O ATOM 714 CB VAL A 46 -2.390 -11.198 9.462 1.00 0.00 C ATOM 715 CG1 VAL A 46 -3.584 -11.994 9.988 1.00 0.00 C ATOM 716 CG2 VAL A 46 -1.202 -12.103 9.857 1.00 0.00 C ATOM 0 H VAL A 46 -3.968 -9.475 8.506 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.456 -10.718 7.472 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.349 -10.195 9.888 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -3.454 -12.184 11.053 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -4.499 -11.424 9.830 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -3.652 -12.943 9.456 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -1.240 -12.308 10.927 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -1.261 -13.042 9.306 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.266 -11.599 9.617 1.00 0.00 H new ATOM 726 N PHE A 47 -2.248 -12.974 7.019 1.00 0.00 N ATOM 727 CA PHE A 47 -2.741 -14.144 6.355 1.00 0.00 C ATOM 728 C PHE A 47 -1.801 -15.321 6.553 1.00 0.00 C ATOM 729 O PHE A 47 -0.605 -15.013 6.681 1.00 0.00 O ATOM 730 CB PHE A 47 -2.822 -13.885 4.824 1.00 0.00 C ATOM 731 CG PHE A 47 -1.642 -13.017 4.430 1.00 0.00 C ATOM 732 CD1 PHE A 47 -1.818 -11.649 4.527 1.00 0.00 C ATOM 733 CD2 PHE A 47 -0.461 -13.520 4.002 1.00 0.00 C ATOM 734 CE1 PHE A 47 -0.769 -10.813 4.184 1.00 0.00 C ATOM 735 CE2 PHE A 47 0.542 -12.628 3.673 1.00 0.00 C ATOM 736 CZ PHE A 47 0.407 -11.426 3.756 1.00 0.00 C ATOM 0 H PHE A 47 -1.260 -12.972 7.274 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.721 -14.368 6.776 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -2.801 -14.827 4.277 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -3.760 -13.390 4.571 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -2.758 -11.239 4.865 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -0.307 -14.586 3.920 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -0.858 -9.738 4.245 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.487 -13.019 3.327 1.00 0.00 H new ATOM 0 HZ PHE A 47 1.242 -10.797 3.484 1.00 0.00 H new ATOM 746 N GLU A 48 -2.288 -16.571 6.577 1.00 0.00 N ATOM 747 CA GLU A 48 -1.279 -17.560 6.774 1.00 0.00 C ATOM 748 C GLU A 48 -0.665 -18.153 5.484 1.00 0.00 C ATOM 749 O GLU A 48 -0.662 -19.380 5.447 1.00 0.00 O ATOM 750 CB GLU A 48 -2.066 -18.674 7.530 1.00 0.00 C ATOM 751 CG GLU A 48 -1.145 -19.495 8.394 1.00 0.00 C ATOM 752 CD GLU A 48 -1.709 -20.877 8.714 1.00 0.00 C ATOM 753 OE1 GLU A 48 -2.179 -21.566 7.787 1.00 0.00 O ATOM 754 OE2 GLU A 48 -1.736 -21.362 9.839 1.00 0.00 O ATOM 0 H GLU A 48 -3.256 -16.876 6.474 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.418 -17.133 7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -2.842 -18.221 8.147 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.568 -19.321 6.811 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.185 -19.607 7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.955 -18.961 9.325 1.00 0.00 H new ATOM 761 N LEU A 49 -0.241 -17.227 4.636 1.00 0.00 N ATOM 762 CA LEU A 49 0.363 -17.482 3.364 1.00 0.00 C ATOM 763 C LEU A 49 -0.375 -18.486 2.507 1.00 0.00 C ATOM 764 O LEU A 49 -0.233 -19.693 2.442 1.00 0.00 O ATOM 765 CB LEU A 49 1.769 -18.030 3.706 1.00 0.00 C ATOM 766 CG LEU A 49 2.838 -17.733 2.656 1.00 0.00 C ATOM 767 CD1 LEU A 49 3.715 -18.930 2.233 1.00 0.00 C ATOM 768 CD2 LEU A 49 2.338 -17.189 1.306 1.00 0.00 C ATOM 0 H LEU A 49 -0.319 -16.231 4.840 1.00 0.00 H new ATOM 0 HA LEU A 49 0.365 -16.567 2.772 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.087 -17.608 4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.701 -19.109 3.842 1.00 0.00 H new ATOM 0 HG LEU A 49 3.393 -16.983 3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.438 -18.605 1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.243 -19.319 3.103 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.084 -19.712 1.812 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.188 -17.018 0.646 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.664 -17.913 0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.808 -16.250 1.466 1.00 0.00 H new ATOM 780 N GLY A 50 -1.287 -17.879 1.736 1.00 0.00 N ATOM 781 CA GLY A 50 -2.107 -18.671 0.830 1.00 0.00 C ATOM 782 C GLY A 50 -3.205 -19.280 1.746 1.00 0.00 C ATOM 783 O GLY A 50 -3.248 -20.480 1.754 1.00 0.00 O ATOM 0 H GLY A 50 -1.468 -16.875 1.724 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.541 -18.054 0.043 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.521 -19.448 0.339 1.00 0.00 H new ATOM 787 N VAL A 51 -3.905 -18.331 2.351 1.00 0.00 N ATOM 788 CA VAL A 51 -4.984 -18.622 3.250 1.00 0.00 C ATOM 789 C VAL A 51 -6.365 -18.214 2.759 1.00 0.00 C ATOM 790 O VAL A 51 -7.344 -18.879 3.082 1.00 0.00 O ATOM 791 CB VAL A 51 -4.810 -17.983 4.651 1.00 0.00 C ATOM 792 CG1 VAL A 51 -5.619 -16.751 4.985 1.00 0.00 C ATOM 793 CG2 VAL A 51 -5.262 -18.987 5.726 1.00 0.00 C ATOM 0 H VAL A 51 -3.730 -17.334 2.223 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.931 -19.709 3.306 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.757 -17.704 4.634 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.385 -16.426 5.999 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.375 -15.954 4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.682 -16.983 4.915 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.141 -18.542 6.714 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -6.310 -19.242 5.568 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -4.655 -19.890 5.659 1.00 0.00 H new ATOM 803 N ASP A 52 -6.250 -17.109 1.996 1.00 0.00 N ATOM 804 CA ASP A 52 -7.514 -16.594 1.445 1.00 0.00 C ATOM 805 C ASP A 52 -8.351 -15.977 2.592 1.00 0.00 C ATOM 806 O ASP A 52 -8.454 -16.498 3.685 1.00 0.00 O ATOM 807 CB ASP A 52 -8.233 -17.590 0.571 1.00 0.00 C ATOM 808 CG ASP A 52 -9.709 -17.703 0.963 1.00 0.00 C ATOM 809 OD1 ASP A 52 -10.540 -16.954 0.440 1.00 0.00 O ATOM 810 OD2 ASP A 52 -10.041 -18.534 1.804 1.00 0.00 O ATOM 0 H ASP A 52 -5.395 -16.603 1.766 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.305 -15.789 0.741 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.153 -17.287 -0.473 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -7.755 -18.566 0.657 1.00 0.00 H new ATOM 815 N PHE A 53 -8.910 -14.807 2.147 1.00 0.00 N ATOM 816 CA PHE A 53 -9.703 -14.145 3.121 1.00 0.00 C ATOM 817 C PHE A 53 -10.339 -12.834 2.699 1.00 0.00 C ATOM 818 O PHE A 53 -9.678 -12.144 1.920 1.00 0.00 O ATOM 819 CB PHE A 53 -8.786 -13.736 4.318 1.00 0.00 C ATOM 820 CG PHE A 53 -7.632 -12.910 3.762 1.00 0.00 C ATOM 821 CD1 PHE A 53 -6.528 -13.453 3.142 1.00 0.00 C ATOM 822 CD2 PHE A 53 -7.688 -11.542 3.887 1.00 0.00 C ATOM 823 CE1 PHE A 53 -5.542 -12.610 2.679 1.00 0.00 C ATOM 824 CE2 PHE A 53 -6.663 -10.759 3.397 1.00 0.00 C ATOM 825 CZ PHE A 53 -5.691 -11.250 2.849 1.00 0.00 C ATOM 0 H PHE A 53 -8.820 -14.378 1.226 1.00 0.00 H new ATOM 0 HA PHE A 53 -10.494 -14.863 3.337 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -9.350 -13.159 5.051 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -8.410 -14.621 4.830 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -6.437 -14.522 3.021 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -8.536 -11.079 4.370 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -4.665 -13.008 2.190 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -6.723 -9.686 3.501 1.00 0.00 H new ATOM 0 HZ PHE A 53 -4.916 -10.594 2.482 1.00 0.00 H new ATOM 835 N ALA A 54 -11.533 -12.524 3.189 1.00 0.00 N ATOM 836 CA ALA A 54 -12.185 -11.260 2.811 1.00 0.00 C ATOM 837 C ALA A 54 -12.079 -10.473 4.155 1.00 0.00 C ATOM 838 O ALA A 54 -12.339 -11.135 5.158 1.00 0.00 O ATOM 839 CB ALA A 54 -13.607 -11.407 2.327 1.00 0.00 C ATOM 0 H ALA A 54 -12.065 -13.109 3.834 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.721 -10.773 1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -14.007 -10.426 2.071 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -13.627 -12.048 1.446 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.215 -11.853 3.114 1.00 0.00 H new ATOM 845 N TYR A 55 -11.732 -9.200 4.058 1.00 0.00 N ATOM 846 CA TYR A 55 -11.663 -8.550 5.360 1.00 0.00 C ATOM 847 C TYR A 55 -12.041 -7.069 5.338 1.00 0.00 C ATOM 848 O TYR A 55 -11.257 -6.228 4.961 1.00 0.00 O ATOM 849 CB TYR A 55 -10.329 -8.796 6.055 1.00 0.00 C ATOM 850 CG TYR A 55 -10.498 -9.207 7.509 1.00 0.00 C ATOM 851 CD1 TYR A 55 -11.554 -8.936 8.329 1.00 0.00 C ATOM 852 CD2 TYR A 55 -9.482 -9.946 8.110 1.00 0.00 C ATOM 853 CE1 TYR A 55 -11.631 -9.352 9.648 1.00 0.00 C ATOM 854 CE2 TYR A 55 -9.625 -10.322 9.435 1.00 0.00 C ATOM 855 CZ TYR A 55 -10.749 -9.996 10.186 1.00 0.00 C ATOM 856 OH TYR A 55 -10.888 -10.365 11.483 1.00 0.00 O ATOM 0 H TYR A 55 -11.520 -8.656 3.222 1.00 0.00 H new ATOM 0 HA TYR A 55 -12.435 -9.030 5.961 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -9.783 -9.574 5.522 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -9.724 -7.891 6.004 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -12.377 -8.364 7.927 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -8.599 -10.221 7.553 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -12.509 -9.095 10.222 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -8.834 -10.890 9.903 1.00 0.00 H new ATOM 0 HH TYR A 55 -10.099 -10.874 11.765 1.00 0.00 H new ATOM 866 N SER A 56 -13.287 -6.887 5.769 1.00 0.00 N ATOM 867 CA SER A 56 -13.692 -5.468 5.763 1.00 0.00 C ATOM 868 C SER A 56 -12.879 -4.908 6.970 1.00 0.00 C ATOM 869 O SER A 56 -13.431 -5.048 8.064 1.00 0.00 O ATOM 870 CB SER A 56 -15.179 -5.518 5.968 1.00 0.00 C ATOM 871 OG SER A 56 -15.793 -6.667 5.417 1.00 0.00 O ATOM 0 H SER A 56 -13.958 -7.586 6.087 1.00 0.00 H new ATOM 0 HA SER A 56 -13.505 -4.855 4.881 1.00 0.00 H new ATOM 0 HB2 SER A 56 -15.390 -5.482 7.037 1.00 0.00 H new ATOM 0 HB3 SER A 56 -15.628 -4.629 5.524 1.00 0.00 H new ATOM 0 HG SER A 56 -16.401 -6.399 4.696 1.00 0.00 H new ATOM 877 N LEU A 57 -11.710 -4.362 6.628 1.00 0.00 N ATOM 878 CA LEU A 57 -10.792 -3.771 7.591 1.00 0.00 C ATOM 879 C LEU A 57 -11.086 -2.352 8.003 1.00 0.00 C ATOM 880 O LEU A 57 -11.767 -2.177 9.020 1.00 0.00 O ATOM 881 CB LEU A 57 -9.362 -3.896 7.041 1.00 0.00 C ATOM 882 CG LEU A 57 -8.416 -4.116 8.224 1.00 0.00 C ATOM 883 CD1 LEU A 57 -8.642 -5.523 8.809 1.00 0.00 C ATOM 884 CD2 LEU A 57 -6.942 -4.085 7.886 1.00 0.00 C ATOM 0 H LEU A 57 -11.376 -4.320 5.665 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.922 -4.334 8.515 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.295 -4.728 6.340 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.084 -2.995 6.494 1.00 0.00 H new ATOM 0 HG LEU A 57 -8.646 -3.293 8.901 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -7.968 -5.679 9.651 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -9.674 -5.615 9.148 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -8.444 -6.272 8.042 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.358 -4.251 8.791 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -6.718 -4.868 7.161 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.686 -3.114 7.462 1.00 0.00 H new ATOM 896 N ALA A 58 -10.629 -1.325 7.294 1.00 0.00 N ATOM 897 CA ALA A 58 -10.916 0.035 7.703 1.00 0.00 C ATOM 898 C ALA A 58 -12.366 0.455 7.675 1.00 0.00 C ATOM 899 O ALA A 58 -12.582 1.671 7.838 1.00 0.00 O ATOM 900 CB ALA A 58 -10.120 0.969 6.773 1.00 0.00 C ATOM 0 H ALA A 58 -10.067 -1.411 6.447 1.00 0.00 H new ATOM 0 HA ALA A 58 -10.631 0.098 8.753 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -10.310 2.006 7.050 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.055 0.757 6.869 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -10.431 0.806 5.741 1.00 0.00 H new ATOM 906 N ASP A 59 -13.334 -0.453 7.485 1.00 0.00 N ATOM 907 CA ASP A 59 -14.747 -0.068 7.453 1.00 0.00 C ATOM 908 C ASP A 59 -15.082 0.664 6.178 1.00 0.00 C ATOM 909 O ASP A 59 -16.180 1.199 6.078 1.00 0.00 O ATOM 910 CB ASP A 59 -15.093 0.809 8.676 1.00 0.00 C ATOM 911 CG ASP A 59 -16.465 0.450 9.181 1.00 0.00 C ATOM 912 OD1 ASP A 59 -16.634 -0.424 10.007 1.00 0.00 O ATOM 913 OD2 ASP A 59 -17.421 1.067 8.737 1.00 0.00 O ATOM 0 H ASP A 59 -13.164 -1.450 7.352 1.00 0.00 H new ATOM 0 HA ASP A 59 -15.344 -0.979 7.490 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -14.354 0.661 9.463 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.059 1.863 8.402 1.00 0.00 H new ATOM 918 N GLY A 60 -14.111 0.649 5.253 1.00 0.00 N ATOM 919 CA GLY A 60 -14.262 1.300 3.975 1.00 0.00 C ATOM 920 C GLY A 60 -13.107 0.752 3.102 1.00 0.00 C ATOM 921 O GLY A 60 -12.447 1.550 2.440 1.00 0.00 O ATOM 0 H GLY A 60 -13.212 0.185 5.383 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -15.232 1.076 3.531 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -14.200 2.384 4.075 1.00 0.00 H new ATOM 925 N THR A 61 -13.039 -0.575 3.234 1.00 0.00 N ATOM 926 CA THR A 61 -12.063 -1.385 2.542 1.00 0.00 C ATOM 927 C THR A 61 -12.657 -2.548 1.734 1.00 0.00 C ATOM 928 O THR A 61 -12.947 -2.370 0.557 1.00 0.00 O ATOM 929 CB THR A 61 -10.943 -1.878 3.499 1.00 0.00 C ATOM 930 OG1 THR A 61 -11.465 -2.185 4.742 1.00 0.00 O ATOM 931 CG2 THR A 61 -9.837 -0.817 3.593 1.00 0.00 C ATOM 0 H THR A 61 -13.669 -1.111 3.831 1.00 0.00 H new ATOM 0 HA THR A 61 -11.620 -0.717 1.803 1.00 0.00 H new ATOM 0 HB THR A 61 -10.503 -2.792 3.099 1.00 0.00 H new ATOM 0 HG1 THR A 61 -12.428 -2.347 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 61 -9.053 -1.167 4.265 1.00 0.00 H new ATOM 0 HG22 THR A 61 -9.415 -0.643 2.603 1.00 0.00 H new ATOM 0 HG23 THR A 61 -10.256 0.113 3.977 1.00 0.00 H new ATOM 939 N GLU A 62 -12.791 -3.673 2.447 1.00 0.00 N ATOM 940 CA GLU A 62 -13.350 -4.808 1.728 1.00 0.00 C ATOM 941 C GLU A 62 -12.373 -5.136 0.588 1.00 0.00 C ATOM 942 O GLU A 62 -12.685 -4.877 -0.559 1.00 0.00 O ATOM 943 CB GLU A 62 -14.733 -4.454 1.204 1.00 0.00 C ATOM 944 CG GLU A 62 -15.612 -5.685 1.063 1.00 0.00 C ATOM 945 CD GLU A 62 -16.418 -5.889 2.355 1.00 0.00 C ATOM 946 OE1 GLU A 62 -16.223 -5.156 3.319 1.00 0.00 O ATOM 947 OE2 GLU A 62 -17.232 -6.813 2.340 1.00 0.00 O ATOM 0 H GLU A 62 -12.545 -3.814 3.427 1.00 0.00 H new ATOM 0 HA GLU A 62 -13.470 -5.678 2.373 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -15.208 -3.743 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -14.640 -3.960 0.237 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -16.287 -5.568 0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -14.998 -6.563 0.862 1.00 0.00 H new ATOM 954 N LEU A 63 -11.232 -5.698 1.043 1.00 0.00 N ATOM 955 CA LEU A 63 -10.201 -6.065 0.134 1.00 0.00 C ATOM 956 C LEU A 63 -9.847 -7.560 0.164 1.00 0.00 C ATOM 957 O LEU A 63 -8.847 -7.988 0.706 1.00 0.00 O ATOM 958 CB LEU A 63 -8.907 -5.290 0.489 1.00 0.00 C ATOM 959 CG LEU A 63 -8.802 -3.885 -0.111 1.00 0.00 C ATOM 960 CD1 LEU A 63 -9.867 -2.922 0.404 1.00 0.00 C ATOM 961 CD2 LEU A 63 -7.470 -3.249 0.263 1.00 0.00 C ATOM 0 H LEU A 63 -11.032 -5.892 2.024 1.00 0.00 H new ATOM 0 HA LEU A 63 -10.582 -5.825 -0.859 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -8.837 -5.210 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -8.050 -5.875 0.156 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.921 -4.030 -1.185 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.732 -1.946 -0.063 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.856 -3.308 0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -9.775 -2.822 1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -7.409 -2.251 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -7.392 -3.179 1.348 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -6.654 -3.861 -0.121 1.00 0.00 H new ATOM 973 N THR A 64 -10.759 -8.313 -0.464 1.00 0.00 N ATOM 974 CA THR A 64 -10.740 -9.720 -0.631 1.00 0.00 C ATOM 975 C THR A 64 -9.302 -10.045 -1.148 1.00 0.00 C ATOM 976 O THR A 64 -9.016 -9.668 -2.277 1.00 0.00 O ATOM 977 CB THR A 64 -11.695 -10.136 -1.764 1.00 0.00 C ATOM 978 OG1 THR A 64 -12.995 -9.731 -1.464 1.00 0.00 O ATOM 979 CG2 THR A 64 -11.648 -11.636 -1.908 1.00 0.00 C ATOM 0 H THR A 64 -11.584 -7.893 -0.892 1.00 0.00 H new ATOM 0 HA THR A 64 -11.020 -10.222 0.295 1.00 0.00 H new ATOM 0 HB THR A 64 -11.389 -9.663 -2.697 1.00 0.00 H new ATOM 0 HG1 THR A 64 -13.597 -9.998 -2.190 1.00 0.00 H new ATOM 0 HG21 THR A 64 -12.320 -11.946 -2.708 1.00 0.00 H new ATOM 0 HG22 THR A 64 -10.631 -11.947 -2.148 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.958 -12.101 -0.972 1.00 0.00 H new ATOM 987 N GLY A 65 -8.569 -10.713 -0.278 1.00 0.00 N ATOM 988 CA GLY A 65 -7.224 -10.989 -0.820 1.00 0.00 C ATOM 989 C GLY A 65 -6.852 -12.419 -0.395 1.00 0.00 C ATOM 990 O GLY A 65 -7.697 -13.124 0.112 1.00 0.00 O ATOM 0 H GLY A 65 -8.809 -11.037 0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.220 -10.896 -1.906 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.499 -10.272 -0.436 1.00 0.00 H new ATOM 994 N THR A 66 -5.561 -12.606 -0.719 1.00 0.00 N ATOM 995 CA THR A 66 -4.861 -13.863 -0.503 1.00 0.00 C ATOM 996 C THR A 66 -3.466 -13.807 -1.033 1.00 0.00 C ATOM 997 O THR A 66 -3.229 -13.404 -2.166 1.00 0.00 O ATOM 998 CB THR A 66 -5.679 -14.969 -1.173 1.00 0.00 C ATOM 999 OG1 THR A 66 -5.239 -16.204 -0.676 1.00 0.00 O ATOM 1000 CG2 THR A 66 -5.418 -14.941 -2.691 1.00 0.00 C ATOM 0 H THR A 66 -4.980 -11.880 -1.139 1.00 0.00 H new ATOM 0 HA THR A 66 -4.769 -14.066 0.564 1.00 0.00 H new ATOM 0 HB THR A 66 -6.740 -14.823 -0.972 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.753 -16.926 -1.093 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.998 -15.727 -3.174 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.714 -13.972 -3.093 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.357 -15.104 -2.881 1.00 0.00 H new ATOM 1008 N TRP A 67 -2.406 -14.167 -0.270 1.00 0.00 N ATOM 1009 CA TRP A 67 -1.039 -14.039 -0.827 1.00 0.00 C ATOM 1010 C TRP A 67 -0.289 -15.299 -0.416 1.00 0.00 C ATOM 1011 O TRP A 67 -0.114 -15.586 0.745 1.00 0.00 O ATOM 1012 CB TRP A 67 -0.416 -12.780 -0.225 1.00 0.00 C ATOM 1013 CG TRP A 67 -1.518 -11.748 -0.552 1.00 0.00 C ATOM 1014 CD1 TRP A 67 -2.631 -11.544 0.283 1.00 0.00 C ATOM 1015 CD2 TRP A 67 -1.623 -10.896 -1.693 1.00 0.00 C ATOM 1016 NE1 TRP A 67 -3.340 -10.676 -0.330 1.00 0.00 N ATOM 1017 CE2 TRP A 67 -2.825 -10.227 -1.515 1.00 0.00 C ATOM 1018 CE3 TRP A 67 -0.903 -10.621 -2.800 1.00 0.00 C ATOM 1019 CZ2 TRP A 67 -3.225 -9.345 -2.463 1.00 0.00 C ATOM 1020 CZ3 TRP A 67 -1.316 -9.713 -3.756 1.00 0.00 C ATOM 1021 CH2 TRP A 67 -2.505 -9.053 -3.599 1.00 0.00 C ATOM 0 H TRP A 67 -2.462 -14.529 0.682 1.00 0.00 H new ATOM 0 HA TRP A 67 -1.016 -13.945 -1.913 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -0.239 -12.875 0.846 1.00 0.00 H new ATOM 0 HB3 TRP A 67 0.540 -12.528 -0.685 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -2.840 -12.016 1.232 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -4.230 -10.341 0.039 1.00 0.00 H new ATOM 0 HE3 TRP A 67 0.037 -11.133 -2.945 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -4.168 -8.839 -2.318 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -0.703 -9.524 -4.625 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -2.860 -8.340 -4.329 1.00 0.00 H new ATOM 1032 N THR A 68 0.058 -15.945 -1.538 1.00 0.00 N ATOM 1033 CA THR A 68 0.748 -17.185 -1.623 1.00 0.00 C ATOM 1034 C THR A 68 2.272 -17.116 -1.836 1.00 0.00 C ATOM 1035 O THR A 68 2.732 -18.016 -2.512 1.00 0.00 O ATOM 1036 CB THR A 68 0.196 -18.058 -2.748 1.00 0.00 C ATOM 1037 OG1 THR A 68 0.668 -17.681 -4.019 1.00 0.00 O ATOM 1038 CG2 THR A 68 -1.334 -18.081 -2.819 1.00 0.00 C ATOM 0 H THR A 68 -0.164 -15.566 -2.459 1.00 0.00 H new ATOM 0 HA THR A 68 0.575 -17.605 -0.632 1.00 0.00 H new ATOM 0 HB THR A 68 0.560 -19.053 -2.491 1.00 0.00 H new ATOM 0 HG1 THR A 68 1.643 -17.780 -4.049 1.00 0.00 H new ATOM 0 HG21 THR A 68 -1.650 -18.722 -3.642 1.00 0.00 H new ATOM 0 HG22 THR A 68 -1.736 -18.468 -1.883 1.00 0.00 H new ATOM 0 HG23 THR A 68 -1.706 -17.070 -2.983 1.00 0.00 H new ATOM 1046 N MET A 69 2.733 -16.052 -1.211 1.00 0.00 N ATOM 1047 CA MET A 69 4.117 -15.625 -1.154 1.00 0.00 C ATOM 1048 C MET A 69 4.980 -16.822 -1.513 1.00 0.00 C ATOM 1049 O MET A 69 5.108 -17.725 -0.704 1.00 0.00 O ATOM 1050 CB MET A 69 4.405 -15.269 0.337 1.00 0.00 C ATOM 1051 CG MET A 69 5.556 -14.247 0.401 1.00 0.00 C ATOM 1052 SD MET A 69 5.390 -13.135 1.778 1.00 0.00 S ATOM 1053 CE MET A 69 7.125 -12.916 2.248 1.00 0.00 C ATOM 0 H MET A 69 2.114 -15.424 -0.698 1.00 0.00 H new ATOM 0 HA MET A 69 4.315 -14.786 -1.822 1.00 0.00 H new ATOM 0 HB2 MET A 69 3.511 -14.857 0.804 1.00 0.00 H new ATOM 0 HB3 MET A 69 4.670 -16.168 0.893 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.506 -14.776 0.476 1.00 0.00 H new ATOM 0 HG3 MET A 69 5.583 -13.674 -0.526 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.186 -12.270 3.124 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.564 -13.886 2.482 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.671 -12.460 1.422 1.00 0.00 H new ATOM 1063 N GLU A 70 5.491 -16.698 -2.740 1.00 0.00 N ATOM 1064 CA GLU A 70 6.338 -17.763 -3.250 1.00 0.00 C ATOM 1065 C GLU A 70 7.588 -17.826 -2.415 1.00 0.00 C ATOM 1066 O GLU A 70 8.054 -18.876 -2.019 1.00 0.00 O ATOM 1067 CB GLU A 70 6.720 -17.516 -4.729 1.00 0.00 C ATOM 1068 CG GLU A 70 8.057 -18.056 -5.167 1.00 0.00 C ATOM 1069 CD GLU A 70 8.406 -17.466 -6.535 1.00 0.00 C ATOM 1070 OE1 GLU A 70 7.413 -17.245 -7.250 1.00 0.00 O ATOM 1071 OE2 GLU A 70 9.582 -17.252 -6.829 1.00 0.00 O ATOM 0 H GLU A 70 5.340 -15.909 -3.368 1.00 0.00 H new ATOM 0 HA GLU A 70 5.791 -18.704 -3.195 1.00 0.00 H new ATOM 0 HB2 GLU A 70 5.948 -17.956 -5.361 1.00 0.00 H new ATOM 0 HB3 GLU A 70 6.707 -16.442 -4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 70 8.825 -17.798 -4.438 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.024 -19.144 -5.223 1.00 0.00 H new ATOM 1078 N GLY A 71 8.070 -16.599 -2.203 1.00 0.00 N ATOM 1079 CA GLY A 71 9.264 -16.501 -1.425 1.00 0.00 C ATOM 1080 C GLY A 71 9.752 -15.046 -1.509 1.00 0.00 C ATOM 1081 O GLY A 71 10.215 -14.508 -0.517 1.00 0.00 O ATOM 0 H GLY A 71 7.670 -15.724 -2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 71 9.071 -16.781 -0.390 1.00 0.00 H new ATOM 0 HA3 GLY A 71 10.025 -17.183 -1.803 1.00 0.00 H new ATOM 1085 N ASN A 72 9.581 -14.559 -2.754 1.00 0.00 N ATOM 1086 CA ASN A 72 9.976 -13.192 -3.051 1.00 0.00 C ATOM 1087 C ASN A 72 8.946 -12.578 -4.016 1.00 0.00 C ATOM 1088 O ASN A 72 9.398 -11.729 -4.786 1.00 0.00 O ATOM 1089 CB ASN A 72 11.377 -13.162 -3.640 1.00 0.00 C ATOM 1090 CG ASN A 72 11.541 -14.434 -4.472 1.00 0.00 C ATOM 1091 OD1 ASN A 72 10.569 -14.796 -5.133 1.00 0.00 O ATOM 1092 ND2 ASN A 72 12.713 -15.030 -4.404 1.00 0.00 N ATOM 0 H ASN A 72 9.185 -15.080 -3.537 1.00 0.00 H new ATOM 0 HA ASN A 72 9.998 -12.602 -2.135 1.00 0.00 H new ATOM 0 HB2 ASN A 72 11.516 -12.276 -4.259 1.00 0.00 H new ATOM 0 HB3 ASN A 72 12.126 -13.119 -2.850 1.00 0.00 H new ATOM 0 HD21 ASN A 72 12.883 -15.884 -4.936 1.00 0.00 H new ATOM 0 HD22 ASN A 72 13.451 -14.638 -3.819 1.00 0.00 H new ATOM 1099 N LYS A 73 7.704 -13.063 -3.871 1.00 0.00 N ATOM 1100 CA LYS A 73 6.632 -12.571 -4.719 1.00 0.00 C ATOM 1101 C LYS A 73 5.362 -12.290 -3.915 1.00 0.00 C ATOM 1102 O LYS A 73 5.210 -12.857 -2.831 1.00 0.00 O ATOM 1103 CB LYS A 73 6.408 -13.459 -5.933 1.00 0.00 C ATOM 1104 CG LYS A 73 7.549 -13.543 -6.906 1.00 0.00 C ATOM 1105 CD LYS A 73 7.000 -13.830 -8.312 1.00 0.00 C ATOM 1106 CE LYS A 73 7.421 -12.681 -9.238 1.00 0.00 C ATOM 1107 NZ LYS A 73 7.189 -12.976 -10.646 1.00 0.00 N ATOM 0 H LYS A 73 7.431 -13.774 -3.193 1.00 0.00 H new ATOM 0 HA LYS A 73 6.944 -11.609 -5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.179 -14.466 -5.585 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.528 -13.098 -6.465 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.111 -12.609 -6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.240 -14.330 -6.606 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.387 -14.779 -8.684 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.914 -13.917 -8.285 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.871 -11.780 -8.965 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.479 -12.467 -9.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.444 -12.148 -11.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.773 -13.788 -10.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.185 -13.203 -10.792 1.00 0.00 H new ATOM 1121 N LEU A 74 4.537 -11.417 -4.510 1.00 0.00 N ATOM 1122 CA LEU A 74 3.312 -11.097 -3.804 1.00 0.00 C ATOM 1123 C LEU A 74 2.127 -11.117 -4.745 1.00 0.00 C ATOM 1124 O LEU A 74 1.408 -10.164 -4.967 1.00 0.00 O ATOM 1125 CB LEU A 74 3.525 -9.814 -2.990 1.00 0.00 C ATOM 1126 CG LEU A 74 3.875 -10.209 -1.520 1.00 0.00 C ATOM 1127 CD1 LEU A 74 4.269 -9.073 -0.621 1.00 0.00 C ATOM 1128 CD2 LEU A 74 2.744 -10.998 -0.837 1.00 0.00 C ATOM 0 H LEU A 74 4.685 -10.956 -5.408 1.00 0.00 H new ATOM 0 HA LEU A 74 3.057 -11.861 -3.070 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.329 -9.220 -3.424 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.626 -9.198 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 74 4.756 -10.838 -1.648 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.491 -9.457 0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.153 -8.579 -1.025 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.450 -8.357 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.039 -11.248 0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.839 -10.391 -0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.552 -11.915 -1.394 1.00 0.00 H new ATOM 1140 N VAL A 75 2.059 -12.379 -5.257 1.00 0.00 N ATOM 1141 CA VAL A 75 1.049 -12.775 -6.202 1.00 0.00 C ATOM 1142 C VAL A 75 -0.253 -13.218 -5.565 1.00 0.00 C ATOM 1143 O VAL A 75 -0.500 -14.331 -5.189 1.00 0.00 O ATOM 1144 CB VAL A 75 1.710 -13.856 -7.074 1.00 0.00 C ATOM 1145 CG1 VAL A 75 0.761 -14.555 -8.007 1.00 0.00 C ATOM 1146 CG2 VAL A 75 2.737 -13.190 -8.013 1.00 0.00 C ATOM 0 H VAL A 75 2.711 -13.123 -5.010 1.00 0.00 H new ATOM 0 HA VAL A 75 0.727 -11.925 -6.804 1.00 0.00 H new ATOM 0 HB VAL A 75 2.132 -14.570 -6.367 1.00 0.00 H new ATOM 0 HG11 VAL A 75 1.304 -15.302 -8.586 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.023 -15.044 -7.429 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.313 -13.827 -8.683 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.209 -13.951 -8.634 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.231 -12.465 -8.650 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.498 -12.683 -7.419 1.00 0.00 H new ATOM 1156 N GLY A 76 -1.052 -12.158 -5.505 1.00 0.00 N ATOM 1157 CA GLY A 76 -2.390 -12.358 -4.909 1.00 0.00 C ATOM 1158 C GLY A 76 -3.195 -11.179 -5.468 1.00 0.00 C ATOM 1159 O GLY A 76 -2.832 -10.654 -6.492 1.00 0.00 O ATOM 0 H GLY A 76 -0.833 -11.217 -5.831 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.822 -13.316 -5.199 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.353 -12.342 -3.820 1.00 0.00 H new ATOM 1163 N LYS A 77 -4.268 -10.884 -4.669 1.00 0.00 N ATOM 1164 CA LYS A 77 -4.982 -9.772 -5.242 1.00 0.00 C ATOM 1165 C LYS A 77 -6.043 -9.226 -4.325 1.00 0.00 C ATOM 1166 O LYS A 77 -6.913 -9.955 -3.909 1.00 0.00 O ATOM 1167 CB LYS A 77 -5.738 -10.449 -6.420 1.00 0.00 C ATOM 1168 CG LYS A 77 -6.997 -9.687 -6.762 1.00 0.00 C ATOM 1169 CD LYS A 77 -7.566 -10.015 -8.125 1.00 0.00 C ATOM 1170 CE LYS A 77 -8.121 -11.464 -8.139 1.00 0.00 C ATOM 1171 NZ LYS A 77 -8.511 -11.873 -9.483 1.00 0.00 N ATOM 0 H LYS A 77 -4.589 -11.316 -3.802 1.00 0.00 H new ATOM 0 HA LYS A 77 -4.306 -8.952 -5.484 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.089 -10.497 -7.294 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.990 -11.475 -6.153 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -7.753 -9.896 -6.005 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -6.786 -8.619 -6.716 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -8.360 -9.311 -8.375 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -6.793 -9.906 -8.886 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.365 -12.148 -7.754 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -8.981 -11.532 -7.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -8.878 -12.846 -9.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -9.250 -11.234 -9.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -7.684 -11.831 -10.112 1.00 0.00 H new ATOM 1185 N PHE A 78 -5.894 -7.916 -4.077 1.00 0.00 N ATOM 1186 CA PHE A 78 -6.888 -7.260 -3.200 1.00 0.00 C ATOM 1187 C PHE A 78 -7.679 -6.467 -4.248 1.00 0.00 C ATOM 1188 O PHE A 78 -7.364 -6.191 -5.373 1.00 0.00 O ATOM 1189 CB PHE A 78 -6.240 -6.386 -2.187 1.00 0.00 C ATOM 1190 CG PHE A 78 -5.092 -6.882 -1.413 1.00 0.00 C ATOM 1191 CD1 PHE A 78 -5.163 -7.704 -0.314 1.00 0.00 C ATOM 1192 CD2 PHE A 78 -3.789 -6.528 -1.774 1.00 0.00 C ATOM 1193 CE1 PHE A 78 -4.007 -8.100 0.292 1.00 0.00 C ATOM 1194 CE2 PHE A 78 -2.684 -6.965 -1.111 1.00 0.00 C ATOM 1195 CZ PHE A 78 -2.882 -7.795 -0.046 1.00 0.00 C ATOM 0 H PHE A 78 -5.151 -7.319 -4.440 1.00 0.00 H new ATOM 0 HA PHE A 78 -7.492 -7.935 -2.593 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -5.918 -5.480 -2.700 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -7.009 -6.092 -1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -6.120 -8.032 0.064 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.652 -5.874 -2.623 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -4.102 -8.745 1.153 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.691 -6.667 -1.415 1.00 0.00 H new ATOM 0 HZ PHE A 78 -2.034 -8.182 0.499 1.00 0.00 H new ATOM 1205 N LYS A 79 -8.842 -6.137 -3.651 1.00 0.00 N ATOM 1206 CA LYS A 79 -9.789 -5.394 -4.466 1.00 0.00 C ATOM 1207 C LYS A 79 -10.928 -4.816 -3.689 1.00 0.00 C ATOM 1208 O LYS A 79 -11.560 -5.523 -2.911 1.00 0.00 O ATOM 1209 CB LYS A 79 -10.279 -6.582 -5.358 1.00 0.00 C ATOM 1210 CG LYS A 79 -11.065 -6.263 -6.583 1.00 0.00 C ATOM 1211 CD LYS A 79 -12.395 -5.540 -6.257 1.00 0.00 C ATOM 1212 CE LYS A 79 -13.056 -5.000 -7.539 1.00 0.00 C ATOM 1213 NZ LYS A 79 -13.798 -6.023 -8.280 1.00 0.00 N ATOM 0 H LYS A 79 -9.122 -6.354 -2.694 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.371 -4.522 -4.969 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -9.402 -7.153 -5.664 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -10.886 -7.239 -4.734 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.466 -5.636 -7.243 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -11.278 -7.184 -7.125 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.074 -6.229 -5.755 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.207 -4.718 -5.566 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -13.734 -4.188 -7.276 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.287 -4.577 -8.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -14.219 -5.598 -9.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.151 -6.788 -8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -14.552 -6.410 -7.677 1.00 0.00 H new ATOM 1227 N ARG A 80 -11.179 -3.504 -3.928 1.00 0.00 N ATOM 1228 CA ARG A 80 -12.254 -2.851 -3.232 1.00 0.00 C ATOM 1229 C ARG A 80 -13.596 -3.127 -3.922 1.00 0.00 C ATOM 1230 O ARG A 80 -14.039 -2.364 -4.754 1.00 0.00 O ATOM 1231 CB ARG A 80 -11.980 -1.346 -3.068 1.00 0.00 C ATOM 1232 CG ARG A 80 -13.200 -0.716 -2.418 1.00 0.00 C ATOM 1233 CD ARG A 80 -12.744 0.405 -1.464 1.00 0.00 C ATOM 1234 NE ARG A 80 -11.809 1.312 -2.090 1.00 0.00 N ATOM 1235 CZ ARG A 80 -10.712 1.784 -1.501 1.00 0.00 C ATOM 1236 NH1 ARG A 80 -10.338 1.477 -0.270 1.00 0.00 N ATOM 1237 NH2 ARG A 80 -9.975 2.612 -2.245 1.00 0.00 N ATOM 0 H ARG A 80 -10.658 -2.917 -4.579 1.00 0.00 H new ATOM 0 HA ARG A 80 -12.316 -3.269 -2.227 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -11.094 -1.184 -2.453 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -11.784 -0.886 -4.037 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -13.866 -0.312 -3.181 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -13.764 -1.470 -1.869 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -13.615 0.964 -1.121 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -12.282 -0.038 -0.582 1.00 0.00 H new ATOM 0 HE ARG A 80 -12.002 1.610 -3.046 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -10.904 0.841 0.291 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -9.484 1.877 0.118 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -10.268 2.841 -3.195 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -9.119 3.015 -1.864 1.00 0.00 H new ATOM 1251 N VAL A 81 -14.135 -4.261 -3.479 1.00 0.00 N ATOM 1252 CA VAL A 81 -15.384 -4.825 -3.911 1.00 0.00 C ATOM 1253 C VAL A 81 -16.460 -3.712 -4.044 1.00 0.00 C ATOM 1254 O VAL A 81 -17.308 -3.831 -4.927 1.00 0.00 O ATOM 1255 CB VAL A 81 -15.909 -5.816 -2.901 1.00 0.00 C ATOM 1256 CG1 VAL A 81 -17.156 -6.567 -3.433 1.00 0.00 C ATOM 1257 CG2 VAL A 81 -14.935 -6.965 -2.547 1.00 0.00 C ATOM 0 H VAL A 81 -13.676 -4.832 -2.770 1.00 0.00 H new ATOM 0 HA VAL A 81 -15.199 -5.314 -4.867 1.00 0.00 H new ATOM 0 HB VAL A 81 -16.100 -5.184 -2.033 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -17.506 -7.272 -2.679 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -17.946 -5.849 -3.653 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -16.894 -7.109 -4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -15.401 -7.624 -1.815 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -14.699 -7.532 -3.447 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -14.018 -6.549 -2.129 1.00 0.00 H new ATOM 1267 N ASP A 82 -16.254 -2.773 -3.111 1.00 0.00 N ATOM 1268 CA ASP A 82 -17.099 -1.608 -2.978 1.00 0.00 C ATOM 1269 C ASP A 82 -17.112 -0.854 -4.307 1.00 0.00 C ATOM 1270 O ASP A 82 -18.246 -0.506 -4.695 1.00 0.00 O ATOM 1271 CB ASP A 82 -16.578 -0.663 -1.889 1.00 0.00 C ATOM 1272 CG ASP A 82 -17.509 -0.601 -0.700 1.00 0.00 C ATOM 1273 OD1 ASP A 82 -17.610 -1.616 -0.012 1.00 0.00 O ATOM 1274 OD2 ASP A 82 -18.111 0.437 -0.466 1.00 0.00 O ATOM 0 H ASP A 82 -15.493 -2.812 -2.433 1.00 0.00 H new ATOM 0 HA ASP A 82 -18.100 -1.940 -2.703 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -15.593 -0.996 -1.561 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -16.455 0.337 -2.305 1.00 0.00 H new ATOM 1279 N ASN A 83 -15.929 -0.632 -4.930 1.00 0.00 N ATOM 1280 CA ASN A 83 -16.062 0.084 -6.170 1.00 0.00 C ATOM 1281 C ASN A 83 -15.832 -0.792 -7.369 1.00 0.00 C ATOM 1282 O ASN A 83 -16.030 -0.297 -8.493 1.00 0.00 O ATOM 1283 CB ASN A 83 -14.902 1.123 -6.163 1.00 0.00 C ATOM 1284 CG ASN A 83 -15.199 2.152 -5.095 1.00 0.00 C ATOM 1285 OD1 ASN A 83 -15.482 1.880 -3.952 1.00 0.00 O ATOM 1286 ND2 ASN A 83 -15.128 3.421 -5.512 1.00 0.00 N ATOM 0 H ASN A 83 -14.995 -0.906 -4.627 1.00 0.00 H new ATOM 0 HA ASN A 83 -17.066 0.503 -6.240 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -13.951 0.630 -5.962 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -14.814 1.601 -7.138 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -15.315 4.183 -4.860 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -14.887 3.626 -6.482 1.00 0.00 H new ATOM 1293 N GLY A 84 -15.429 -2.048 -7.136 1.00 0.00 N ATOM 1294 CA GLY A 84 -15.232 -2.782 -8.406 1.00 0.00 C ATOM 1295 C GLY A 84 -13.880 -2.172 -8.879 1.00 0.00 C ATOM 1296 O GLY A 84 -13.649 -1.854 -10.012 1.00 0.00 O ATOM 0 H GLY A 84 -15.255 -2.521 -6.249 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -15.171 -3.860 -8.257 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -16.039 -2.604 -9.117 1.00 0.00 H new ATOM 1300 N LYS A 85 -13.111 -2.085 -7.774 1.00 0.00 N ATOM 1301 CA LYS A 85 -11.806 -1.521 -7.840 1.00 0.00 C ATOM 1302 C LYS A 85 -10.635 -2.328 -8.301 1.00 0.00 C ATOM 1303 O LYS A 85 -10.338 -2.105 -9.497 1.00 0.00 O ATOM 1304 CB LYS A 85 -11.547 -1.106 -6.351 1.00 0.00 C ATOM 1305 CG LYS A 85 -10.145 -0.568 -6.170 1.00 0.00 C ATOM 1306 CD LYS A 85 -10.143 0.894 -6.653 1.00 0.00 C ATOM 1307 CE LYS A 85 -10.379 1.995 -5.644 1.00 0.00 C ATOM 1308 NZ LYS A 85 -10.373 3.306 -6.328 1.00 0.00 N ATOM 0 H LYS A 85 -13.394 -2.403 -6.847 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.842 -0.760 -8.620 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.272 -0.349 -6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.696 -1.967 -5.699 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.844 -0.626 -5.124 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -9.430 -1.161 -6.741 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -9.181 1.083 -7.129 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.905 0.987 -7.427 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -11.333 1.841 -5.140 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.605 1.971 -4.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.535 4.061 -5.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.453 3.453 -6.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.127 3.327 -7.044 1.00 0.00 H new ATOM 1322 N GLU A 86 -10.069 -3.129 -7.405 1.00 0.00 N ATOM 1323 CA GLU A 86 -8.897 -3.899 -7.751 1.00 0.00 C ATOM 1324 C GLU A 86 -7.635 -3.050 -7.391 1.00 0.00 C ATOM 1325 O GLU A 86 -7.578 -1.980 -7.948 1.00 0.00 O ATOM 1326 CB GLU A 86 -8.774 -4.392 -9.165 1.00 0.00 C ATOM 1327 CG GLU A 86 -9.903 -5.294 -9.697 1.00 0.00 C ATOM 1328 CD GLU A 86 -9.538 -6.767 -9.631 1.00 0.00 C ATOM 1329 OE1 GLU A 86 -8.803 -7.204 -8.760 1.00 0.00 O ATOM 1330 OE2 GLU A 86 -10.006 -7.526 -10.488 1.00 0.00 O ATOM 0 H GLU A 86 -10.402 -3.256 -6.449 1.00 0.00 H new ATOM 0 HA GLU A 86 -8.993 -4.818 -7.172 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.698 -3.524 -9.820 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.835 -4.939 -9.251 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -10.809 -5.119 -9.117 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -10.127 -5.023 -10.729 1.00 0.00 H new ATOM 1337 N LEU A 87 -6.840 -3.645 -6.528 1.00 0.00 N ATOM 1338 CA LEU A 87 -5.613 -2.978 -6.087 1.00 0.00 C ATOM 1339 C LEU A 87 -4.582 -4.001 -5.667 1.00 0.00 C ATOM 1340 O LEU A 87 -3.992 -3.908 -4.633 1.00 0.00 O ATOM 1341 CB LEU A 87 -5.867 -1.854 -5.064 1.00 0.00 C ATOM 1342 CG LEU A 87 -6.326 -2.309 -3.663 1.00 0.00 C ATOM 1343 CD1 LEU A 87 -6.538 -1.016 -2.831 1.00 0.00 C ATOM 1344 CD2 LEU A 87 -7.608 -3.125 -3.642 1.00 0.00 C ATOM 0 H LEU A 87 -7.006 -4.565 -6.121 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.188 -2.444 -6.937 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.950 -1.275 -4.954 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.622 -1.182 -5.472 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.560 -2.972 -3.261 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.865 -1.280 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.601 -0.462 -2.774 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.297 -0.396 -3.308 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.849 -3.398 -2.615 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.422 -2.534 -4.061 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.473 -4.029 -4.236 1.00 0.00 H new ATOM 1356 N ILE A 88 -4.504 -4.927 -6.623 1.00 0.00 N ATOM 1357 CA ILE A 88 -3.587 -6.049 -6.486 1.00 0.00 C ATOM 1358 C ILE A 88 -2.213 -5.404 -6.177 1.00 0.00 C ATOM 1359 O ILE A 88 -1.983 -4.387 -6.770 1.00 0.00 O ATOM 1360 CB ILE A 88 -3.594 -6.793 -7.800 1.00 0.00 C ATOM 1361 CG1 ILE A 88 -5.018 -7.385 -8.024 1.00 0.00 C ATOM 1362 CG2 ILE A 88 -2.656 -7.946 -8.031 1.00 0.00 C ATOM 1363 CD1 ILE A 88 -5.393 -7.589 -9.484 1.00 0.00 C ATOM 0 H ILE A 88 -5.054 -4.921 -7.482 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.846 -6.761 -5.702 1.00 0.00 H new ATOM 0 HB ILE A 88 -3.254 -6.014 -8.483 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.085 -8.342 -7.507 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.750 -6.722 -7.563 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.813 -8.348 -9.032 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.626 -7.602 -7.935 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.848 -8.725 -7.293 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.399 -8.004 -9.547 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.362 -6.632 -10.005 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -4.687 -8.278 -9.948 1.00 0.00 H new ATOM 1375 N ALA A 89 -1.488 -6.073 -5.302 1.00 0.00 N ATOM 1376 CA ALA A 89 -0.170 -5.677 -4.849 1.00 0.00 C ATOM 1377 C ALA A 89 0.789 -6.608 -5.558 1.00 0.00 C ATOM 1378 O ALA A 89 1.535 -7.328 -4.928 1.00 0.00 O ATOM 1379 CB ALA A 89 -0.045 -5.936 -3.327 1.00 0.00 C ATOM 0 H ALA A 89 -1.813 -6.939 -4.872 1.00 0.00 H new ATOM 0 HA ALA A 89 0.025 -4.624 -5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 89 0.947 -5.638 -2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.800 -5.356 -2.796 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -0.194 -6.997 -3.125 1.00 0.00 H new ATOM 1385 N VAL A 90 0.677 -6.507 -6.868 1.00 0.00 N ATOM 1386 CA VAL A 90 1.528 -7.344 -7.621 1.00 0.00 C ATOM 1387 C VAL A 90 2.994 -6.980 -7.388 1.00 0.00 C ATOM 1388 O VAL A 90 3.464 -5.985 -7.951 1.00 0.00 O ATOM 1389 CB VAL A 90 1.319 -7.159 -9.134 1.00 0.00 C ATOM 1390 CG1 VAL A 90 2.521 -7.693 -9.942 1.00 0.00 C ATOM 1391 CG2 VAL A 90 0.161 -7.897 -9.756 1.00 0.00 C ATOM 0 H VAL A 90 0.047 -5.894 -7.385 1.00 0.00 H new ATOM 0 HA VAL A 90 1.293 -8.360 -7.303 1.00 0.00 H new ATOM 0 HB VAL A 90 1.154 -6.083 -9.187 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.338 -7.546 -11.006 1.00 0.00 H new ATOM 0 HG12 VAL A 90 3.423 -7.155 -9.651 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.652 -8.756 -9.740 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.124 -7.682 -10.824 1.00 0.00 H new ATOM 0 HG22 VAL A 90 0.290 -8.969 -9.606 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.769 -7.574 -9.289 1.00 0.00 H new ATOM 1401 N ARG A 91 3.689 -7.800 -6.563 1.00 0.00 N ATOM 1402 CA ARG A 91 5.069 -7.458 -6.375 1.00 0.00 C ATOM 1403 C ARG A 91 5.933 -8.717 -6.336 1.00 0.00 C ATOM 1404 O ARG A 91 5.474 -9.812 -6.567 1.00 0.00 O ATOM 1405 CB ARG A 91 5.427 -6.733 -5.080 1.00 0.00 C ATOM 1406 CG ARG A 91 6.080 -5.366 -5.224 1.00 0.00 C ATOM 1407 CD ARG A 91 7.496 -5.218 -5.731 1.00 0.00 C ATOM 1408 NE ARG A 91 7.699 -5.687 -7.077 1.00 0.00 N ATOM 1409 CZ ARG A 91 7.101 -5.182 -8.159 1.00 0.00 C ATOM 1410 NH1 ARG A 91 6.237 -4.184 -8.173 1.00 0.00 N ATOM 1411 NH2 ARG A 91 7.404 -5.736 -9.353 1.00 0.00 N ATOM 0 H ARG A 91 3.338 -8.621 -6.071 1.00 0.00 H new ATOM 0 HA ARG A 91 5.253 -6.791 -7.217 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.517 -6.616 -4.492 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.097 -7.372 -4.505 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.443 -4.779 -5.886 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.043 -4.892 -4.243 1.00 0.00 H new ATOM 0 HD2 ARG A 91 7.779 -4.167 -5.679 1.00 0.00 H new ATOM 0 HD3 ARG A 91 8.166 -5.762 -5.065 1.00 0.00 H new ATOM 0 HE ARG A 91 8.347 -6.462 -7.214 1.00 0.00 H new ATOM 0 HH11 ARG A 91 5.972 -3.726 -7.301 1.00 0.00 H new ATOM 0 HH12 ARG A 91 5.834 -3.871 -9.056 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.067 -6.510 -9.403 1.00 0.00 H new ATOM 0 HH22 ARG A 91 6.970 -5.381 -10.205 1.00 0.00 H new ATOM 1425 N GLU A 92 7.171 -8.302 -6.026 1.00 0.00 N ATOM 1426 CA GLU A 92 8.212 -9.294 -5.945 1.00 0.00 C ATOM 1427 C GLU A 92 9.518 -8.513 -5.655 1.00 0.00 C ATOM 1428 O GLU A 92 9.993 -7.997 -6.670 1.00 0.00 O ATOM 1429 CB GLU A 92 8.262 -9.850 -7.363 1.00 0.00 C ATOM 1430 CG GLU A 92 7.607 -8.986 -8.486 1.00 0.00 C ATOM 1431 CD GLU A 92 8.469 -9.093 -9.729 1.00 0.00 C ATOM 1432 OE1 GLU A 92 8.290 -10.082 -10.455 1.00 0.00 O ATOM 1433 OE2 GLU A 92 9.272 -8.191 -9.928 1.00 0.00 O ATOM 0 H GLU A 92 7.450 -7.339 -5.840 1.00 0.00 H new ATOM 0 HA GLU A 92 8.068 -10.071 -5.195 1.00 0.00 H new ATOM 0 HB2 GLU A 92 9.307 -10.012 -7.627 1.00 0.00 H new ATOM 0 HB3 GLU A 92 7.778 -10.827 -7.361 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.596 -9.335 -8.693 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.526 -7.947 -8.168 1.00 0.00 H new ATOM 1440 N ILE A 93 9.916 -8.506 -4.405 1.00 0.00 N ATOM 1441 CA ILE A 93 11.141 -7.815 -4.024 1.00 0.00 C ATOM 1442 C ILE A 93 12.212 -8.036 -5.079 1.00 0.00 C ATOM 1443 O ILE A 93 12.869 -9.069 -5.144 1.00 0.00 O ATOM 1444 CB ILE A 93 11.529 -8.274 -2.610 1.00 0.00 C ATOM 1445 CG1 ILE A 93 13.040 -8.031 -2.362 1.00 0.00 C ATOM 1446 CG2 ILE A 93 11.399 -9.776 -2.376 1.00 0.00 C ATOM 1447 CD1 ILE A 93 13.556 -6.655 -2.727 1.00 0.00 C ATOM 0 H ILE A 93 9.422 -8.962 -3.638 1.00 0.00 H new ATOM 0 HA ILE A 93 11.004 -6.734 -3.982 1.00 0.00 H new ATOM 0 HB ILE A 93 10.853 -7.712 -1.966 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.249 -8.208 -1.307 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.605 -8.772 -2.927 1.00 0.00 H new ATOM 0 HG21 ILE A 93 11.693 -10.012 -1.353 1.00 0.00 H new ATOM 0 HG22 ILE A 93 10.365 -10.081 -2.536 1.00 0.00 H new ATOM 0 HG23 ILE A 93 12.046 -10.310 -3.072 1.00 0.00 H new ATOM 0 HD11 ILE A 93 14.623 -6.598 -2.512 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.389 -6.474 -3.789 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.027 -5.901 -2.143 1.00 0.00 H new ATOM 1459 N SER A 94 12.272 -6.953 -5.869 1.00 0.00 N ATOM 1460 CA SER A 94 13.233 -7.001 -6.942 1.00 0.00 C ATOM 1461 C SER A 94 14.641 -6.588 -6.636 1.00 0.00 C ATOM 1462 O SER A 94 15.560 -7.409 -6.621 1.00 0.00 O ATOM 1463 CB SER A 94 12.587 -6.149 -8.074 1.00 0.00 C ATOM 1464 OG SER A 94 11.465 -6.719 -8.650 1.00 0.00 O ATOM 0 H SER A 94 11.710 -6.106 -5.787 1.00 0.00 H new ATOM 0 HA SER A 94 13.406 -8.043 -7.212 1.00 0.00 H new ATOM 0 HB2 SER A 94 12.317 -5.174 -7.669 1.00 0.00 H new ATOM 0 HB3 SER A 94 13.331 -5.976 -8.851 1.00 0.00 H new ATOM 0 HG SER A 94 10.930 -7.161 -7.958 1.00 0.00 H new ATOM 1470 N GLY A 95 14.827 -5.288 -6.382 1.00 0.00 N ATOM 1471 CA GLY A 95 16.189 -4.883 -6.078 1.00 0.00 C ATOM 1472 C GLY A 95 16.465 -5.388 -4.651 1.00 0.00 C ATOM 1473 O GLY A 95 16.659 -6.546 -4.320 1.00 0.00 O ATOM 0 H GLY A 95 14.115 -4.558 -6.380 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.894 -5.314 -6.789 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.298 -3.800 -6.138 1.00 0.00 H new ATOM 1477 N ASN A 96 16.457 -4.331 -3.829 1.00 0.00 N ATOM 1478 CA ASN A 96 16.696 -4.534 -2.413 1.00 0.00 C ATOM 1479 C ASN A 96 15.736 -3.564 -1.699 1.00 0.00 C ATOM 1480 O ASN A 96 16.219 -2.805 -0.853 1.00 0.00 O ATOM 1481 CB ASN A 96 18.170 -4.249 -2.185 1.00 0.00 C ATOM 1482 CG ASN A 96 18.764 -5.174 -1.126 1.00 0.00 C ATOM 1483 OD1 ASN A 96 18.078 -6.054 -0.651 1.00 0.00 O ATOM 1484 ND2 ASN A 96 20.054 -4.863 -0.846 1.00 0.00 N ATOM 0 H ASN A 96 16.293 -3.365 -4.114 1.00 0.00 H new ATOM 0 HA ASN A 96 16.505 -5.537 -2.033 1.00 0.00 H new ATOM 0 HB2 ASN A 96 18.714 -4.371 -3.122 1.00 0.00 H new ATOM 0 HB3 ASN A 96 18.297 -3.212 -1.875 1.00 0.00 H new ATOM 0 HD21 ASN A 96 20.570 -5.404 -0.153 1.00 0.00 H new ATOM 0 HD22 ASN A 96 20.508 -4.088 -1.329 1.00 0.00 H new ATOM 1491 N GLU A 97 14.493 -3.705 -2.108 1.00 0.00 N ATOM 1492 CA GLU A 97 13.405 -2.902 -1.568 1.00 0.00 C ATOM 1493 C GLU A 97 12.102 -3.673 -1.879 1.00 0.00 C ATOM 1494 O GLU A 97 12.042 -4.781 -1.372 1.00 0.00 O ATOM 1495 CB GLU A 97 13.423 -1.435 -1.865 1.00 0.00 C ATOM 1496 CG GLU A 97 14.542 -1.042 -2.880 1.00 0.00 C ATOM 1497 CD GLU A 97 14.435 -1.785 -4.177 1.00 0.00 C ATOM 1498 OE1 GLU A 97 13.465 -2.513 -4.383 1.00 0.00 O ATOM 1499 OE2 GLU A 97 15.343 -1.622 -5.004 1.00 0.00 O ATOM 0 H GLU A 97 14.204 -4.375 -2.821 1.00 0.00 H new ATOM 0 HA GLU A 97 13.522 -2.804 -0.489 1.00 0.00 H new ATOM 0 HB2 GLU A 97 12.454 -1.137 -2.265 1.00 0.00 H new ATOM 0 HB3 GLU A 97 13.569 -0.882 -0.937 1.00 0.00 H new ATOM 0 HG2 GLU A 97 14.490 0.029 -3.075 1.00 0.00 H new ATOM 0 HG3 GLU A 97 15.517 -1.238 -2.433 1.00 0.00 H new ATOM 1506 N LEU A 98 11.232 -3.047 -2.646 1.00 0.00 N ATOM 1507 CA LEU A 98 9.952 -3.561 -3.056 1.00 0.00 C ATOM 1508 C LEU A 98 9.005 -2.376 -3.403 1.00 0.00 C ATOM 1509 O LEU A 98 8.503 -1.743 -2.495 1.00 0.00 O ATOM 1510 CB LEU A 98 9.335 -4.331 -1.888 1.00 0.00 C ATOM 1511 CG LEU A 98 7.987 -4.959 -2.290 1.00 0.00 C ATOM 1512 CD1 LEU A 98 7.645 -6.170 -1.452 1.00 0.00 C ATOM 1513 CD2 LEU A 98 6.854 -3.972 -1.985 1.00 0.00 C ATOM 0 H LEU A 98 11.415 -2.115 -3.017 1.00 0.00 H new ATOM 0 HA LEU A 98 10.081 -4.208 -3.924 1.00 0.00 H new ATOM 0 HB2 LEU A 98 10.021 -5.112 -1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 98 9.189 -3.660 -1.042 1.00 0.00 H new ATOM 0 HG LEU A 98 8.081 -5.219 -3.344 1.00 0.00 H new ATOM 0 HD11 LEU A 98 6.686 -6.576 -1.774 1.00 0.00 H new ATOM 0 HD12 LEU A 98 8.419 -6.927 -1.574 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.583 -5.881 -0.403 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.899 -4.415 -2.269 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.846 -3.745 -0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.010 -3.053 -2.550 1.00 0.00 H new ATOM 1525 N ILE A 99 8.890 -2.243 -4.749 1.00 0.00 N ATOM 1526 CA ILE A 99 8.079 -1.226 -5.292 1.00 0.00 C ATOM 1527 C ILE A 99 6.700 -1.280 -4.554 1.00 0.00 C ATOM 1528 O ILE A 99 6.550 -0.348 -3.795 1.00 0.00 O ATOM 1529 CB ILE A 99 7.930 -1.578 -6.796 1.00 0.00 C ATOM 1530 CG1 ILE A 99 8.985 -0.726 -7.536 1.00 0.00 C ATOM 1531 CG2 ILE A 99 6.597 -1.033 -7.278 1.00 0.00 C ATOM 1532 CD1 ILE A 99 10.378 -1.318 -7.647 1.00 0.00 C ATOM 0 H ILE A 99 9.357 -2.837 -5.434 1.00 0.00 H new ATOM 0 HA ILE A 99 8.489 -0.223 -5.177 1.00 0.00 H new ATOM 0 HB ILE A 99 8.023 -2.652 -6.959 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.618 -0.527 -8.543 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.063 0.236 -7.029 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.468 -1.268 -8.335 1.00 0.00 H new ATOM 0 HG22 ILE A 99 5.789 -1.487 -6.704 1.00 0.00 H new ATOM 0 HG23 ILE A 99 6.575 0.048 -7.142 1.00 0.00 H new ATOM 0 HD11 ILE A 99 11.025 -0.626 -8.186 1.00 0.00 H new ATOM 0 HD12 ILE A 99 10.781 -1.489 -6.649 1.00 0.00 H new ATOM 0 HD13 ILE A 99 10.329 -2.264 -8.186 1.00 0.00 H new ATOM 1544 N GLN A 100 5.963 -2.332 -4.903 1.00 0.00 N ATOM 1545 CA GLN A 100 4.642 -2.615 -4.374 1.00 0.00 C ATOM 1546 C GLN A 100 3.780 -1.626 -5.222 1.00 0.00 C ATOM 1547 O GLN A 100 3.730 -0.451 -4.938 1.00 0.00 O ATOM 1548 CB GLN A 100 4.450 -2.434 -2.889 1.00 0.00 C ATOM 1549 CG GLN A 100 3.084 -1.988 -2.343 1.00 0.00 C ATOM 1550 CD GLN A 100 2.163 -3.218 -2.230 1.00 0.00 C ATOM 1551 OE1 GLN A 100 2.490 -4.291 -1.779 1.00 0.00 O ATOM 1552 NE2 GLN A 100 0.923 -2.906 -2.708 1.00 0.00 N ATOM 0 H GLN A 100 6.281 -3.026 -5.579 1.00 0.00 H new ATOM 0 HA GLN A 100 4.384 -3.671 -4.460 1.00 0.00 H new ATOM 0 HB2 GLN A 100 4.697 -3.382 -2.412 1.00 0.00 H new ATOM 0 HB3 GLN A 100 5.188 -1.706 -2.552 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.204 -1.517 -1.367 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.639 -1.244 -3.004 1.00 0.00 H new ATOM 0 HE21 GLN A 100 0.737 -1.971 -3.071 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.183 -3.608 -2.702 1.00 0.00 H new ATOM 1561 N THR A 101 3.223 -2.380 -6.189 1.00 0.00 N ATOM 1562 CA THR A 101 2.357 -1.864 -7.176 1.00 0.00 C ATOM 1563 C THR A 101 0.909 -2.220 -6.978 1.00 0.00 C ATOM 1564 O THR A 101 0.487 -3.356 -6.948 1.00 0.00 O ATOM 1565 CB THR A 101 2.676 -2.392 -8.583 1.00 0.00 C ATOM 1566 OG1 THR A 101 3.976 -2.826 -8.809 1.00 0.00 O ATOM 1567 CG2 THR A 101 2.157 -1.484 -9.721 1.00 0.00 C ATOM 0 H THR A 101 3.389 -3.383 -6.276 1.00 0.00 H new ATOM 0 HA THR A 101 2.517 -0.790 -7.080 1.00 0.00 H new ATOM 0 HB THR A 101 2.092 -3.312 -8.608 1.00 0.00 H new ATOM 0 HG1 THR A 101 4.060 -3.140 -9.734 1.00 0.00 H new ATOM 0 HG21 THR A 101 2.420 -1.922 -10.684 1.00 0.00 H new ATOM 0 HG22 THR A 101 1.073 -1.392 -9.648 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.611 -0.497 -9.635 1.00 0.00 H new ATOM 1575 N TYR A 102 0.178 -1.094 -6.838 1.00 0.00 N ATOM 1576 CA TYR A 102 -1.239 -1.336 -6.642 1.00 0.00 C ATOM 1577 C TYR A 102 -1.733 -1.481 -8.118 1.00 0.00 C ATOM 1578 O TYR A 102 -2.222 -0.491 -8.595 1.00 0.00 O ATOM 1579 CB TYR A 102 -1.934 -0.197 -5.972 1.00 0.00 C ATOM 1580 CG TYR A 102 -1.853 -0.210 -4.476 1.00 0.00 C ATOM 1581 CD1 TYR A 102 -2.604 -1.055 -3.703 1.00 0.00 C ATOM 1582 CD2 TYR A 102 -0.986 0.664 -3.827 1.00 0.00 C ATOM 1583 CE1 TYR A 102 -2.476 -1.008 -2.336 1.00 0.00 C ATOM 1584 CE2 TYR A 102 -0.925 0.640 -2.461 1.00 0.00 C ATOM 1585 CZ TYR A 102 -1.589 -0.106 -1.757 1.00 0.00 C ATOM 1586 OH TYR A 102 -1.458 -0.056 -0.374 1.00 0.00 O ATOM 0 H TYR A 102 0.504 -0.128 -6.855 1.00 0.00 H new ATOM 0 HA TYR A 102 -1.439 -2.192 -5.997 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -1.508 0.737 -6.338 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -2.984 -0.205 -6.266 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -3.290 -1.751 -4.163 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -0.372 1.349 -4.392 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -3.061 -1.668 -1.713 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.247 1.324 -1.973 1.00 0.00 H new ATOM 0 HH TYR A 102 -0.797 0.626 -0.132 1.00 0.00 H new ATOM 1596 N THR A 103 -1.516 -2.728 -8.617 1.00 0.00 N ATOM 1597 CA THR A 103 -1.927 -3.031 -9.989 1.00 0.00 C ATOM 1598 C THR A 103 -3.461 -2.917 -9.878 1.00 0.00 C ATOM 1599 O THR A 103 -4.144 -3.824 -9.449 1.00 0.00 O ATOM 1600 CB THR A 103 -1.466 -4.396 -10.394 1.00 0.00 C ATOM 1601 OG1 THR A 103 -0.108 -4.440 -10.839 1.00 0.00 O ATOM 1602 CG2 THR A 103 -2.169 -5.098 -11.574 1.00 0.00 C ATOM 0 H THR A 103 -1.080 -3.497 -8.108 1.00 0.00 H new ATOM 0 HA THR A 103 -1.507 -2.378 -10.754 1.00 0.00 H new ATOM 0 HB THR A 103 -1.684 -4.895 -9.450 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.126 -5.359 -11.085 1.00 0.00 H new ATOM 0 HG21 THR A 103 -1.716 -6.076 -11.738 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.228 -5.222 -11.345 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.061 -4.493 -12.474 1.00 0.00 H new ATOM 1610 N TYR A 104 -3.830 -1.694 -10.329 1.00 0.00 N ATOM 1611 CA TYR A 104 -5.197 -1.258 -10.361 1.00 0.00 C ATOM 1612 C TYR A 104 -5.776 -1.196 -11.762 1.00 0.00 C ATOM 1613 O TYR A 104 -5.269 -0.472 -12.612 1.00 0.00 O ATOM 1614 CB TYR A 104 -5.162 0.123 -9.645 1.00 0.00 C ATOM 1615 CG TYR A 104 -6.445 0.854 -9.719 1.00 0.00 C ATOM 1616 CD1 TYR A 104 -7.679 0.274 -9.859 1.00 0.00 C ATOM 1617 CD2 TYR A 104 -6.434 2.240 -9.649 1.00 0.00 C ATOM 1618 CE1 TYR A 104 -8.815 1.042 -9.920 1.00 0.00 C ATOM 1619 CE2 TYR A 104 -7.634 2.930 -9.720 1.00 0.00 C ATOM 1620 CZ TYR A 104 -8.707 2.410 -9.841 1.00 0.00 C ATOM 1621 OH TYR A 104 -9.822 3.200 -9.892 1.00 0.00 O ATOM 0 H TYR A 104 -3.167 -1.000 -10.676 1.00 0.00 H new ATOM 0 HA TYR A 104 -5.865 -1.961 -9.864 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -4.896 -0.025 -8.598 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -4.377 0.735 -10.090 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -7.759 -0.801 -9.922 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -5.502 2.774 -9.541 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -9.783 0.576 -10.029 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -7.600 4.008 -9.662 1.00 0.00 H new ATOM 0 HH TYR A 104 -9.559 4.141 -9.821 1.00 0.00 H new ATOM 1631 N GLU A 105 -6.828 -1.982 -11.913 1.00 0.00 N ATOM 1632 CA GLU A 105 -7.609 -2.166 -13.103 1.00 0.00 C ATOM 1633 C GLU A 105 -7.140 -1.476 -14.361 1.00 0.00 C ATOM 1634 O GLU A 105 -7.860 -0.608 -14.840 1.00 0.00 O ATOM 1635 CB GLU A 105 -9.034 -1.656 -12.727 1.00 0.00 C ATOM 1636 CG GLU A 105 -9.976 -2.224 -13.796 1.00 0.00 C ATOM 1637 CD GLU A 105 -10.928 -1.203 -14.401 1.00 0.00 C ATOM 1638 OE1 GLU A 105 -10.701 0.010 -14.303 1.00 0.00 O ATOM 1639 OE2 GLU A 105 -11.908 -1.724 -14.975 1.00 0.00 O ATOM 0 H GLU A 105 -7.178 -2.548 -11.140 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.541 -3.219 -13.376 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.321 -1.996 -11.732 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.069 -0.567 -12.714 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.377 -2.662 -14.594 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.561 -3.032 -13.356 1.00 0.00 H new ATOM 1646 N GLY A 106 -5.956 -1.871 -14.868 1.00 0.00 N ATOM 1647 CA GLY A 106 -5.476 -1.231 -16.072 1.00 0.00 C ATOM 1648 C GLY A 106 -4.384 -0.191 -15.893 1.00 0.00 C ATOM 1649 O GLY A 106 -4.070 0.585 -16.790 1.00 0.00 O ATOM 0 H GLY A 106 -5.353 -2.594 -14.475 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -5.105 -2.004 -16.745 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.323 -0.756 -16.568 1.00 0.00 H new ATOM 1653 N VAL A 107 -3.800 -0.193 -14.671 1.00 0.00 N ATOM 1654 CA VAL A 107 -2.760 0.734 -14.377 1.00 0.00 C ATOM 1655 C VAL A 107 -1.630 0.189 -13.501 1.00 0.00 C ATOM 1656 O VAL A 107 -1.937 -0.659 -12.676 1.00 0.00 O ATOM 1657 CB VAL A 107 -3.401 1.918 -13.592 1.00 0.00 C ATOM 1658 CG1 VAL A 107 -2.392 2.616 -12.722 1.00 0.00 C ATOM 1659 CG2 VAL A 107 -4.018 2.943 -14.506 1.00 0.00 C ATOM 0 H VAL A 107 -4.047 -0.824 -13.909 1.00 0.00 H new ATOM 0 HA VAL A 107 -2.316 1.007 -15.334 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.181 1.471 -12.975 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -2.875 3.436 -12.190 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -1.981 1.908 -12.002 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -1.587 3.011 -13.343 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.451 3.747 -13.911 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.252 3.351 -15.165 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.799 2.474 -15.105 1.00 0.00 H new ATOM 1669 N GLU A 108 -0.415 0.743 -13.769 1.00 0.00 N ATOM 1670 CA GLU A 108 0.733 0.279 -12.974 1.00 0.00 C ATOM 1671 C GLU A 108 1.253 1.502 -12.198 1.00 0.00 C ATOM 1672 O GLU A 108 2.350 1.924 -12.510 1.00 0.00 O ATOM 1673 CB GLU A 108 1.793 -0.307 -13.862 1.00 0.00 C ATOM 1674 CG GLU A 108 1.496 -1.800 -14.182 1.00 0.00 C ATOM 1675 CD GLU A 108 2.149 -2.202 -15.487 1.00 0.00 C ATOM 1676 OE1 GLU A 108 3.364 -2.068 -15.524 1.00 0.00 O ATOM 1677 OE2 GLU A 108 1.486 -2.622 -16.426 1.00 0.00 O ATOM 0 H GLU A 108 -0.221 1.455 -14.473 1.00 0.00 H new ATOM 0 HA GLU A 108 0.443 -0.513 -12.284 1.00 0.00 H new ATOM 0 HB2 GLU A 108 1.850 0.262 -14.790 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.765 -0.223 -13.377 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.865 -2.432 -13.374 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.419 -1.958 -14.243 1.00 0.00 H new ATOM 1684 N ALA A 109 0.416 1.986 -11.234 1.00 0.00 N ATOM 1685 CA ALA A 109 0.883 3.104 -10.515 1.00 0.00 C ATOM 1686 C ALA A 109 1.466 2.691 -9.125 1.00 0.00 C ATOM 1687 O ALA A 109 0.666 2.538 -8.225 1.00 0.00 O ATOM 1688 CB ALA A 109 -0.406 3.848 -10.077 1.00 0.00 C ATOM 0 H ALA A 109 -0.504 1.624 -10.984 1.00 0.00 H new ATOM 0 HA ALA A 109 1.611 3.638 -11.125 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.137 4.738 -9.507 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.975 4.140 -10.960 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.013 3.189 -9.456 1.00 0.00 H new ATOM 1694 N LYS A 110 2.781 2.591 -9.238 1.00 0.00 N ATOM 1695 CA LYS A 110 3.442 2.220 -8.038 1.00 0.00 C ATOM 1696 C LYS A 110 3.822 3.469 -7.240 1.00 0.00 C ATOM 1697 O LYS A 110 3.610 4.594 -7.701 1.00 0.00 O ATOM 1698 CB LYS A 110 4.817 1.510 -8.255 1.00 0.00 C ATOM 1699 CG LYS A 110 4.540 0.289 -9.105 1.00 0.00 C ATOM 1700 CD LYS A 110 5.461 0.173 -10.350 1.00 0.00 C ATOM 1701 CE LYS A 110 5.306 1.274 -11.403 1.00 0.00 C ATOM 1702 NZ LYS A 110 6.461 1.399 -12.288 1.00 0.00 N ATOM 0 H LYS A 110 3.351 2.747 -10.069 1.00 0.00 H new ATOM 0 HA LYS A 110 2.734 1.554 -7.544 1.00 0.00 H new ATOM 0 HB2 LYS A 110 5.524 2.176 -8.751 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.262 1.226 -7.301 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.659 -0.604 -8.492 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.501 0.314 -9.434 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.497 0.164 -10.012 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.274 -0.789 -10.828 1.00 0.00 H new ATOM 0 HE2 LYS A 110 4.419 1.070 -12.003 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.139 2.226 -10.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 6.291 2.161 -12.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.307 1.623 -11.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 6.609 0.503 -12.794 1.00 0.00 H new ATOM 1716 N ARG A 111 4.366 3.065 -6.097 1.00 0.00 N ATOM 1717 CA ARG A 111 4.826 4.105 -5.151 1.00 0.00 C ATOM 1718 C ARG A 111 6.209 3.491 -4.767 1.00 0.00 C ATOM 1719 O ARG A 111 6.238 2.408 -4.206 1.00 0.00 O ATOM 1720 CB ARG A 111 3.907 4.337 -3.990 1.00 0.00 C ATOM 1721 CG ARG A 111 2.415 4.220 -4.312 1.00 0.00 C ATOM 1722 CD ARG A 111 1.628 4.217 -2.996 1.00 0.00 C ATOM 1723 NE ARG A 111 1.373 5.605 -2.626 1.00 0.00 N ATOM 1724 CZ ARG A 111 0.803 5.942 -1.456 1.00 0.00 C ATOM 1725 NH1 ARG A 111 0.461 4.958 -0.615 1.00 0.00 N ATOM 1726 NH2 ARG A 111 0.561 7.194 -1.090 1.00 0.00 N ATOM 0 H ARG A 111 4.499 2.097 -5.805 1.00 0.00 H new ATOM 0 HA ARG A 111 4.867 5.115 -5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 111 4.151 3.622 -3.204 1.00 0.00 H new ATOM 0 HB3 ARG A 111 4.099 5.331 -3.587 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.097 5.052 -4.940 1.00 0.00 H new ATOM 0 HG3 ARG A 111 2.220 3.305 -4.872 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.690 3.674 -3.113 1.00 0.00 H new ATOM 0 HD3 ARG A 111 2.194 3.711 -2.214 1.00 0.00 H new ATOM 0 HE ARG A 111 1.636 6.345 -3.277 1.00 0.00 H new ATOM 0 HH11 ARG A 111 0.635 3.986 -0.870 1.00 0.00 H new ATOM 0 HH12 ARG A 111 0.027 5.181 0.281 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.811 7.964 -1.711 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.125 7.387 -0.188 1.00 0.00 H new ATOM 1740 N ILE A 112 7.236 4.300 -5.138 1.00 0.00 N ATOM 1741 CA ILE A 112 8.547 3.787 -4.812 1.00 0.00 C ATOM 1742 C ILE A 112 8.970 4.129 -3.380 1.00 0.00 C ATOM 1743 O ILE A 112 8.959 5.273 -2.978 1.00 0.00 O ATOM 1744 CB ILE A 112 9.566 4.221 -5.855 1.00 0.00 C ATOM 1745 CG1 ILE A 112 10.701 3.178 -5.889 1.00 0.00 C ATOM 1746 CG2 ILE A 112 10.232 5.551 -5.597 1.00 0.00 C ATOM 1747 CD1 ILE A 112 11.024 2.611 -7.284 1.00 0.00 C ATOM 0 H ILE A 112 7.180 5.204 -5.608 1.00 0.00 H new ATOM 0 HA ILE A 112 8.498 2.699 -4.842 1.00 0.00 H new ATOM 0 HB ILE A 112 9.002 4.311 -6.783 1.00 0.00 H new ATOM 0 HG12 ILE A 112 11.604 3.632 -5.480 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.434 2.351 -5.231 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.939 5.765 -6.398 1.00 0.00 H new ATOM 0 HG22 ILE A 112 9.476 6.335 -5.560 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.763 5.514 -4.646 1.00 0.00 H new ATOM 0 HD11 ILE A 112 11.835 1.887 -7.204 1.00 0.00 H new ATOM 0 HD12 ILE A 112 10.139 2.122 -7.692 1.00 0.00 H new ATOM 0 HD13 ILE A 112 11.327 3.423 -7.945 1.00 0.00 H new ATOM 1759 N PHE A 113 9.317 3.015 -2.757 1.00 0.00 N ATOM 1760 CA PHE A 113 9.763 3.068 -1.384 1.00 0.00 C ATOM 1761 C PHE A 113 10.932 2.083 -1.230 1.00 0.00 C ATOM 1762 O PHE A 113 11.603 1.951 -2.247 1.00 0.00 O ATOM 1763 CB PHE A 113 8.702 2.757 -0.365 1.00 0.00 C ATOM 1764 CG PHE A 113 7.400 3.464 -0.487 1.00 0.00 C ATOM 1765 CD1 PHE A 113 7.203 4.839 -0.408 1.00 0.00 C ATOM 1766 CD2 PHE A 113 6.206 2.771 -0.696 1.00 0.00 C ATOM 1767 CE1 PHE A 113 5.907 5.328 -0.539 1.00 0.00 C ATOM 1768 CE2 PHE A 113 4.956 3.361 -0.814 1.00 0.00 C ATOM 1769 CZ PHE A 113 4.789 4.558 -0.744 1.00 0.00 C ATOM 0 H PHE A 113 9.298 2.084 -3.173 1.00 0.00 H new ATOM 0 HA PHE A 113 10.058 4.098 -1.183 1.00 0.00 H new ATOM 0 HB2 PHE A 113 8.507 1.685 -0.400 1.00 0.00 H new ATOM 0 HB3 PHE A 113 9.111 2.974 0.622 1.00 0.00 H new ATOM 0 HD1 PHE A 113 8.035 5.510 -0.249 1.00 0.00 H new ATOM 0 HD2 PHE A 113 6.260 1.695 -0.771 1.00 0.00 H new ATOM 0 HE1 PHE A 113 5.770 6.397 -0.474 1.00 0.00 H new ATOM 0 HE2 PHE A 113 4.097 2.727 -0.975 1.00 0.00 H new ATOM 0 HZ PHE A 113 3.808 4.999 -0.838 1.00 0.00 H new ATOM 1779 N LYS A 114 11.046 1.534 -0.044 1.00 0.00 N ATOM 1780 CA LYS A 114 12.132 0.607 0.195 1.00 0.00 C ATOM 1781 C LYS A 114 12.001 -0.104 1.544 1.00 0.00 C ATOM 1782 O LYS A 114 10.964 -0.501 2.037 1.00 0.00 O ATOM 1783 CB LYS A 114 13.461 1.343 -0.003 1.00 0.00 C ATOM 1784 CG LYS A 114 13.799 2.402 1.036 1.00 0.00 C ATOM 1785 CD LYS A 114 12.615 2.758 1.975 1.00 0.00 C ATOM 1786 CE LYS A 114 12.859 3.971 2.925 1.00 0.00 C ATOM 1787 NZ LYS A 114 13.892 4.897 2.591 1.00 0.00 N ATOM 0 H LYS A 114 10.425 1.703 0.747 1.00 0.00 H new ATOM 0 HA LYS A 114 12.093 -0.205 -0.531 1.00 0.00 H new ATOM 0 HB2 LYS A 114 14.263 0.605 -0.015 1.00 0.00 H new ATOM 0 HB3 LYS A 114 13.448 1.817 -0.985 1.00 0.00 H new ATOM 0 HG2 LYS A 114 14.636 2.052 1.639 1.00 0.00 H new ATOM 0 HG3 LYS A 114 14.130 3.306 0.525 1.00 0.00 H new ATOM 0 HD2 LYS A 114 11.738 2.968 1.363 1.00 0.00 H new ATOM 0 HD3 LYS A 114 12.379 1.884 2.582 1.00 0.00 H new ATOM 0 HE2 LYS A 114 11.925 4.528 2.999 1.00 0.00 H new ATOM 0 HE3 LYS A 114 13.075 3.577 3.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 14.073 5.523 3.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 14.761 4.377 2.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.596 5.467 1.773 1.00 0.00 H new ATOM 1801 N LYS A 115 13.161 -0.275 2.166 1.00 0.00 N ATOM 1802 CA LYS A 115 13.338 -0.922 3.458 1.00 0.00 C ATOM 1803 C LYS A 115 14.019 -0.020 4.441 1.00 0.00 C ATOM 1804 O LYS A 115 13.650 1.126 4.636 1.00 0.00 O ATOM 1805 CB LYS A 115 14.026 -2.253 3.116 1.00 0.00 C ATOM 1806 CG LYS A 115 13.880 -3.221 4.303 1.00 0.00 C ATOM 1807 CD LYS A 115 15.070 -4.213 4.171 1.00 0.00 C ATOM 1808 CE LYS A 115 14.788 -5.539 4.835 1.00 0.00 C ATOM 1809 NZ LYS A 115 15.884 -6.462 4.991 1.00 0.00 N ATOM 0 H LYS A 115 14.042 0.048 1.765 1.00 0.00 H new ATOM 0 HA LYS A 115 12.414 -1.136 3.995 1.00 0.00 H new ATOM 0 HB2 LYS A 115 13.580 -2.687 2.221 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.080 -2.085 2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.916 -2.687 5.253 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.925 -3.745 4.268 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.288 -4.377 3.116 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.961 -3.769 4.615 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.378 -5.337 5.824 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.008 -6.040 4.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.546 -7.326 5.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.270 -6.704 4.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.628 -6.023 5.569 1.00 0.00 H new ATOM 1823 N GLU A 116 15.060 -0.578 5.084 1.00 0.00 N ATOM 1824 CA GLU A 116 15.822 0.150 6.065 1.00 0.00 C ATOM 1825 C GLU A 116 17.319 -0.148 5.811 1.00 0.00 C ATOM 1826 O GLU A 116 17.691 -0.556 4.734 1.00 0.00 O ATOM 1827 CB GLU A 116 15.454 -0.489 7.411 1.00 0.00 C ATOM 1828 CG GLU A 116 14.070 -1.081 7.602 1.00 0.00 C ATOM 1829 CD GLU A 116 13.170 -0.176 8.480 1.00 0.00 C ATOM 1830 OE1 GLU A 116 13.574 0.097 9.605 1.00 0.00 O ATOM 1831 OE2 GLU A 116 12.102 0.234 8.022 1.00 0.00 O ATOM 1832 OXT GLU A 116 18.129 0.035 6.711 1.00 0.00 O ATOM 0 H GLU A 116 15.379 -1.534 4.928 1.00 0.00 H new ATOM 0 HA GLU A 116 15.631 1.223 6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 116 16.178 -1.280 7.606 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.595 0.269 8.182 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.600 -1.226 6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.157 -2.064 8.064 1.00 0.00 H new TER 1839 GLU A 116