USER MOD reduce.3.24.130724 H: found=0, std=0, add=927, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 925 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 LYS NZ :NH3+ -143:sc= 0.189 (180deg=-1.37) USER MOD Set 1.2: A 94 SER OG : rot 180:sc= 0.11 USER MOD Set 2.1: A 72 THR OG1 : rot -116:sc= -1.16 USER MOD Set 2.2: A 115 GLN : amide:sc= -0.0597 X(o=-1.2,f=-1.3) USER MOD Set 3.1: A 40 GLN : amide:sc= -0.911 K(o=-5.7,f=-8.5!) USER MOD Set 3.2: A 48 ASN : amide:sc= -5.6! K(o=-5.7!,f=-1.7) USER MOD Set 3.3: A 50 TYR OH : rot -152:sc= 0.818 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.103 (180deg=-0.455) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0.768 (180deg=0.768) USER MOD Single : A 4 LYS NZ :NH3+ 165:sc= 0.581 (180deg=0.468) USER MOD Single : A 5 SER OG : rot -156:sc= 0.481 USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 73:sc= 0.313 USER MOD Single : A 28 LYS NZ :NH3+ -118:sc= 0.607 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= 0.0966 X(o=0.097,f=-0.29) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl 156:sc= -0.158 (180deg=-0.726) USER MOD Single : A 103 THR OG1 : rot -116:sc= 0.177 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -0.552 X(o=-0.55,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.685 -0.950 -0.092 1.00 0.00 N ATOM 2 CA MET A 1 2.045 -0.855 -0.667 1.00 0.00 C ATOM 3 C MET A 1 2.448 -2.190 -1.302 1.00 0.00 C ATOM 4 O MET A 1 2.408 -3.221 -0.635 1.00 0.00 O ATOM 5 CB MET A 1 3.071 -0.441 0.432 1.00 0.00 C ATOM 6 CG MET A 1 3.086 1.060 0.748 1.00 0.00 C ATOM 7 SD MET A 1 3.556 2.053 -0.691 1.00 0.00 S ATOM 8 CE MET A 1 5.214 1.450 -1.048 1.00 0.00 C ATOM 0 H1 MET A 1 0.424 -0.038 0.335 1.00 0.00 H new ATOM 0 H2 MET A 1 0.006 -1.187 -0.843 1.00 0.00 H new ATOM 0 H3 MET A 1 0.667 -1.692 0.637 1.00 0.00 H new ATOM 0 HA MET A 1 2.043 -0.089 -1.443 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.848 -0.991 1.346 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.069 -0.743 0.114 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.099 1.367 1.093 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.783 1.252 1.564 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.722 2.152 -1.709 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.775 1.356 -0.118 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.150 0.476 -1.533 1.00 0.00 H new ATOM 18 N ARG A 2 2.780 -2.154 -2.605 1.00 0.00 N ATOM 19 CA ARG A 2 3.337 -3.297 -3.351 1.00 0.00 C ATOM 20 C ARG A 2 4.761 -3.623 -2.863 1.00 0.00 C ATOM 21 O ARG A 2 5.737 -2.983 -3.269 1.00 0.00 O ATOM 22 CB ARG A 2 3.340 -2.969 -4.863 1.00 0.00 C ATOM 23 CG ARG A 2 1.938 -2.750 -5.468 1.00 0.00 C ATOM 24 CD ARG A 2 2.004 -2.196 -6.899 1.00 0.00 C ATOM 25 NE ARG A 2 2.900 -2.988 -7.767 1.00 0.00 N ATOM 26 CZ ARG A 2 3.784 -2.480 -8.649 1.00 0.00 C ATOM 27 NH1 ARG A 2 3.852 -1.177 -8.885 1.00 0.00 N ATOM 28 NH2 ARG A 2 4.591 -3.285 -9.305 1.00 0.00 N ATOM 0 H ARG A 2 2.667 -1.318 -3.178 1.00 0.00 H new ATOM 0 HA ARG A 2 2.716 -4.175 -3.176 1.00 0.00 H new ATOM 0 HB2 ARG A 2 3.938 -2.072 -5.027 1.00 0.00 H new ATOM 0 HB3 ARG A 2 3.831 -3.782 -5.398 1.00 0.00 H new ATOM 0 HG2 ARG A 2 1.394 -3.694 -5.471 1.00 0.00 H new ATOM 0 HG3 ARG A 2 1.376 -2.060 -4.839 1.00 0.00 H new ATOM 0 HD2 ARG A 2 1.002 -2.185 -7.328 1.00 0.00 H new ATOM 0 HD3 ARG A 2 2.350 -1.163 -6.870 1.00 0.00 H new ATOM 0 HE ARG A 2 2.845 -4.004 -7.693 1.00 0.00 H new ATOM 0 HH11 ARG A 2 3.227 -0.537 -8.395 1.00 0.00 H new ATOM 0 HH12 ARG A 2 4.529 -0.815 -9.557 1.00 0.00 H new ATOM 0 HH21 ARG A 2 4.547 -4.292 -9.146 1.00 0.00 H new ATOM 0 HH22 ARG A 2 5.261 -2.903 -9.973 1.00 0.00 H new ATOM 42 N LEU A 3 4.838 -4.591 -1.943 1.00 0.00 N ATOM 43 CA LEU A 3 6.094 -5.093 -1.351 1.00 0.00 C ATOM 44 C LEU A 3 5.956 -6.600 -1.048 1.00 0.00 C ATOM 45 O LEU A 3 4.907 -7.203 -1.332 1.00 0.00 O ATOM 46 CB LEU A 3 6.475 -4.262 -0.063 1.00 0.00 C ATOM 47 CG LEU A 3 5.297 -3.673 0.799 1.00 0.00 C ATOM 48 CD1 LEU A 3 4.369 -4.771 1.336 1.00 0.00 C ATOM 49 CD2 LEU A 3 5.817 -2.776 1.950 1.00 0.00 C ATOM 0 H LEU A 3 4.011 -5.062 -1.577 1.00 0.00 H new ATOM 0 HA LEU A 3 6.909 -4.964 -2.063 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.077 -4.901 0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.111 -3.433 -0.374 1.00 0.00 H new ATOM 0 HG LEU A 3 4.708 -3.046 0.129 1.00 0.00 H new ATOM 0 HD11 LEU A 3 3.571 -4.318 1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 3 3.936 -5.322 0.501 1.00 0.00 H new ATOM 0 HD13 LEU A 3 4.940 -5.455 1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 3 4.972 -2.390 2.520 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.460 -3.362 2.606 1.00 0.00 H new ATOM 0 HD23 LEU A 3 6.385 -1.944 1.534 1.00 0.00 H new ATOM 61 N LYS A 4 7.014 -7.201 -0.470 1.00 0.00 N ATOM 62 CA LYS A 4 6.971 -8.593 0.011 1.00 0.00 C ATOM 63 C LYS A 4 6.031 -8.711 1.221 1.00 0.00 C ATOM 64 O LYS A 4 5.810 -7.735 1.939 1.00 0.00 O ATOM 65 CB LYS A 4 8.389 -9.098 0.402 1.00 0.00 C ATOM 66 CG LYS A 4 9.377 -9.198 -0.780 1.00 0.00 C ATOM 67 CD LYS A 4 10.689 -9.935 -0.409 1.00 0.00 C ATOM 68 CE LYS A 4 11.488 -9.247 0.717 1.00 0.00 C ATOM 69 NZ LYS A 4 12.787 -9.928 0.976 1.00 0.00 N ATOM 0 H LYS A 4 7.912 -6.740 -0.325 1.00 0.00 H new ATOM 0 HA LYS A 4 6.595 -9.213 -0.802 1.00 0.00 H new ATOM 0 HB2 LYS A 4 8.806 -8.427 1.153 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.297 -10.079 0.867 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.895 -9.719 -1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 4 9.617 -8.195 -1.132 1.00 0.00 H new ATOM 0 HD2 LYS A 4 10.449 -10.953 -0.103 1.00 0.00 H new ATOM 0 HD3 LYS A 4 11.318 -10.008 -1.296 1.00 0.00 H new ATOM 0 HE2 LYS A 4 11.671 -8.207 0.448 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.894 -9.240 1.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 13.398 -9.307 1.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 12.617 -10.814 1.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 13.254 -10.140 0.071 1.00 0.00 H new ATOM 83 N SER A 5 5.509 -9.920 1.436 1.00 0.00 N ATOM 84 CA SER A 5 4.671 -10.267 2.591 1.00 0.00 C ATOM 85 C SER A 5 5.450 -10.048 3.914 1.00 0.00 C ATOM 86 O SER A 5 4.883 -9.609 4.912 1.00 0.00 O ATOM 87 CB SER A 5 4.248 -11.744 2.442 1.00 0.00 C ATOM 88 OG SER A 5 3.859 -12.027 1.109 1.00 0.00 O ATOM 0 H SER A 5 5.659 -10.703 0.800 1.00 0.00 H new ATOM 0 HA SER A 5 3.789 -9.627 2.624 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.075 -12.394 2.730 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.422 -11.960 3.120 1.00 0.00 H new ATOM 0 HG SER A 5 3.252 -12.797 1.102 1.00 0.00 H new ATOM 94 N GLU A 6 6.769 -10.344 3.872 1.00 0.00 N ATOM 95 CA GLU A 6 7.716 -10.098 4.978 1.00 0.00 C ATOM 96 C GLU A 6 7.799 -8.604 5.307 1.00 0.00 C ATOM 97 O GLU A 6 7.626 -8.184 6.461 1.00 0.00 O ATOM 98 CB GLU A 6 9.126 -10.626 4.580 1.00 0.00 C ATOM 99 CG GLU A 6 10.251 -10.280 5.583 1.00 0.00 C ATOM 100 CD GLU A 6 11.565 -11.024 5.311 1.00 0.00 C ATOM 101 OE1 GLU A 6 11.737 -12.156 5.822 1.00 0.00 O ATOM 102 OE2 GLU A 6 12.435 -10.483 4.600 1.00 0.00 O ATOM 0 H GLU A 6 7.210 -10.767 3.055 1.00 0.00 H new ATOM 0 HA GLU A 6 7.359 -10.624 5.863 1.00 0.00 H new ATOM 0 HB2 GLU A 6 9.076 -11.709 4.470 1.00 0.00 H new ATOM 0 HB3 GLU A 6 9.390 -10.219 3.604 1.00 0.00 H new ATOM 0 HG2 GLU A 6 10.437 -9.207 5.551 1.00 0.00 H new ATOM 0 HG3 GLU A 6 9.912 -10.515 6.592 1.00 0.00 H new ATOM 109 N MET A 7 8.040 -7.814 4.250 1.00 0.00 N ATOM 110 CA MET A 7 8.204 -6.360 4.350 1.00 0.00 C ATOM 111 C MET A 7 6.860 -5.694 4.728 1.00 0.00 C ATOM 112 O MET A 7 6.842 -4.599 5.305 1.00 0.00 O ATOM 113 CB MET A 7 8.774 -5.792 3.020 1.00 0.00 C ATOM 114 CG MET A 7 9.052 -4.283 3.053 1.00 0.00 C ATOM 115 SD MET A 7 10.101 -3.803 4.448 1.00 0.00 S ATOM 116 CE MET A 7 9.531 -2.134 4.782 1.00 0.00 C ATOM 0 H MET A 7 8.127 -8.170 3.298 1.00 0.00 H new ATOM 0 HA MET A 7 8.919 -6.132 5.141 1.00 0.00 H new ATOM 0 HB2 MET A 7 9.699 -6.316 2.780 1.00 0.00 H new ATOM 0 HB3 MET A 7 8.070 -6.004 2.215 1.00 0.00 H new ATOM 0 HG2 MET A 7 9.533 -3.985 2.121 1.00 0.00 H new ATOM 0 HG3 MET A 7 8.107 -3.744 3.111 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.093 -1.718 5.619 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.684 -1.514 3.899 1.00 0.00 H new ATOM 0 HE3 MET A 7 8.470 -2.155 5.032 1.00 0.00 H new ATOM 126 N PHE A 8 5.734 -6.385 4.422 1.00 0.00 N ATOM 127 CA PHE A 8 4.393 -5.929 4.813 1.00 0.00 C ATOM 128 C PHE A 8 4.230 -6.057 6.329 1.00 0.00 C ATOM 129 O PHE A 8 3.747 -5.128 6.960 1.00 0.00 O ATOM 130 CB PHE A 8 3.260 -6.715 4.083 1.00 0.00 C ATOM 131 CG PHE A 8 1.863 -6.097 4.276 1.00 0.00 C ATOM 132 CD1 PHE A 8 1.108 -6.352 5.424 1.00 0.00 C ATOM 133 CD2 PHE A 8 1.328 -5.216 3.330 1.00 0.00 C ATOM 134 CE1 PHE A 8 -0.123 -5.762 5.611 1.00 0.00 C ATOM 135 CE2 PHE A 8 0.094 -4.624 3.522 1.00 0.00 C ATOM 136 CZ PHE A 8 -0.630 -4.893 4.664 1.00 0.00 C ATOM 0 H PHE A 8 5.737 -7.263 3.903 1.00 0.00 H new ATOM 0 HA PHE A 8 4.300 -4.885 4.514 1.00 0.00 H new ATOM 0 HB2 PHE A 8 3.486 -6.757 3.018 1.00 0.00 H new ATOM 0 HB3 PHE A 8 3.248 -7.742 4.447 1.00 0.00 H new ATOM 0 HD1 PHE A 8 1.496 -7.022 6.177 1.00 0.00 H new ATOM 0 HD2 PHE A 8 1.889 -4.995 2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -0.694 -5.980 6.502 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -0.303 -3.950 2.777 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.591 -4.426 4.818 1.00 0.00 H new ATOM 146 N VAL A 9 4.635 -7.219 6.896 1.00 0.00 N ATOM 147 CA VAL A 9 4.556 -7.465 8.357 1.00 0.00 C ATOM 148 C VAL A 9 5.397 -6.436 9.114 1.00 0.00 C ATOM 149 O VAL A 9 4.938 -5.860 10.104 1.00 0.00 O ATOM 150 CB VAL A 9 5.014 -8.917 8.763 1.00 0.00 C ATOM 151 CG1 VAL A 9 4.960 -9.110 10.285 1.00 0.00 C ATOM 152 CG2 VAL A 9 4.163 -9.976 8.046 1.00 0.00 C ATOM 0 H VAL A 9 5.019 -8.000 6.365 1.00 0.00 H new ATOM 0 HA VAL A 9 3.505 -7.368 8.630 1.00 0.00 H new ATOM 0 HB VAL A 9 6.050 -9.042 8.449 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.281 -10.121 10.535 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.621 -8.389 10.767 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.939 -8.957 10.635 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.496 -10.971 8.341 1.00 0.00 H new ATOM 0 HG22 VAL A 9 3.116 -9.848 8.320 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.272 -9.861 6.968 1.00 0.00 H new ATOM 162 N SER A 10 6.605 -6.187 8.584 1.00 0.00 N ATOM 163 CA SER A 10 7.537 -5.189 9.119 1.00 0.00 C ATOM 164 C SER A 10 6.841 -3.814 9.211 1.00 0.00 C ATOM 165 O SER A 10 6.721 -3.252 10.297 1.00 0.00 O ATOM 166 CB SER A 10 8.797 -5.118 8.226 1.00 0.00 C ATOM 167 OG SER A 10 9.450 -6.380 8.152 1.00 0.00 O ATOM 0 H SER A 10 6.963 -6.679 7.765 1.00 0.00 H new ATOM 0 HA SER A 10 7.846 -5.480 10.123 1.00 0.00 H new ATOM 0 HB2 SER A 10 8.517 -4.791 7.224 1.00 0.00 H new ATOM 0 HB3 SER A 10 9.486 -4.373 8.624 1.00 0.00 H new ATOM 0 HG SER A 10 8.922 -6.989 7.595 1.00 0.00 H new ATOM 173 N ALA A 11 6.277 -3.363 8.074 1.00 0.00 N ATOM 174 CA ALA A 11 5.584 -2.062 7.966 1.00 0.00 C ATOM 175 C ALA A 11 4.326 -1.999 8.863 1.00 0.00 C ATOM 176 O ALA A 11 4.060 -0.976 9.487 1.00 0.00 O ATOM 177 CB ALA A 11 5.220 -1.790 6.496 1.00 0.00 C ATOM 0 H ALA A 11 6.289 -3.891 7.201 1.00 0.00 H new ATOM 0 HA ALA A 11 6.264 -1.287 8.320 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.709 -0.830 6.419 1.00 0.00 H new ATOM 0 HB2 ALA A 11 6.129 -1.767 5.894 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.564 -2.580 6.131 1.00 0.00 H new ATOM 183 N LEU A 12 3.610 -3.134 8.943 1.00 0.00 N ATOM 184 CA LEU A 12 2.353 -3.310 9.715 1.00 0.00 C ATOM 185 C LEU A 12 2.570 -3.005 11.202 1.00 0.00 C ATOM 186 O LEU A 12 1.762 -2.324 11.843 1.00 0.00 O ATOM 187 CB LEU A 12 1.853 -4.772 9.520 1.00 0.00 C ATOM 188 CG LEU A 12 0.742 -5.297 10.486 1.00 0.00 C ATOM 189 CD1 LEU A 12 -0.564 -4.497 10.361 1.00 0.00 C ATOM 190 CD2 LEU A 12 0.504 -6.802 10.264 1.00 0.00 C ATOM 0 H LEU A 12 3.894 -3.986 8.459 1.00 0.00 H new ATOM 0 HA LEU A 12 1.602 -2.610 9.349 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.481 -4.866 8.500 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.714 -5.435 9.608 1.00 0.00 H new ATOM 0 HG LEU A 12 1.097 -5.151 11.506 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.305 -4.900 11.052 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.374 -3.451 10.601 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.941 -4.572 9.341 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.272 -7.152 10.944 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.188 -6.973 9.235 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.427 -7.349 10.456 1.00 0.00 H new ATOM 202 N ILE A 13 3.684 -3.513 11.717 1.00 0.00 N ATOM 203 CA ILE A 13 4.095 -3.335 13.110 1.00 0.00 C ATOM 204 C ILE A 13 4.386 -1.847 13.401 1.00 0.00 C ATOM 205 O ILE A 13 3.998 -1.329 14.440 1.00 0.00 O ATOM 206 CB ILE A 13 5.330 -4.275 13.390 1.00 0.00 C ATOM 207 CG1 ILE A 13 4.870 -5.775 13.258 1.00 0.00 C ATOM 208 CG2 ILE A 13 5.996 -4.002 14.762 1.00 0.00 C ATOM 209 CD1 ILE A 13 5.975 -6.782 13.122 1.00 0.00 C ATOM 0 H ILE A 13 4.340 -4.071 11.171 1.00 0.00 H new ATOM 0 HA ILE A 13 3.293 -3.621 13.790 1.00 0.00 H new ATOM 0 HB ILE A 13 6.098 -4.060 12.647 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.274 -6.032 14.134 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.216 -5.861 12.391 1.00 0.00 H new ATOM 0 HG21 ILE A 13 6.839 -4.679 14.898 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.349 -2.971 14.796 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.269 -4.163 15.558 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.548 -7.781 13.038 1.00 0.00 H new ATOM 0 HD12 ILE A 13 6.561 -6.561 12.229 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.620 -6.735 14.000 1.00 0.00 H new ATOM 221 N ARG A 14 4.994 -1.141 12.436 1.00 0.00 N ATOM 222 CA ARG A 14 5.290 0.310 12.583 1.00 0.00 C ATOM 223 C ARG A 14 3.999 1.145 12.453 1.00 0.00 C ATOM 224 O ARG A 14 3.918 2.242 13.015 1.00 0.00 O ATOM 225 CB ARG A 14 6.378 0.798 11.574 1.00 0.00 C ATOM 226 CG ARG A 14 7.840 0.398 11.926 1.00 0.00 C ATOM 227 CD ARG A 14 8.056 -1.118 11.955 1.00 0.00 C ATOM 228 NE ARG A 14 9.449 -1.523 12.177 1.00 0.00 N ATOM 229 CZ ARG A 14 9.862 -2.798 12.309 1.00 0.00 C ATOM 230 NH1 ARG A 14 8.999 -3.812 12.231 1.00 0.00 N ATOM 231 NH2 ARG A 14 11.138 -3.052 12.500 1.00 0.00 N ATOM 0 H ARG A 14 5.293 -1.540 11.546 1.00 0.00 H new ATOM 0 HA ARG A 14 5.699 0.456 13.583 1.00 0.00 H new ATOM 0 HB2 ARG A 14 6.138 0.402 10.587 1.00 0.00 H new ATOM 0 HB3 ARG A 14 6.323 1.884 11.503 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.518 0.842 11.197 1.00 0.00 H new ATOM 0 HG3 ARG A 14 8.101 0.815 12.899 1.00 0.00 H new ATOM 0 HD2 ARG A 14 7.435 -1.547 12.741 1.00 0.00 H new ATOM 0 HD3 ARG A 14 7.713 -1.541 11.011 1.00 0.00 H new ATOM 0 HE ARG A 14 10.153 -0.788 12.235 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.009 -3.628 12.069 1.00 0.00 H new ATOM 0 HH12 ARG A 14 9.329 -4.772 12.333 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.809 -2.285 12.548 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.457 -4.016 12.601 1.00 0.00 H new ATOM 245 N ARG A 15 2.992 0.603 11.726 1.00 0.00 N ATOM 246 CA ARG A 15 1.667 1.240 11.585 1.00 0.00 C ATOM 247 C ARG A 15 0.933 1.272 12.935 1.00 0.00 C ATOM 248 O ARG A 15 0.333 2.294 13.302 1.00 0.00 O ATOM 249 CB ARG A 15 0.773 0.505 10.545 1.00 0.00 C ATOM 250 CG ARG A 15 1.273 0.531 9.085 1.00 0.00 C ATOM 251 CD ARG A 15 0.238 -0.053 8.095 1.00 0.00 C ATOM 252 NE ARG A 15 -0.986 0.774 8.023 1.00 0.00 N ATOM 253 CZ ARG A 15 -1.981 0.626 7.131 1.00 0.00 C ATOM 254 NH1 ARG A 15 -1.920 -0.300 6.176 1.00 0.00 N ATOM 255 NH2 ARG A 15 -3.024 1.435 7.183 1.00 0.00 N ATOM 0 H ARG A 15 3.078 -0.282 11.226 1.00 0.00 H new ATOM 0 HA ARG A 15 1.845 2.256 11.233 1.00 0.00 H new ATOM 0 HB2 ARG A 15 0.670 -0.535 10.854 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.223 0.947 10.575 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.503 1.558 8.801 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.201 -0.036 9.012 1.00 0.00 H new ATOM 0 HD2 ARG A 15 0.685 -0.126 7.104 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -0.026 -1.065 8.401 1.00 0.00 H new ATOM 0 HE ARG A 15 -1.084 1.522 8.710 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -1.108 -0.913 6.112 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.686 -0.396 5.509 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.069 2.164 7.895 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.784 1.331 6.511 1.00 0.00 H new ATOM 269 N VAL A 16 0.976 0.132 13.668 1.00 0.00 N ATOM 270 CA VAL A 16 0.263 0.003 14.952 1.00 0.00 C ATOM 271 C VAL A 16 0.934 0.870 16.035 1.00 0.00 C ATOM 272 O VAL A 16 0.242 1.550 16.777 1.00 0.00 O ATOM 273 CB VAL A 16 0.107 -1.491 15.452 1.00 0.00 C ATOM 274 CG1 VAL A 16 -0.444 -2.407 14.336 1.00 0.00 C ATOM 275 CG2 VAL A 16 1.412 -2.060 16.024 1.00 0.00 C ATOM 0 H VAL A 16 1.494 -0.702 13.390 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.749 0.365 14.770 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.618 -1.467 16.266 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.538 -3.425 14.714 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -1.422 -2.046 14.019 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.239 -2.397 13.487 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.248 -3.087 16.352 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.184 -2.043 15.255 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.732 -1.455 16.872 1.00 0.00 H new ATOM 285 N PHE A 17 2.294 0.868 16.084 1.00 0.00 N ATOM 286 CA PHE A 17 3.075 1.662 17.064 1.00 0.00 C ATOM 287 C PHE A 17 2.919 3.175 16.795 1.00 0.00 C ATOM 288 O PHE A 17 2.976 3.983 17.728 1.00 0.00 O ATOM 289 CB PHE A 17 4.576 1.222 17.087 1.00 0.00 C ATOM 290 CG PHE A 17 4.833 -0.066 17.886 1.00 0.00 C ATOM 291 CD1 PHE A 17 4.858 -0.042 19.279 1.00 0.00 C ATOM 292 CD2 PHE A 17 5.019 -1.295 17.260 1.00 0.00 C ATOM 293 CE1 PHE A 17 5.075 -1.196 20.007 1.00 0.00 C ATOM 294 CE2 PHE A 17 5.232 -2.448 17.991 1.00 0.00 C ATOM 295 CZ PHE A 17 5.255 -2.397 19.363 1.00 0.00 C ATOM 0 H PHE A 17 2.873 0.319 15.449 1.00 0.00 H new ATOM 0 HA PHE A 17 2.673 1.464 18.058 1.00 0.00 H new ATOM 0 HB2 PHE A 17 4.918 1.077 16.062 1.00 0.00 H new ATOM 0 HB3 PHE A 17 5.175 2.028 17.512 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.705 0.893 19.798 1.00 0.00 H new ATOM 0 HD2 PHE A 17 4.996 -1.349 16.182 1.00 0.00 H new ATOM 0 HE1 PHE A 17 5.103 -1.154 21.086 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.380 -3.390 17.483 1.00 0.00 H new ATOM 0 HZ PHE A 17 5.414 -3.299 19.935 1.00 0.00 H new ATOM 305 N ALA A 18 2.691 3.540 15.516 1.00 0.00 N ATOM 306 CA ALA A 18 2.352 4.926 15.119 1.00 0.00 C ATOM 307 C ALA A 18 0.932 5.313 15.594 1.00 0.00 C ATOM 308 O ALA A 18 0.654 6.487 15.850 1.00 0.00 O ATOM 309 CB ALA A 18 2.471 5.091 13.596 1.00 0.00 C ATOM 0 H ALA A 18 2.736 2.888 14.733 1.00 0.00 H new ATOM 0 HA ALA A 18 3.062 5.597 15.602 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.219 6.115 13.320 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.493 4.873 13.285 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.786 4.403 13.101 1.00 0.00 H new ATOM 315 N ALA A 19 0.043 4.303 15.703 1.00 0.00 N ATOM 316 CA ALA A 19 -1.341 4.475 16.215 1.00 0.00 C ATOM 317 C ALA A 19 -1.430 4.240 17.745 1.00 0.00 C ATOM 318 O ALA A 19 -2.533 4.265 18.314 1.00 0.00 O ATOM 319 CB ALA A 19 -2.291 3.522 15.463 1.00 0.00 C ATOM 0 H ALA A 19 0.261 3.342 15.439 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.642 5.507 16.035 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.306 3.649 15.839 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -2.268 3.751 14.398 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -1.972 2.492 15.620 1.00 0.00 H new ATOM 325 N GLY A 20 -0.268 4.016 18.402 1.00 0.00 N ATOM 326 CA GLY A 20 -0.206 3.813 19.860 1.00 0.00 C ATOM 327 C GLY A 20 -0.672 2.422 20.293 1.00 0.00 C ATOM 328 O GLY A 20 -1.350 2.268 21.316 1.00 0.00 O ATOM 0 H GLY A 20 0.640 3.972 17.939 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.818 3.968 20.199 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -0.822 4.565 20.352 1.00 0.00 H new ATOM 332 N GLY A 21 -0.293 1.420 19.495 1.00 0.00 N ATOM 333 CA GLY A 21 -0.641 0.014 19.723 1.00 0.00 C ATOM 334 C GLY A 21 0.588 -0.882 19.667 1.00 0.00 C ATOM 335 O GLY A 21 1.677 -0.415 19.339 1.00 0.00 O ATOM 0 H GLY A 21 0.273 1.565 18.659 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -1.124 -0.089 20.695 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.363 -0.309 18.973 1.00 0.00 H new ATOM 339 N PHE A 22 0.415 -2.178 19.957 1.00 0.00 N ATOM 340 CA PHE A 22 1.536 -3.147 20.043 1.00 0.00 C ATOM 341 C PHE A 22 1.462 -4.147 18.879 1.00 0.00 C ATOM 342 O PHE A 22 0.390 -4.353 18.312 1.00 0.00 O ATOM 343 CB PHE A 22 1.495 -3.882 21.414 1.00 0.00 C ATOM 344 CG PHE A 22 2.594 -4.935 21.616 1.00 0.00 C ATOM 345 CD1 PHE A 22 3.889 -4.558 21.971 1.00 0.00 C ATOM 346 CD2 PHE A 22 2.332 -6.299 21.447 1.00 0.00 C ATOM 347 CE1 PHE A 22 4.881 -5.503 22.146 1.00 0.00 C ATOM 348 CE2 PHE A 22 3.327 -7.243 21.622 1.00 0.00 C ATOM 349 CZ PHE A 22 4.600 -6.844 21.974 1.00 0.00 C ATOM 0 H PHE A 22 -0.499 -2.592 20.139 1.00 0.00 H new ATOM 0 HA PHE A 22 2.482 -2.611 19.968 1.00 0.00 H new ATOM 0 HB2 PHE A 22 1.572 -3.141 22.210 1.00 0.00 H new ATOM 0 HB3 PHE A 22 0.524 -4.366 21.522 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.119 -3.512 22.111 1.00 0.00 H new ATOM 0 HD2 PHE A 22 1.337 -6.620 21.176 1.00 0.00 H new ATOM 0 HE1 PHE A 22 5.879 -5.192 22.418 1.00 0.00 H new ATOM 0 HE2 PHE A 22 3.108 -8.291 21.483 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.377 -7.581 22.115 1.00 0.00 H new ATOM 359 N ALA A 23 2.621 -4.729 18.513 1.00 0.00 N ATOM 360 CA ALA A 23 2.713 -5.815 17.521 1.00 0.00 C ATOM 361 C ALA A 23 3.989 -6.632 17.723 1.00 0.00 C ATOM 362 O ALA A 23 4.969 -6.135 18.301 1.00 0.00 O ATOM 363 CB ALA A 23 2.656 -5.279 16.094 1.00 0.00 C ATOM 0 H ALA A 23 3.524 -4.456 18.900 1.00 0.00 H new ATOM 0 HA ALA A 23 1.851 -6.464 17.674 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.727 -6.109 15.391 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.714 -4.752 15.941 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.487 -4.592 15.930 1.00 0.00 H new ATOM 369 N ALA A 24 3.958 -7.879 17.217 1.00 0.00 N ATOM 370 CA ALA A 24 5.086 -8.816 17.285 1.00 0.00 C ATOM 371 C ALA A 24 4.816 -9.994 16.348 1.00 0.00 C ATOM 372 O ALA A 24 3.694 -10.513 16.310 1.00 0.00 O ATOM 373 CB ALA A 24 5.304 -9.308 18.727 1.00 0.00 C ATOM 0 H ALA A 24 3.140 -8.264 16.746 1.00 0.00 H new ATOM 0 HA ALA A 24 5.996 -8.305 16.970 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.145 -10.001 18.752 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.516 -8.457 19.374 1.00 0.00 H new ATOM 0 HB3 ALA A 24 4.405 -9.815 19.078 1.00 0.00 H new ATOM 379 N VAL A 25 5.836 -10.403 15.579 1.00 0.00 N ATOM 380 CA VAL A 25 5.730 -11.554 14.673 1.00 0.00 C ATOM 381 C VAL A 25 5.933 -12.844 15.486 1.00 0.00 C ATOM 382 O VAL A 25 7.052 -13.118 15.938 1.00 0.00 O ATOM 383 CB VAL A 25 6.783 -11.509 13.498 1.00 0.00 C ATOM 384 CG1 VAL A 25 6.417 -12.520 12.390 1.00 0.00 C ATOM 385 CG2 VAL A 25 6.958 -10.091 12.941 1.00 0.00 C ATOM 0 H VAL A 25 6.749 -9.949 15.568 1.00 0.00 H new ATOM 0 HA VAL A 25 4.740 -11.524 14.217 1.00 0.00 H new ATOM 0 HB VAL A 25 7.748 -11.804 13.909 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.158 -12.469 11.592 1.00 0.00 H new ATOM 0 HG12 VAL A 25 6.401 -13.527 12.807 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.433 -12.278 11.988 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.691 -10.105 12.135 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.004 -9.730 12.558 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.304 -9.429 13.734 1.00 0.00 H new ATOM 395 N GLU A 26 4.847 -13.591 15.715 1.00 0.00 N ATOM 396 CA GLU A 26 4.904 -14.892 16.405 1.00 0.00 C ATOM 397 C GLU A 26 5.484 -15.963 15.476 1.00 0.00 C ATOM 398 O GLU A 26 6.454 -16.646 15.824 1.00 0.00 O ATOM 399 CB GLU A 26 3.497 -15.313 16.890 1.00 0.00 C ATOM 400 CG GLU A 26 2.861 -14.331 17.883 1.00 0.00 C ATOM 401 CD GLU A 26 1.566 -14.864 18.503 1.00 0.00 C ATOM 402 OE1 GLU A 26 0.505 -14.724 17.880 1.00 0.00 O ATOM 403 OE2 GLU A 26 1.612 -15.457 19.603 1.00 0.00 O ATOM 0 H GLU A 26 3.907 -13.316 15.430 1.00 0.00 H new ATOM 0 HA GLU A 26 5.554 -14.791 17.274 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.841 -15.416 16.025 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.564 -16.295 17.358 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.575 -14.112 18.677 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.653 -13.390 17.373 1.00 0.00 H new ATOM 410 N LYS A 27 4.873 -16.096 14.288 1.00 0.00 N ATOM 411 CA LYS A 27 5.256 -17.104 13.286 1.00 0.00 C ATOM 412 C LYS A 27 5.696 -16.420 11.989 1.00 0.00 C ATOM 413 O LYS A 27 5.151 -15.381 11.615 1.00 0.00 O ATOM 414 CB LYS A 27 4.064 -18.049 12.990 1.00 0.00 C ATOM 415 CG LYS A 27 4.390 -19.192 12.003 1.00 0.00 C ATOM 416 CD LYS A 27 3.194 -20.130 11.730 1.00 0.00 C ATOM 417 CE LYS A 27 3.588 -21.359 10.884 1.00 0.00 C ATOM 418 NZ LYS A 27 4.358 -20.975 9.670 1.00 0.00 N ATOM 0 H LYS A 27 4.096 -15.505 13.994 1.00 0.00 H new ATOM 0 HA LYS A 27 6.086 -17.687 13.686 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.717 -18.482 13.928 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.240 -17.460 12.587 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.727 -18.762 11.060 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.219 -19.779 12.400 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.775 -20.465 12.679 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.411 -19.574 11.215 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.184 -22.041 11.491 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.689 -21.899 10.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 4.086 -21.591 8.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.151 -19.985 9.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.376 -21.080 9.857 1.00 0.00 H new ATOM 432 N LYS A 28 6.654 -17.047 11.301 1.00 0.00 N ATOM 433 CA LYS A 28 7.140 -16.619 9.986 1.00 0.00 C ATOM 434 C LYS A 28 6.808 -17.699 8.931 1.00 0.00 C ATOM 435 O LYS A 28 6.722 -18.895 9.247 1.00 0.00 O ATOM 436 CB LYS A 28 8.676 -16.335 10.043 1.00 0.00 C ATOM 437 CG LYS A 28 9.322 -16.111 8.655 1.00 0.00 C ATOM 438 CD LYS A 28 10.757 -15.549 8.684 1.00 0.00 C ATOM 439 CE LYS A 28 11.303 -15.302 7.256 1.00 0.00 C ATOM 440 NZ LYS A 28 12.608 -14.605 7.266 1.00 0.00 N ATOM 0 H LYS A 28 7.123 -17.883 11.649 1.00 0.00 H new ATOM 0 HA LYS A 28 6.641 -15.694 9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 28 8.850 -15.454 10.661 1.00 0.00 H new ATOM 0 HB3 LYS A 28 9.173 -17.172 10.534 1.00 0.00 H new ATOM 0 HG2 LYS A 28 9.331 -17.060 8.118 1.00 0.00 H new ATOM 0 HG3 LYS A 28 8.693 -15.428 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 28 10.771 -14.615 9.246 1.00 0.00 H new ATOM 0 HD3 LYS A 28 11.411 -16.246 9.208 1.00 0.00 H new ATOM 0 HE2 LYS A 28 11.407 -16.256 6.739 1.00 0.00 H new ATOM 0 HE3 LYS A 28 10.582 -14.711 6.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 12.515 -13.688 6.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.912 -14.451 8.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 13.315 -15.185 6.772 1.00 0.00 H new ATOM 454 N GLY A 29 6.586 -17.238 7.695 1.00 0.00 N ATOM 455 CA GLY A 29 6.490 -18.097 6.513 1.00 0.00 C ATOM 456 C GLY A 29 7.341 -17.553 5.365 1.00 0.00 C ATOM 457 O GLY A 29 8.460 -17.085 5.598 1.00 0.00 O ATOM 0 H GLY A 29 6.467 -16.247 7.487 1.00 0.00 H new ATOM 0 HA2 GLY A 29 6.817 -19.106 6.765 1.00 0.00 H new ATOM 0 HA3 GLY A 29 5.450 -18.169 6.196 1.00 0.00 H new ATOM 461 N ALA A 30 6.804 -17.589 4.126 1.00 0.00 N ATOM 462 CA ALA A 30 7.535 -17.151 2.912 1.00 0.00 C ATOM 463 C ALA A 30 7.538 -15.610 2.786 1.00 0.00 C ATOM 464 O ALA A 30 6.550 -14.951 3.125 1.00 0.00 O ATOM 465 CB ALA A 30 6.931 -17.808 1.655 1.00 0.00 C ATOM 0 H ALA A 30 5.858 -17.920 3.937 1.00 0.00 H new ATOM 0 HA ALA A 30 8.572 -17.474 3.004 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.478 -17.477 0.773 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.003 -18.892 1.741 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.884 -17.520 1.562 1.00 0.00 H new ATOM 471 N GLU A 31 8.649 -15.060 2.270 1.00 0.00 N ATOM 472 CA GLU A 31 8.880 -13.609 2.194 1.00 0.00 C ATOM 473 C GLU A 31 7.937 -12.922 1.191 1.00 0.00 C ATOM 474 O GLU A 31 7.191 -12.045 1.565 1.00 0.00 O ATOM 475 CB GLU A 31 10.345 -13.315 1.804 1.00 0.00 C ATOM 476 CG GLU A 31 11.393 -13.846 2.794 1.00 0.00 C ATOM 477 CD GLU A 31 12.822 -13.599 2.294 1.00 0.00 C ATOM 478 OE1 GLU A 31 13.303 -12.450 2.378 1.00 0.00 O ATOM 479 OE2 GLU A 31 13.456 -14.534 1.773 1.00 0.00 O ATOM 0 H GLU A 31 9.417 -15.614 1.891 1.00 0.00 H new ATOM 0 HA GLU A 31 8.672 -13.203 3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.539 -13.749 0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.471 -12.237 1.706 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.257 -13.363 3.762 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.241 -14.914 2.947 1.00 0.00 H new ATOM 486 N ALA A 32 8.002 -13.312 -0.087 1.00 0.00 N ATOM 487 CA ALA A 32 7.235 -12.651 -1.174 1.00 0.00 C ATOM 488 C ALA A 32 5.886 -13.351 -1.419 1.00 0.00 C ATOM 489 O ALA A 32 4.855 -12.693 -1.603 1.00 0.00 O ATOM 490 CB ALA A 32 8.080 -12.620 -2.463 1.00 0.00 C ATOM 0 H ALA A 32 8.581 -14.089 -0.406 1.00 0.00 H new ATOM 0 HA ALA A 32 7.016 -11.628 -0.867 1.00 0.00 H new ATOM 0 HB1 ALA A 32 7.514 -12.134 -3.258 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.000 -12.065 -2.282 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.324 -13.639 -2.762 1.00 0.00 H new ATOM 496 N ALA A 33 5.908 -14.691 -1.387 1.00 0.00 N ATOM 497 CA ALA A 33 4.758 -15.538 -1.760 1.00 0.00 C ATOM 498 C ALA A 33 4.008 -16.073 -0.523 1.00 0.00 C ATOM 499 O ALA A 33 3.168 -16.979 -0.642 1.00 0.00 O ATOM 500 CB ALA A 33 5.263 -16.699 -2.640 1.00 0.00 C ATOM 0 H ALA A 33 6.729 -15.225 -1.100 1.00 0.00 H new ATOM 0 HA ALA A 33 4.044 -14.932 -2.317 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.423 -17.333 -2.923 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.733 -16.297 -3.538 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.991 -17.288 -2.082 1.00 0.00 H new ATOM 506 N GLY A 34 4.300 -15.496 0.658 1.00 0.00 N ATOM 507 CA GLY A 34 3.726 -15.969 1.920 1.00 0.00 C ATOM 508 C GLY A 34 2.371 -15.365 2.243 1.00 0.00 C ATOM 509 O GLY A 34 2.088 -14.224 1.870 1.00 0.00 O ATOM 0 H GLY A 34 4.931 -14.701 0.758 1.00 0.00 H new ATOM 0 HA2 GLY A 34 3.629 -17.054 1.880 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.418 -15.740 2.731 1.00 0.00 H new ATOM 513 N ALA A 35 1.526 -16.144 2.933 1.00 0.00 N ATOM 514 CA ALA A 35 0.259 -15.653 3.494 1.00 0.00 C ATOM 515 C ALA A 35 0.559 -14.891 4.800 1.00 0.00 C ATOM 516 O ALA A 35 1.654 -15.012 5.345 1.00 0.00 O ATOM 517 CB ALA A 35 -0.701 -16.833 3.734 1.00 0.00 C ATOM 0 H ALA A 35 1.701 -17.132 3.118 1.00 0.00 H new ATOM 0 HA ALA A 35 -0.228 -14.972 2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.638 -16.461 4.150 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.899 -17.339 2.789 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -0.247 -17.535 4.433 1.00 0.00 H new ATOM 523 N ILE A 36 -0.407 -14.109 5.301 1.00 0.00 N ATOM 524 CA ILE A 36 -0.245 -13.299 6.527 1.00 0.00 C ATOM 525 C ILE A 36 -1.568 -13.348 7.304 1.00 0.00 C ATOM 526 O ILE A 36 -2.592 -12.874 6.804 1.00 0.00 O ATOM 527 CB ILE A 36 0.093 -11.773 6.261 1.00 0.00 C ATOM 528 CG1 ILE A 36 1.223 -11.550 5.208 1.00 0.00 C ATOM 529 CG2 ILE A 36 0.454 -11.059 7.598 1.00 0.00 C ATOM 530 CD1 ILE A 36 2.592 -12.022 5.637 1.00 0.00 C ATOM 0 H ILE A 36 -1.327 -14.017 4.870 1.00 0.00 H new ATOM 0 HA ILE A 36 0.597 -13.724 7.072 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.809 -11.334 5.835 1.00 0.00 H new ATOM 0 HG12 ILE A 36 0.949 -12.065 4.287 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.278 -10.487 4.974 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.684 -10.012 7.401 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.391 -11.122 8.284 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.322 -11.543 8.046 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.311 -11.825 4.841 1.00 0.00 H new ATOM 0 HD12 ILE A 36 2.894 -11.490 6.539 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.560 -13.092 5.841 1.00 0.00 H new ATOM 542 N PHE A 37 -1.549 -13.945 8.499 1.00 0.00 N ATOM 543 CA PHE A 37 -2.700 -13.982 9.404 1.00 0.00 C ATOM 544 C PHE A 37 -2.383 -13.190 10.678 1.00 0.00 C ATOM 545 O PHE A 37 -1.537 -13.582 11.481 1.00 0.00 O ATOM 546 CB PHE A 37 -3.109 -15.449 9.695 1.00 0.00 C ATOM 547 CG PHE A 37 -3.779 -16.097 8.489 1.00 0.00 C ATOM 548 CD1 PHE A 37 -3.023 -16.586 7.429 1.00 0.00 C ATOM 549 CD2 PHE A 37 -5.163 -16.171 8.397 1.00 0.00 C ATOM 550 CE1 PHE A 37 -3.623 -17.125 6.316 1.00 0.00 C ATOM 551 CE2 PHE A 37 -5.763 -16.715 7.286 1.00 0.00 C ATOM 552 CZ PHE A 37 -4.995 -17.192 6.245 1.00 0.00 C ATOM 0 H PHE A 37 -0.726 -14.421 8.868 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.559 -13.505 8.932 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.226 -16.024 9.974 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.789 -15.475 10.547 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.945 -16.541 7.481 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.774 -15.798 9.206 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.019 -17.495 5.500 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.840 -16.769 7.228 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.471 -17.618 5.374 1.00 0.00 H new ATOM 562 N VAL A 38 -3.092 -12.066 10.847 1.00 0.00 N ATOM 563 CA VAL A 38 -2.859 -11.098 11.924 1.00 0.00 C ATOM 564 C VAL A 38 -4.007 -11.188 12.935 1.00 0.00 C ATOM 565 O VAL A 38 -5.174 -11.148 12.556 1.00 0.00 O ATOM 566 CB VAL A 38 -2.758 -9.630 11.352 1.00 0.00 C ATOM 567 CG1 VAL A 38 -2.388 -8.616 12.455 1.00 0.00 C ATOM 568 CG2 VAL A 38 -1.746 -9.555 10.186 1.00 0.00 C ATOM 0 H VAL A 38 -3.857 -11.800 10.227 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.914 -11.334 12.413 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.743 -9.364 10.969 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.327 -7.616 12.025 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.151 -8.630 13.233 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.424 -8.884 12.887 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.697 -8.532 9.812 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.761 -9.860 10.539 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.065 -10.220 9.384 1.00 0.00 H new ATOM 578 N ARG A 39 -3.667 -11.322 14.213 1.00 0.00 N ATOM 579 CA ARG A 39 -4.638 -11.448 15.311 1.00 0.00 C ATOM 580 C ARG A 39 -4.567 -10.197 16.209 1.00 0.00 C ATOM 581 O ARG A 39 -3.504 -9.859 16.733 1.00 0.00 O ATOM 582 CB ARG A 39 -4.358 -12.756 16.099 1.00 0.00 C ATOM 583 CG ARG A 39 -2.884 -12.953 16.523 1.00 0.00 C ATOM 584 CD ARG A 39 -2.629 -14.302 17.204 1.00 0.00 C ATOM 585 NE ARG A 39 -3.403 -14.459 18.444 1.00 0.00 N ATOM 586 CZ ARG A 39 -3.043 -15.191 19.502 1.00 0.00 C ATOM 587 NH1 ARG A 39 -1.833 -15.736 19.588 1.00 0.00 N ATOM 588 NH2 ARG A 39 -3.881 -15.316 20.508 1.00 0.00 N ATOM 0 H ARG A 39 -2.697 -11.347 14.527 1.00 0.00 H new ATOM 0 HA ARG A 39 -5.653 -11.511 14.918 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.983 -12.767 16.992 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -4.662 -13.605 15.487 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -2.245 -12.870 15.644 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.597 -12.150 17.202 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -2.884 -15.108 16.515 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.566 -14.398 17.427 1.00 0.00 H new ATOM 0 HE ARG A 39 -4.294 -13.965 18.502 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -1.157 -15.599 18.836 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.581 -16.291 20.406 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.791 -14.857 20.473 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.620 -15.872 21.323 1.00 0.00 H new ATOM 602 N GLN A 40 -5.705 -9.499 16.349 1.00 0.00 N ATOM 603 CA GLN A 40 -5.800 -8.233 17.105 1.00 0.00 C ATOM 604 C GLN A 40 -6.437 -8.458 18.472 1.00 0.00 C ATOM 605 O GLN A 40 -7.575 -8.895 18.538 1.00 0.00 O ATOM 606 CB GLN A 40 -6.649 -7.198 16.318 1.00 0.00 C ATOM 607 CG GLN A 40 -6.925 -5.893 17.096 1.00 0.00 C ATOM 608 CD GLN A 40 -7.813 -4.899 16.355 1.00 0.00 C ATOM 609 OE1 GLN A 40 -7.798 -4.826 15.139 1.00 0.00 O ATOM 610 NE2 GLN A 40 -8.576 -4.118 17.097 1.00 0.00 N ATOM 0 H GLN A 40 -6.591 -9.796 15.940 1.00 0.00 H new ATOM 0 HA GLN A 40 -4.788 -7.853 17.242 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -6.135 -6.953 15.388 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -7.600 -7.655 16.046 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.394 -6.143 18.048 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -5.974 -5.412 17.326 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.562 -4.208 18.113 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.179 -3.425 16.654 1.00 0.00 H new ATOM 619 N ARG A 41 -5.722 -8.115 19.551 1.00 0.00 N ATOM 620 CA ARG A 41 -6.283 -8.126 20.908 1.00 0.00 C ATOM 621 C ARG A 41 -7.079 -6.829 21.149 1.00 0.00 C ATOM 622 O ARG A 41 -6.503 -5.739 21.160 1.00 0.00 O ATOM 623 CB ARG A 41 -5.174 -8.262 21.973 1.00 0.00 C ATOM 624 CG ARG A 41 -5.718 -8.379 23.419 1.00 0.00 C ATOM 625 CD ARG A 41 -4.620 -8.500 24.480 1.00 0.00 C ATOM 626 NE ARG A 41 -5.191 -8.509 25.841 1.00 0.00 N ATOM 627 CZ ARG A 41 -4.652 -9.100 26.915 1.00 0.00 C ATOM 628 NH1 ARG A 41 -3.547 -9.826 26.814 1.00 0.00 N ATOM 629 NH2 ARG A 41 -5.237 -8.966 28.088 1.00 0.00 N ATOM 0 H ARG A 41 -4.745 -7.824 19.509 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.944 -8.988 20.996 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.571 -9.141 21.748 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.513 -7.397 21.911 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -6.330 -7.504 23.640 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -6.371 -9.249 23.483 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.051 -9.415 24.316 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.922 -7.669 24.381 1.00 0.00 H new ATOM 0 HE ARG A 41 -6.076 -8.021 25.976 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.094 -9.941 25.908 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.150 -10.269 27.643 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.092 -8.416 28.172 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.835 -9.412 28.912 1.00 0.00 H new ATOM 643 N LEU A 42 -8.400 -6.975 21.314 1.00 0.00 N ATOM 644 CA LEU A 42 -9.317 -5.885 21.691 1.00 0.00 C ATOM 645 C LEU A 42 -9.130 -5.487 23.158 1.00 0.00 C ATOM 646 O LEU A 42 -8.527 -6.213 23.959 1.00 0.00 O ATOM 647 CB LEU A 42 -10.816 -6.274 21.430 1.00 0.00 C ATOM 648 CG LEU A 42 -11.286 -6.325 19.942 1.00 0.00 C ATOM 649 CD1 LEU A 42 -11.057 -4.978 19.231 1.00 0.00 C ATOM 650 CD2 LEU A 42 -10.632 -7.485 19.180 1.00 0.00 C ATOM 0 H LEU A 42 -8.873 -7.870 21.187 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.070 -5.030 21.061 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.995 -7.253 21.875 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.448 -5.562 21.961 1.00 0.00 H new ATOM 0 HG LEU A 42 -12.360 -6.510 19.948 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -11.396 -5.050 18.197 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.618 -4.196 19.743 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.995 -4.733 19.249 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.984 -7.487 18.148 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.549 -7.364 19.193 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.898 -8.429 19.656 1.00 0.00 H new ATOM 662 N ARG A 43 -9.719 -4.331 23.470 1.00 0.00 N ATOM 663 CA ARG A 43 -9.652 -3.663 24.779 1.00 0.00 C ATOM 664 C ARG A 43 -10.099 -4.553 25.960 1.00 0.00 C ATOM 665 O ARG A 43 -9.582 -4.400 27.075 1.00 0.00 O ATOM 666 CB ARG A 43 -10.515 -2.380 24.716 1.00 0.00 C ATOM 667 CG ARG A 43 -11.982 -2.619 24.262 1.00 0.00 C ATOM 668 CD ARG A 43 -12.789 -1.317 24.150 1.00 0.00 C ATOM 669 NE ARG A 43 -12.854 -0.614 25.447 1.00 0.00 N ATOM 670 CZ ARG A 43 -12.507 0.661 25.663 1.00 0.00 C ATOM 671 NH1 ARG A 43 -12.030 1.415 24.677 1.00 0.00 N ATOM 672 NH2 ARG A 43 -12.599 1.166 26.881 1.00 0.00 N ATOM 0 H ARG A 43 -10.279 -3.811 22.794 1.00 0.00 H new ATOM 0 HA ARG A 43 -8.606 -3.427 24.974 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.523 -1.913 25.701 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.046 -1.673 24.032 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.981 -3.125 23.297 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.473 -3.286 24.971 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -12.333 -0.667 23.404 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -13.798 -1.540 23.804 1.00 0.00 H new ATOM 0 HE ARG A 43 -13.193 -1.146 26.248 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -11.924 1.024 23.741 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -11.770 2.385 24.857 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.933 0.585 27.650 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.336 2.137 27.052 1.00 0.00 H new ATOM 686 N ASP A 44 -11.027 -5.496 25.712 1.00 0.00 N ATOM 687 CA ASP A 44 -11.669 -6.275 26.786 1.00 0.00 C ATOM 688 C ASP A 44 -10.905 -7.583 27.053 1.00 0.00 C ATOM 689 O ASP A 44 -10.759 -8.003 28.209 1.00 0.00 O ATOM 690 CB ASP A 44 -13.154 -6.557 26.423 1.00 0.00 C ATOM 691 CG ASP A 44 -13.344 -7.549 25.260 1.00 0.00 C ATOM 692 OD1 ASP A 44 -12.729 -7.353 24.182 1.00 0.00 O ATOM 693 OD2 ASP A 44 -14.120 -8.517 25.409 1.00 0.00 O ATOM 0 H ASP A 44 -11.349 -5.737 24.775 1.00 0.00 H new ATOM 0 HA ASP A 44 -11.642 -5.689 27.705 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.664 -6.946 27.304 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.638 -5.615 26.165 1.00 0.00 H new ATOM 698 N GLY A 45 -10.408 -8.208 25.974 1.00 0.00 N ATOM 699 CA GLY A 45 -9.766 -9.524 26.052 1.00 0.00 C ATOM 700 C GLY A 45 -9.956 -10.329 24.785 1.00 0.00 C ATOM 701 O GLY A 45 -9.119 -11.176 24.456 1.00 0.00 O ATOM 0 H GLY A 45 -10.440 -7.817 25.032 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -8.700 -9.396 26.242 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -10.177 -10.077 26.897 1.00 0.00 H new ATOM 705 N ARG A 46 -11.069 -10.075 24.070 1.00 0.00 N ATOM 706 CA ARG A 46 -11.383 -10.780 22.814 1.00 0.00 C ATOM 707 C ARG A 46 -10.409 -10.399 21.704 1.00 0.00 C ATOM 708 O ARG A 46 -9.646 -9.449 21.838 1.00 0.00 O ATOM 709 CB ARG A 46 -12.842 -10.504 22.373 1.00 0.00 C ATOM 710 CG ARG A 46 -13.913 -11.039 23.349 1.00 0.00 C ATOM 711 CD ARG A 46 -13.667 -12.506 23.749 1.00 0.00 C ATOM 712 NE ARG A 46 -14.802 -13.095 24.489 1.00 0.00 N ATOM 713 CZ ARG A 46 -14.757 -14.239 25.193 1.00 0.00 C ATOM 714 NH1 ARG A 46 -13.600 -14.845 25.432 1.00 0.00 N ATOM 715 NH2 ARG A 46 -15.871 -14.747 25.686 1.00 0.00 N ATOM 0 H ARG A 46 -11.768 -9.384 24.343 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.277 -11.848 23.003 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.977 -9.429 22.258 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.004 -10.952 21.393 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.925 -10.419 24.245 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.897 -10.952 22.887 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.479 -13.096 22.852 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -12.769 -12.565 24.364 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.690 -12.594 24.464 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -12.731 -14.443 25.080 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -13.580 -15.713 25.968 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.760 -14.272 25.532 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -15.843 -15.615 26.221 1.00 0.00 H new ATOM 729 N GLU A 47 -10.451 -11.150 20.600 1.00 0.00 N ATOM 730 CA GLU A 47 -9.514 -10.995 19.486 1.00 0.00 C ATOM 731 C GLU A 47 -10.230 -11.110 18.140 1.00 0.00 C ATOM 732 O GLU A 47 -11.290 -11.719 18.022 1.00 0.00 O ATOM 733 CB GLU A 47 -8.361 -12.036 19.566 1.00 0.00 C ATOM 734 CG GLU A 47 -7.396 -11.856 20.753 1.00 0.00 C ATOM 735 CD GLU A 47 -6.223 -12.843 20.712 1.00 0.00 C ATOM 736 OE1 GLU A 47 -5.386 -12.734 19.789 1.00 0.00 O ATOM 737 OE2 GLU A 47 -6.148 -13.744 21.577 1.00 0.00 O ATOM 0 H GLU A 47 -11.141 -11.887 20.454 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.083 -9.997 19.566 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.797 -13.034 19.621 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.786 -11.990 18.641 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -7.009 -10.837 20.751 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.944 -11.987 21.686 1.00 0.00 H new ATOM 744 N ASN A 48 -9.657 -10.450 17.143 1.00 0.00 N ATOM 745 CA ASN A 48 -10.012 -10.613 15.726 1.00 0.00 C ATOM 746 C ASN A 48 -8.904 -11.402 15.029 1.00 0.00 C ATOM 747 O ASN A 48 -7.812 -11.583 15.582 1.00 0.00 O ATOM 748 CB ASN A 48 -10.197 -9.230 15.031 1.00 0.00 C ATOM 749 CG ASN A 48 -11.504 -8.493 15.344 1.00 0.00 C ATOM 750 OD1 ASN A 48 -12.049 -7.789 14.492 1.00 0.00 O ATOM 751 ND2 ASN A 48 -12.011 -8.620 16.556 1.00 0.00 N ATOM 0 H ASN A 48 -8.913 -9.768 17.293 1.00 0.00 H new ATOM 0 HA ASN A 48 -10.958 -11.151 15.657 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -9.363 -8.588 15.315 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -10.134 -9.376 13.953 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -12.871 -8.130 16.803 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -11.543 -9.208 17.246 1.00 0.00 H new ATOM 758 N LEU A 49 -9.192 -11.868 13.819 1.00 0.00 N ATOM 759 CA LEU A 49 -8.220 -12.536 12.958 1.00 0.00 C ATOM 760 C LEU A 49 -8.410 -11.978 11.554 1.00 0.00 C ATOM 761 O LEU A 49 -9.536 -11.703 11.142 1.00 0.00 O ATOM 762 CB LEU A 49 -8.391 -14.088 12.992 1.00 0.00 C ATOM 763 CG LEU A 49 -7.067 -14.915 13.068 1.00 0.00 C ATOM 764 CD1 LEU A 49 -7.349 -16.402 13.307 1.00 0.00 C ATOM 765 CD2 LEU A 49 -6.182 -14.712 11.817 1.00 0.00 C ATOM 0 H LEU A 49 -10.120 -11.792 13.402 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.206 -12.345 13.308 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.010 -14.348 13.851 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.938 -14.394 12.100 1.00 0.00 H new ATOM 0 HG LEU A 49 -6.508 -14.537 13.924 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -6.407 -16.948 13.355 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -7.887 -16.524 14.247 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -7.954 -16.794 12.489 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -5.273 -15.306 11.914 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -6.729 -15.029 10.929 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -5.919 -13.658 11.725 1.00 0.00 H new ATOM 777 N TYR A 50 -7.301 -11.769 10.857 1.00 0.00 N ATOM 778 CA TYR A 50 -7.261 -11.187 9.518 1.00 0.00 C ATOM 779 C TYR A 50 -6.422 -12.103 8.626 1.00 0.00 C ATOM 780 O TYR A 50 -5.488 -12.730 9.114 1.00 0.00 O ATOM 781 CB TYR A 50 -6.659 -9.757 9.598 1.00 0.00 C ATOM 782 CG TYR A 50 -7.365 -8.876 10.642 1.00 0.00 C ATOM 783 CD1 TYR A 50 -8.691 -8.491 10.466 1.00 0.00 C ATOM 784 CD2 TYR A 50 -6.723 -8.466 11.813 1.00 0.00 C ATOM 785 CE1 TYR A 50 -9.346 -7.724 11.399 1.00 0.00 C ATOM 786 CE2 TYR A 50 -7.379 -7.697 12.750 1.00 0.00 C ATOM 787 CZ TYR A 50 -8.693 -7.329 12.536 1.00 0.00 C ATOM 788 OH TYR A 50 -9.351 -6.549 13.462 1.00 0.00 O ATOM 0 H TYR A 50 -6.376 -12.006 11.216 1.00 0.00 H new ATOM 0 HA TYR A 50 -8.262 -11.102 9.094 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -5.599 -9.826 9.843 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.729 -9.282 8.620 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -9.217 -8.802 9.576 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -5.697 -8.756 11.987 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -10.373 -7.433 11.236 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.868 -7.383 13.648 1.00 0.00 H new ATOM 0 HH TYR A 50 -8.701 -6.003 13.951 1.00 0.00 H new ATOM 798 N GLY A 51 -6.767 -12.190 7.337 1.00 0.00 N ATOM 799 CA GLY A 51 -6.056 -13.054 6.387 1.00 0.00 C ATOM 800 C GLY A 51 -6.001 -12.441 5.002 1.00 0.00 C ATOM 801 O GLY A 51 -6.698 -11.460 4.757 1.00 0.00 O ATOM 0 H GLY A 51 -7.540 -11.668 6.925 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.042 -13.232 6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.552 -14.024 6.336 1.00 0.00 H new ATOM 805 N PRO A 52 -5.177 -12.994 4.056 1.00 0.00 N ATOM 806 CA PRO A 52 -5.073 -12.460 2.676 1.00 0.00 C ATOM 807 C PRO A 52 -6.403 -12.624 1.914 1.00 0.00 C ATOM 808 O PRO A 52 -6.944 -13.734 1.833 1.00 0.00 O ATOM 809 CB PRO A 52 -3.929 -13.302 2.031 1.00 0.00 C ATOM 810 CG PRO A 52 -3.229 -13.942 3.194 1.00 0.00 C ATOM 811 CD PRO A 52 -4.294 -14.164 4.240 1.00 0.00 C ATOM 0 HA PRO A 52 -4.861 -11.391 2.652 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -4.326 -14.051 1.346 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -3.249 -12.673 1.456 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -2.765 -14.884 2.902 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.434 -13.300 3.574 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -4.827 -15.102 4.083 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -3.874 -14.200 5.245 1.00 0.00 H new ATOM 819 N ALA A 53 -6.928 -11.509 1.399 1.00 0.00 N ATOM 820 CA ALA A 53 -8.190 -11.484 0.647 1.00 0.00 C ATOM 821 C ALA A 53 -7.940 -11.791 -0.844 1.00 0.00 C ATOM 822 O ALA A 53 -6.837 -11.530 -1.349 1.00 0.00 O ATOM 823 CB ALA A 53 -8.877 -10.118 0.804 1.00 0.00 C ATOM 0 H ALA A 53 -6.489 -10.593 1.491 1.00 0.00 H new ATOM 0 HA ALA A 53 -8.847 -12.254 1.051 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.811 -10.114 0.242 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -9.087 -9.935 1.858 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.221 -9.335 0.424 1.00 0.00 H new ATOM 829 N PRO A 54 -8.957 -12.368 -1.570 1.00 0.00 N ATOM 830 CA PRO A 54 -8.894 -12.512 -3.036 1.00 0.00 C ATOM 831 C PRO A 54 -8.927 -11.125 -3.724 1.00 0.00 C ATOM 832 O PRO A 54 -9.991 -10.496 -3.843 1.00 0.00 O ATOM 833 CB PRO A 54 -10.141 -13.384 -3.376 1.00 0.00 C ATOM 834 CG PRO A 54 -11.089 -13.158 -2.235 1.00 0.00 C ATOM 835 CD PRO A 54 -10.218 -12.945 -1.016 1.00 0.00 C ATOM 0 HA PRO A 54 -7.973 -12.975 -3.390 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -10.586 -13.085 -4.325 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -9.875 -14.437 -3.466 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -11.724 -12.291 -2.419 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.750 -14.014 -2.099 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -10.688 -12.267 -0.303 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -10.031 -13.881 -0.490 1.00 0.00 H new ATOM 843 N GLN A 55 -7.727 -10.622 -4.079 1.00 0.00 N ATOM 844 CA GLN A 55 -7.570 -9.374 -4.831 1.00 0.00 C ATOM 845 C GLN A 55 -8.182 -9.543 -6.227 1.00 0.00 C ATOM 846 O GLN A 55 -7.679 -10.330 -7.043 1.00 0.00 O ATOM 847 CB GLN A 55 -6.071 -8.967 -4.914 1.00 0.00 C ATOM 848 CG GLN A 55 -5.777 -7.666 -5.707 1.00 0.00 C ATOM 849 CD GLN A 55 -6.438 -6.402 -5.130 1.00 0.00 C ATOM 850 OE1 GLN A 55 -6.645 -6.279 -3.920 1.00 0.00 O ATOM 851 NE2 GLN A 55 -6.767 -5.445 -5.993 1.00 0.00 N ATOM 0 H GLN A 55 -6.843 -11.075 -3.849 1.00 0.00 H new ATOM 0 HA GLN A 55 -8.095 -8.571 -4.314 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -5.688 -8.849 -3.901 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -5.515 -9.785 -5.372 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -4.698 -7.513 -5.741 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -6.113 -7.799 -6.735 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -6.585 -5.572 -6.989 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -7.201 -4.584 -5.659 1.00 0.00 H new ATOM 860 N SER A 56 -9.315 -8.856 -6.448 1.00 0.00 N ATOM 861 CA SER A 56 -10.015 -8.838 -7.735 1.00 0.00 C ATOM 862 C SER A 56 -9.104 -8.204 -8.805 1.00 0.00 C ATOM 863 O SER A 56 -8.990 -6.974 -8.895 1.00 0.00 O ATOM 864 CB SER A 56 -11.348 -8.059 -7.603 1.00 0.00 C ATOM 865 OG SER A 56 -12.103 -8.092 -8.808 1.00 0.00 O ATOM 0 H SER A 56 -9.771 -8.294 -5.730 1.00 0.00 H new ATOM 0 HA SER A 56 -10.251 -9.858 -8.040 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.939 -8.485 -6.792 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.138 -7.024 -7.334 1.00 0.00 H new ATOM 0 HG SER A 56 -12.937 -7.592 -8.685 1.00 0.00 H new ATOM 871 N PHE A 57 -8.398 -9.071 -9.549 1.00 0.00 N ATOM 872 CA PHE A 57 -7.475 -8.650 -10.605 1.00 0.00 C ATOM 873 C PHE A 57 -8.224 -8.420 -11.921 1.00 0.00 C ATOM 874 O PHE A 57 -9.055 -9.233 -12.325 1.00 0.00 O ATOM 875 CB PHE A 57 -6.296 -9.659 -10.778 1.00 0.00 C ATOM 876 CG PHE A 57 -6.690 -11.135 -10.862 1.00 0.00 C ATOM 877 CD1 PHE A 57 -7.019 -11.736 -12.077 1.00 0.00 C ATOM 878 CD2 PHE A 57 -6.700 -11.926 -9.715 1.00 0.00 C ATOM 879 CE1 PHE A 57 -7.353 -13.075 -12.136 1.00 0.00 C ATOM 880 CE2 PHE A 57 -7.034 -13.260 -9.773 1.00 0.00 C ATOM 881 CZ PHE A 57 -7.356 -13.839 -10.985 1.00 0.00 C ATOM 0 H PHE A 57 -8.454 -10.083 -9.432 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.033 -7.700 -10.303 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -5.748 -9.397 -11.683 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -5.609 -9.533 -9.941 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -7.013 -11.147 -12.982 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.441 -11.485 -8.764 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -7.612 -13.525 -13.083 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -7.044 -13.854 -8.871 1.00 0.00 H new ATOM 0 HZ PHE A 57 -7.610 -14.888 -11.033 1.00 0.00 H new ATOM 891 N ALA A 58 -7.930 -7.287 -12.554 1.00 0.00 N ATOM 892 CA ALA A 58 -8.451 -6.932 -13.870 1.00 0.00 C ATOM 893 C ALA A 58 -7.372 -7.282 -14.897 1.00 0.00 C ATOM 894 O ALA A 58 -6.361 -6.577 -14.980 1.00 0.00 O ATOM 895 CB ALA A 58 -8.816 -5.435 -13.913 1.00 0.00 C ATOM 0 H ALA A 58 -7.312 -6.578 -12.159 1.00 0.00 H new ATOM 0 HA ALA A 58 -9.364 -7.484 -14.094 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.203 -5.183 -14.900 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.576 -5.224 -13.160 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.927 -4.838 -13.709 1.00 0.00 H new ATOM 901 N ASP A 59 -7.570 -8.419 -15.601 1.00 0.00 N ATOM 902 CA ASP A 59 -6.660 -8.926 -16.660 1.00 0.00 C ATOM 903 C ASP A 59 -5.317 -9.415 -16.039 1.00 0.00 C ATOM 904 O ASP A 59 -4.253 -9.316 -16.655 1.00 0.00 O ATOM 905 CB ASP A 59 -6.465 -7.836 -17.771 1.00 0.00 C ATOM 906 CG ASP A 59 -5.763 -8.341 -19.045 1.00 0.00 C ATOM 907 OD1 ASP A 59 -6.420 -9.012 -19.866 1.00 0.00 O ATOM 908 OD2 ASP A 59 -4.558 -8.068 -19.234 1.00 0.00 O ATOM 0 H ASP A 59 -8.379 -9.022 -15.449 1.00 0.00 H new ATOM 0 HA ASP A 59 -7.109 -9.793 -17.144 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -7.441 -7.435 -18.044 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -5.886 -7.011 -17.355 1.00 0.00 H new ATOM 913 N ASP A 60 -5.398 -9.955 -14.793 1.00 0.00 N ATOM 914 CA ASP A 60 -4.237 -10.514 -14.037 1.00 0.00 C ATOM 915 C ASP A 60 -3.186 -9.439 -13.700 1.00 0.00 C ATOM 916 O ASP A 60 -2.061 -9.766 -13.306 1.00 0.00 O ATOM 917 CB ASP A 60 -3.557 -11.702 -14.790 1.00 0.00 C ATOM 918 CG ASP A 60 -4.497 -12.880 -15.087 1.00 0.00 C ATOM 919 OD1 ASP A 60 -4.715 -13.722 -14.189 1.00 0.00 O ATOM 920 OD2 ASP A 60 -4.996 -12.983 -16.231 1.00 0.00 O ATOM 0 H ASP A 60 -6.277 -10.016 -14.279 1.00 0.00 H new ATOM 0 HA ASP A 60 -4.650 -10.892 -13.102 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -3.146 -11.334 -15.730 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -2.718 -12.062 -14.195 1.00 0.00 H new ATOM 925 N GLU A 61 -3.557 -8.160 -13.823 1.00 0.00 N ATOM 926 CA GLU A 61 -2.618 -7.055 -13.616 1.00 0.00 C ATOM 927 C GLU A 61 -2.370 -6.819 -12.122 1.00 0.00 C ATOM 928 O GLU A 61 -1.227 -6.660 -11.715 1.00 0.00 O ATOM 929 CB GLU A 61 -3.132 -5.781 -14.300 1.00 0.00 C ATOM 930 CG GLU A 61 -3.234 -5.925 -15.834 1.00 0.00 C ATOM 931 CD GLU A 61 -3.548 -4.612 -16.554 1.00 0.00 C ATOM 932 OE1 GLU A 61 -4.737 -4.288 -16.738 1.00 0.00 O ATOM 933 OE2 GLU A 61 -2.602 -3.890 -16.939 1.00 0.00 O ATOM 0 H GLU A 61 -4.503 -7.865 -14.065 1.00 0.00 H new ATOM 0 HA GLU A 61 -1.664 -7.324 -14.070 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.113 -5.528 -13.897 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.466 -4.952 -14.061 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -2.294 -6.323 -16.216 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.009 -6.654 -16.071 1.00 0.00 H new ATOM 940 N ASP A 62 -3.451 -6.858 -11.312 1.00 0.00 N ATOM 941 CA ASP A 62 -3.395 -6.602 -9.840 1.00 0.00 C ATOM 942 C ASP A 62 -2.516 -7.624 -9.082 1.00 0.00 C ATOM 943 O ASP A 62 -2.213 -7.422 -7.904 1.00 0.00 O ATOM 944 CB ASP A 62 -4.818 -6.598 -9.216 1.00 0.00 C ATOM 945 CG ASP A 62 -5.737 -5.491 -9.761 1.00 0.00 C ATOM 946 OD1 ASP A 62 -5.995 -5.471 -10.988 1.00 0.00 O ATOM 947 OD2 ASP A 62 -6.203 -4.637 -8.973 1.00 0.00 O ATOM 0 H ASP A 62 -4.390 -7.067 -11.652 1.00 0.00 H new ATOM 0 HA ASP A 62 -2.939 -5.618 -9.730 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -5.286 -7.566 -9.397 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -4.730 -6.483 -8.136 1.00 0.00 H new ATOM 952 N ILE A 63 -2.137 -8.719 -9.761 1.00 0.00 N ATOM 953 CA ILE A 63 -1.188 -9.722 -9.229 1.00 0.00 C ATOM 954 C ILE A 63 0.190 -9.063 -8.966 1.00 0.00 C ATOM 955 O ILE A 63 0.844 -9.313 -7.943 1.00 0.00 O ATOM 956 CB ILE A 63 -1.007 -10.926 -10.241 1.00 0.00 C ATOM 957 CG1 ILE A 63 -2.387 -11.544 -10.645 1.00 0.00 C ATOM 958 CG2 ILE A 63 -0.057 -12.015 -9.675 1.00 0.00 C ATOM 959 CD1 ILE A 63 -3.218 -12.049 -9.490 1.00 0.00 C ATOM 0 H ILE A 63 -2.478 -8.938 -10.697 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.596 -10.108 -8.295 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.544 -10.521 -11.141 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.961 -10.792 -11.186 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.211 -12.369 -11.336 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.041 -12.824 -10.399 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.923 -11.579 -9.483 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.467 -12.408 -8.745 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.155 -12.459 -9.868 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.669 -12.827 -8.960 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.431 -11.226 -8.808 1.00 0.00 H new ATOM 971 N MET A 64 0.594 -8.196 -9.908 1.00 0.00 N ATOM 972 CA MET A 64 1.913 -7.535 -9.922 1.00 0.00 C ATOM 973 C MET A 64 1.776 -6.000 -9.853 1.00 0.00 C ATOM 974 O MET A 64 2.779 -5.305 -9.720 1.00 0.00 O ATOM 975 CB MET A 64 2.673 -7.957 -11.210 1.00 0.00 C ATOM 976 CG MET A 64 1.985 -7.542 -12.526 1.00 0.00 C ATOM 977 SD MET A 64 2.714 -8.326 -13.981 1.00 0.00 S ATOM 978 CE MET A 64 2.315 -10.051 -13.687 1.00 0.00 C ATOM 0 H MET A 64 0.004 -7.929 -10.696 1.00 0.00 H new ATOM 0 HA MET A 64 2.474 -7.848 -9.042 1.00 0.00 H new ATOM 0 HB2 MET A 64 3.672 -7.523 -11.185 1.00 0.00 H new ATOM 0 HB3 MET A 64 2.796 -9.040 -11.205 1.00 0.00 H new ATOM 0 HG2 MET A 64 0.927 -7.799 -12.473 1.00 0.00 H new ATOM 0 HG3 MET A 64 2.045 -6.459 -12.635 1.00 0.00 H new ATOM 0 HE1 MET A 64 2.302 -10.588 -14.635 1.00 0.00 H new ATOM 0 HE2 MET A 64 3.066 -10.491 -13.031 1.00 0.00 H new ATOM 0 HE3 MET A 64 1.335 -10.123 -13.216 1.00 0.00 H new ATOM 988 N ARG A 65 0.532 -5.481 -9.954 1.00 0.00 N ATOM 989 CA ARG A 65 0.248 -4.017 -9.977 1.00 0.00 C ATOM 990 C ARG A 65 -0.661 -3.608 -8.799 1.00 0.00 C ATOM 991 O ARG A 65 -1.160 -2.476 -8.751 1.00 0.00 O ATOM 992 CB ARG A 65 -0.397 -3.598 -11.332 1.00 0.00 C ATOM 993 CG ARG A 65 0.423 -3.963 -12.596 1.00 0.00 C ATOM 994 CD ARG A 65 1.843 -3.360 -12.605 1.00 0.00 C ATOM 995 NE ARG A 65 1.831 -1.886 -12.596 1.00 0.00 N ATOM 996 CZ ARG A 65 2.915 -1.104 -12.514 1.00 0.00 C ATOM 997 NH1 ARG A 65 4.129 -1.625 -12.359 1.00 0.00 N ATOM 998 NH2 ARG A 65 2.776 0.205 -12.589 1.00 0.00 N ATOM 0 H ARG A 65 -0.306 -6.059 -10.022 1.00 0.00 H new ATOM 0 HA ARG A 65 1.198 -3.494 -9.871 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -1.379 -4.065 -11.408 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -0.557 -2.520 -11.322 1.00 0.00 H new ATOM 0 HG2 ARG A 65 0.497 -5.048 -12.670 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -0.115 -3.619 -13.480 1.00 0.00 H new ATOM 0 HD2 ARG A 65 2.393 -3.721 -11.736 1.00 0.00 H new ATOM 0 HD3 ARG A 65 2.377 -3.710 -13.488 1.00 0.00 H new ATOM 0 HE ARG A 65 0.924 -1.424 -12.657 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.246 -2.637 -12.301 1.00 0.00 H new ATOM 0 HH12 ARG A 65 4.943 -1.013 -12.299 1.00 0.00 H new ATOM 0 HH21 ARG A 65 1.849 0.613 -12.708 1.00 0.00 H new ATOM 0 HH22 ARG A 65 3.595 0.809 -12.528 1.00 0.00 H new ATOM 1012 N ALA A 66 -0.855 -4.531 -7.845 1.00 0.00 N ATOM 1013 CA ALA A 66 -1.533 -4.260 -6.565 1.00 0.00 C ATOM 1014 C ALA A 66 -0.973 -5.197 -5.497 1.00 0.00 C ATOM 1015 O ALA A 66 -0.504 -6.298 -5.808 1.00 0.00 O ATOM 1016 CB ALA A 66 -3.061 -4.413 -6.683 1.00 0.00 C ATOM 0 H ALA A 66 -0.543 -5.497 -7.940 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.342 -3.225 -6.281 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -3.523 -4.205 -5.718 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -3.441 -3.712 -7.426 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -3.302 -5.431 -6.989 1.00 0.00 H new ATOM 1022 N GLU A 67 -1.001 -4.730 -4.247 1.00 0.00 N ATOM 1023 CA GLU A 67 -0.503 -5.490 -3.088 1.00 0.00 C ATOM 1024 C GLU A 67 -1.553 -6.510 -2.606 1.00 0.00 C ATOM 1025 O GLU A 67 -2.675 -6.577 -3.133 1.00 0.00 O ATOM 1026 CB GLU A 67 -0.118 -4.548 -1.913 1.00 0.00 C ATOM 1027 CG GLU A 67 -1.263 -3.704 -1.298 1.00 0.00 C ATOM 1028 CD GLU A 67 -1.749 -2.562 -2.209 1.00 0.00 C ATOM 1029 OE1 GLU A 67 -0.968 -1.611 -2.435 1.00 0.00 O ATOM 1030 OE2 GLU A 67 -2.884 -2.620 -2.721 1.00 0.00 O ATOM 0 H GLU A 67 -1.370 -3.811 -4.004 1.00 0.00 H new ATOM 0 HA GLU A 67 0.390 -6.023 -3.414 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.322 -5.154 -1.121 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.658 -3.867 -2.262 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.104 -4.359 -1.072 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.924 -3.283 -0.352 1.00 0.00 H new ATOM 1037 N ARG A 68 -1.173 -7.299 -1.587 1.00 0.00 N ATOM 1038 CA ARG A 68 -2.108 -8.181 -0.885 1.00 0.00 C ATOM 1039 C ARG A 68 -2.900 -7.355 0.155 1.00 0.00 C ATOM 1040 O ARG A 68 -2.352 -6.889 1.165 1.00 0.00 O ATOM 1041 CB ARG A 68 -1.362 -9.392 -0.232 1.00 0.00 C ATOM 1042 CG ARG A 68 -0.296 -9.043 0.842 1.00 0.00 C ATOM 1043 CD ARG A 68 0.415 -10.291 1.416 1.00 0.00 C ATOM 1044 NE ARG A 68 1.296 -10.949 0.426 1.00 0.00 N ATOM 1045 CZ ARG A 68 1.019 -12.079 -0.258 1.00 0.00 C ATOM 1046 NH1 ARG A 68 -0.157 -12.690 -0.126 1.00 0.00 N ATOM 1047 NH2 ARG A 68 1.937 -12.588 -1.070 1.00 0.00 N ATOM 0 H ARG A 68 -0.217 -7.341 -1.233 1.00 0.00 H new ATOM 0 HA ARG A 68 -2.813 -8.605 -1.599 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -2.105 -10.047 0.223 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -0.876 -9.962 -1.024 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.448 -8.377 0.405 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.773 -8.497 1.656 1.00 0.00 H new ATOM 0 HD2 ARG A 68 1.005 -10.001 2.286 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.333 -11.004 1.762 1.00 0.00 H new ATOM 0 HE ARG A 68 2.197 -10.507 0.243 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.865 -12.305 0.499 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -0.350 -13.543 -0.650 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.840 -12.126 -1.172 1.00 0.00 H new ATOM 0 HH22 ARG A 68 1.739 -13.442 -1.592 1.00 0.00 H new ATOM 1061 N ARG A 69 -4.179 -7.103 -0.143 1.00 0.00 N ATOM 1062 CA ARG A 69 -5.107 -6.478 0.796 1.00 0.00 C ATOM 1063 C ARG A 69 -5.802 -7.606 1.564 1.00 0.00 C ATOM 1064 O ARG A 69 -5.983 -8.706 1.033 1.00 0.00 O ATOM 1065 CB ARG A 69 -6.101 -5.566 0.035 1.00 0.00 C ATOM 1066 CG ARG A 69 -7.061 -4.745 0.926 1.00 0.00 C ATOM 1067 CD ARG A 69 -7.796 -3.648 0.131 1.00 0.00 C ATOM 1068 NE ARG A 69 -8.331 -4.163 -1.146 1.00 0.00 N ATOM 1069 CZ ARG A 69 -8.690 -3.418 -2.198 1.00 0.00 C ATOM 1070 NH1 ARG A 69 -8.698 -2.095 -2.124 1.00 0.00 N ATOM 1071 NH2 ARG A 69 -9.056 -4.011 -3.319 1.00 0.00 N ATOM 0 H ARG A 69 -4.598 -7.329 -1.045 1.00 0.00 H new ATOM 0 HA ARG A 69 -4.591 -5.832 1.506 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -5.531 -4.876 -0.588 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.696 -6.186 -0.636 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -7.792 -5.413 1.382 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.498 -4.287 1.739 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.612 -3.248 0.732 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -7.112 -2.823 -0.068 1.00 0.00 H new ATOM 0 HE ARG A 69 -8.436 -5.174 -1.233 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.428 -1.631 -1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -8.974 -1.541 -2.934 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -9.064 -5.029 -3.378 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -9.331 -3.451 -4.126 1.00 0.00 H new ATOM 1085 N PHE A 70 -6.149 -7.342 2.821 1.00 0.00 N ATOM 1086 CA PHE A 70 -6.600 -8.373 3.771 1.00 0.00 C ATOM 1087 C PHE A 70 -8.122 -8.380 3.885 1.00 0.00 C ATOM 1088 O PHE A 70 -8.805 -7.593 3.242 1.00 0.00 O ATOM 1089 CB PHE A 70 -5.954 -8.136 5.167 1.00 0.00 C ATOM 1090 CG PHE A 70 -4.460 -8.422 5.262 1.00 0.00 C ATOM 1091 CD1 PHE A 70 -3.568 -7.978 4.287 1.00 0.00 C ATOM 1092 CD2 PHE A 70 -3.946 -9.126 6.348 1.00 0.00 C ATOM 1093 CE1 PHE A 70 -2.223 -8.229 4.391 1.00 0.00 C ATOM 1094 CE2 PHE A 70 -2.601 -9.373 6.448 1.00 0.00 C ATOM 1095 CZ PHE A 70 -1.740 -8.927 5.468 1.00 0.00 C ATOM 0 H PHE A 70 -6.127 -6.403 3.218 1.00 0.00 H new ATOM 0 HA PHE A 70 -6.283 -9.346 3.396 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.125 -7.099 5.455 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.471 -8.759 5.897 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.942 -7.428 3.436 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.613 -9.481 7.119 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.546 -7.878 3.626 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.215 -9.918 7.297 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.682 -9.128 5.549 1.00 0.00 H new ATOM 1105 N GLU A 71 -8.617 -9.335 4.663 1.00 0.00 N ATOM 1106 CA GLU A 71 -10.020 -9.480 5.053 1.00 0.00 C ATOM 1107 C GLU A 71 -10.057 -9.887 6.528 1.00 0.00 C ATOM 1108 O GLU A 71 -9.024 -10.246 7.101 1.00 0.00 O ATOM 1109 CB GLU A 71 -10.730 -10.554 4.190 1.00 0.00 C ATOM 1110 CG GLU A 71 -10.093 -11.960 4.263 1.00 0.00 C ATOM 1111 CD GLU A 71 -10.922 -13.030 3.543 1.00 0.00 C ATOM 1112 OE1 GLU A 71 -10.803 -13.161 2.312 1.00 0.00 O ATOM 1113 OE2 GLU A 71 -11.696 -13.751 4.215 1.00 0.00 O ATOM 0 H GLU A 71 -8.026 -10.065 5.059 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.543 -8.536 4.899 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.771 -10.624 4.504 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.732 -10.224 3.151 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.096 -11.924 3.824 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -9.972 -12.244 5.308 1.00 0.00 H new ATOM 1120 N THR A 72 -11.239 -9.847 7.131 1.00 0.00 N ATOM 1121 CA THR A 72 -11.433 -10.220 8.531 1.00 0.00 C ATOM 1122 C THR A 72 -11.913 -11.687 8.592 1.00 0.00 C ATOM 1123 O THR A 72 -13.046 -11.985 8.192 1.00 0.00 O ATOM 1124 CB THR A 72 -12.464 -9.259 9.216 1.00 0.00 C ATOM 1125 OG1 THR A 72 -12.096 -7.899 8.951 1.00 0.00 O ATOM 1126 CG2 THR A 72 -12.546 -9.468 10.736 1.00 0.00 C ATOM 0 H THR A 72 -12.096 -9.554 6.662 1.00 0.00 H new ATOM 0 HA THR A 72 -10.492 -10.128 9.073 1.00 0.00 H new ATOM 0 HB THR A 72 -13.445 -9.486 8.798 1.00 0.00 H new ATOM 0 HG1 THR A 72 -11.868 -7.452 9.793 1.00 0.00 H new ATOM 0 HG21 THR A 72 -13.275 -8.777 11.160 1.00 0.00 H new ATOM 0 HG22 THR A 72 -12.853 -10.493 10.946 1.00 0.00 H new ATOM 0 HG23 THR A 72 -11.569 -9.283 11.182 1.00 0.00 H new ATOM 1134 N ARG A 73 -11.017 -12.601 9.032 1.00 0.00 N ATOM 1135 CA ARG A 73 -11.344 -14.026 9.232 1.00 0.00 C ATOM 1136 C ARG A 73 -12.326 -14.173 10.414 1.00 0.00 C ATOM 1137 O ARG A 73 -13.442 -14.682 10.251 1.00 0.00 O ATOM 1138 CB ARG A 73 -10.046 -14.860 9.486 1.00 0.00 C ATOM 1139 CG ARG A 73 -9.160 -15.127 8.241 1.00 0.00 C ATOM 1140 CD ARG A 73 -9.843 -16.053 7.204 1.00 0.00 C ATOM 1141 NE ARG A 73 -8.868 -16.723 6.313 1.00 0.00 N ATOM 1142 CZ ARG A 73 -8.663 -16.447 5.015 1.00 0.00 C ATOM 1143 NH1 ARG A 73 -9.329 -15.480 4.412 1.00 0.00 N ATOM 1144 NH2 ARG A 73 -7.787 -17.160 4.325 1.00 0.00 N ATOM 0 H ARG A 73 -10.050 -12.369 9.257 1.00 0.00 H new ATOM 0 HA ARG A 73 -11.818 -14.410 8.329 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.444 -14.342 10.232 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.332 -15.819 9.917 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.913 -14.177 7.766 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.220 -15.578 8.560 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.431 -16.808 7.727 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.538 -15.468 6.602 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.299 -17.463 6.724 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.012 -14.929 4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.161 -15.283 3.425 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.272 -17.914 4.780 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.627 -16.955 3.339 1.00 0.00 H new ATOM 1158 N LEU A 74 -11.887 -13.717 11.606 1.00 0.00 N ATOM 1159 CA LEU A 74 -12.676 -13.794 12.857 1.00 0.00 C ATOM 1160 C LEU A 74 -12.856 -12.394 13.465 1.00 0.00 C ATOM 1161 O LEU A 74 -12.067 -11.493 13.182 1.00 0.00 O ATOM 1162 CB LEU A 74 -11.949 -14.727 13.854 1.00 0.00 C ATOM 1163 CG LEU A 74 -11.797 -16.218 13.406 1.00 0.00 C ATOM 1164 CD1 LEU A 74 -10.876 -17.000 14.357 1.00 0.00 C ATOM 1165 CD2 LEU A 74 -13.176 -16.901 13.286 1.00 0.00 C ATOM 0 H LEU A 74 -10.972 -13.283 11.730 1.00 0.00 H new ATOM 0 HA LEU A 74 -13.665 -14.196 12.639 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -10.955 -14.321 14.043 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -12.488 -14.705 14.801 1.00 0.00 H new ATOM 0 HG LEU A 74 -11.331 -16.220 12.421 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.793 -18.032 14.016 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -9.888 -16.540 14.366 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -11.294 -16.983 15.364 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -13.043 -17.937 12.973 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -13.680 -16.876 14.252 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -13.780 -16.374 12.548 1.00 0.00 H new ATOM 1177 N ALA A 75 -13.876 -12.231 14.328 1.00 0.00 N ATOM 1178 CA ALA A 75 -14.183 -10.941 14.970 1.00 0.00 C ATOM 1179 C ALA A 75 -14.777 -11.159 16.374 1.00 0.00 C ATOM 1180 O ALA A 75 -15.820 -11.808 16.513 1.00 0.00 O ATOM 1181 CB ALA A 75 -15.143 -10.113 14.088 1.00 0.00 C ATOM 0 H ALA A 75 -14.507 -12.986 14.598 1.00 0.00 H new ATOM 0 HA ALA A 75 -13.254 -10.382 15.081 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -15.359 -9.163 14.578 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -14.677 -9.925 13.121 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -16.071 -10.666 13.942 1.00 0.00 H new ATOM 1187 N GLY A 76 -14.077 -10.640 17.404 1.00 0.00 N ATOM 1188 CA GLY A 76 -14.581 -10.617 18.785 1.00 0.00 C ATOM 1189 C GLY A 76 -14.623 -11.986 19.454 1.00 0.00 C ATOM 1190 O GLY A 76 -15.449 -12.233 20.339 1.00 0.00 O ATOM 0 H GLY A 76 -13.150 -10.227 17.298 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.953 -9.953 19.379 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.585 -10.192 18.787 1.00 0.00 H new ATOM 1194 N VAL A 77 -13.707 -12.865 19.041 1.00 0.00 N ATOM 1195 CA VAL A 77 -13.582 -14.242 19.553 1.00 0.00 C ATOM 1196 C VAL A 77 -12.243 -14.402 20.301 1.00 0.00 C ATOM 1197 O VAL A 77 -11.264 -13.743 19.963 1.00 0.00 O ATOM 1198 CB VAL A 77 -13.673 -15.282 18.376 1.00 0.00 C ATOM 1199 CG1 VAL A 77 -15.040 -15.187 17.644 1.00 0.00 C ATOM 1200 CG2 VAL A 77 -12.499 -15.105 17.377 1.00 0.00 C ATOM 0 H VAL A 77 -13.015 -12.640 18.327 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.403 -14.433 20.244 1.00 0.00 H new ATOM 0 HB VAL A 77 -13.595 -16.278 18.813 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -15.072 -15.918 16.836 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.845 -15.391 18.350 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -15.163 -14.185 17.232 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.590 -15.838 16.575 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.528 -14.100 16.955 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -11.553 -15.252 17.898 1.00 0.00 H new ATOM 1210 N GLU A 78 -12.203 -15.287 21.304 1.00 0.00 N ATOM 1211 CA GLU A 78 -11.004 -15.481 22.148 1.00 0.00 C ATOM 1212 C GLU A 78 -9.879 -16.217 21.387 1.00 0.00 C ATOM 1213 O GLU A 78 -10.105 -16.780 20.304 1.00 0.00 O ATOM 1214 CB GLU A 78 -11.372 -16.236 23.453 1.00 0.00 C ATOM 1215 CG GLU A 78 -12.013 -17.617 23.241 1.00 0.00 C ATOM 1216 CD GLU A 78 -12.339 -18.330 24.565 1.00 0.00 C ATOM 1217 OE1 GLU A 78 -13.219 -17.839 25.315 1.00 0.00 O ATOM 1218 OE2 GLU A 78 -11.722 -19.377 24.869 1.00 0.00 O ATOM 0 H GLU A 78 -12.989 -15.886 21.557 1.00 0.00 H new ATOM 0 HA GLU A 78 -10.625 -14.494 22.412 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -10.470 -16.358 24.052 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.058 -15.618 24.032 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -12.928 -17.503 22.660 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.338 -18.240 22.654 1.00 0.00 H new ATOM 1225 N GLY A 79 -8.687 -16.241 22.018 1.00 0.00 N ATOM 1226 CA GLY A 79 -7.471 -16.842 21.457 1.00 0.00 C ATOM 1227 C GLY A 79 -7.573 -18.328 21.134 1.00 0.00 C ATOM 1228 O GLY A 79 -6.749 -18.850 20.374 1.00 0.00 O ATOM 0 H GLY A 79 -8.546 -15.837 22.944 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.207 -16.305 20.546 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.653 -16.695 22.162 1.00 0.00 H new ATOM 1232 N GLU A 80 -8.578 -19.016 21.720 1.00 0.00 N ATOM 1233 CA GLU A 80 -8.882 -20.417 21.381 1.00 0.00 C ATOM 1234 C GLU A 80 -9.353 -20.512 19.917 1.00 0.00 C ATOM 1235 O GLU A 80 -8.818 -21.304 19.140 1.00 0.00 O ATOM 1236 CB GLU A 80 -9.976 -21.014 22.308 1.00 0.00 C ATOM 1237 CG GLU A 80 -10.231 -22.519 22.071 1.00 0.00 C ATOM 1238 CD GLU A 80 -11.480 -23.068 22.780 1.00 0.00 C ATOM 1239 OE1 GLU A 80 -12.590 -22.944 22.221 1.00 0.00 O ATOM 1240 OE2 GLU A 80 -11.360 -23.631 23.886 1.00 0.00 O ATOM 0 H GLU A 80 -9.192 -18.619 22.431 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.967 -20.992 21.521 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -9.683 -20.863 23.347 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.907 -20.468 22.157 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.329 -22.695 21.000 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -9.360 -23.081 22.408 1.00 0.00 H new ATOM 1247 N GLU A 81 -10.342 -19.666 19.565 1.00 0.00 N ATOM 1248 CA GLU A 81 -10.922 -19.597 18.207 1.00 0.00 C ATOM 1249 C GLU A 81 -9.897 -19.092 17.188 1.00 0.00 C ATOM 1250 O GLU A 81 -9.865 -19.559 16.039 1.00 0.00 O ATOM 1251 CB GLU A 81 -12.172 -18.686 18.211 1.00 0.00 C ATOM 1252 CG GLU A 81 -13.384 -19.269 18.962 1.00 0.00 C ATOM 1253 CD GLU A 81 -13.913 -20.558 18.298 1.00 0.00 C ATOM 1254 OE1 GLU A 81 -14.634 -20.454 17.280 1.00 0.00 O ATOM 1255 OE2 GLU A 81 -13.600 -21.673 18.769 1.00 0.00 O ATOM 0 H GLU A 81 -10.764 -19.007 20.219 1.00 0.00 H new ATOM 0 HA GLU A 81 -11.215 -20.604 17.912 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -11.907 -17.729 18.661 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -12.462 -18.484 17.180 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -13.103 -19.482 19.993 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -14.181 -18.526 18.996 1.00 0.00 H new ATOM 1262 N ILE A 82 -9.060 -18.141 17.630 1.00 0.00 N ATOM 1263 CA ILE A 82 -7.963 -17.600 16.818 1.00 0.00 C ATOM 1264 C ILE A 82 -7.003 -18.734 16.409 1.00 0.00 C ATOM 1265 O ILE A 82 -6.804 -18.987 15.223 1.00 0.00 O ATOM 1266 CB ILE A 82 -7.192 -16.465 17.589 1.00 0.00 C ATOM 1267 CG1 ILE A 82 -8.156 -15.295 17.974 1.00 0.00 C ATOM 1268 CG2 ILE A 82 -5.984 -15.945 16.778 1.00 0.00 C ATOM 1269 CD1 ILE A 82 -8.854 -14.619 16.805 1.00 0.00 C ATOM 0 H ILE A 82 -9.126 -17.727 18.560 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.387 -17.156 15.917 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.803 -16.900 18.510 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -8.914 -15.680 18.656 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.588 -14.543 18.521 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.477 -15.163 17.342 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.291 -16.765 16.591 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.331 -15.540 15.828 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -9.499 -13.823 17.177 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -8.109 -14.197 16.131 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -9.456 -15.352 16.267 1.00 0.00 H new ATOM 1281 N ALA A 83 -6.488 -19.453 17.415 1.00 0.00 N ATOM 1282 CA ALA A 83 -5.566 -20.589 17.220 1.00 0.00 C ATOM 1283 C ALA A 83 -6.249 -21.760 16.486 1.00 0.00 C ATOM 1284 O ALA A 83 -5.582 -22.554 15.808 1.00 0.00 O ATOM 1285 CB ALA A 83 -5.025 -21.047 18.578 1.00 0.00 C ATOM 0 H ALA A 83 -6.698 -19.265 18.395 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.740 -20.255 16.593 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.344 -21.886 18.434 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.491 -20.224 19.053 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.854 -21.357 19.214 1.00 0.00 H new ATOM 1291 N ALA A 84 -7.589 -21.844 16.628 1.00 0.00 N ATOM 1292 CA ALA A 84 -8.412 -22.876 15.969 1.00 0.00 C ATOM 1293 C ALA A 84 -8.445 -22.671 14.449 1.00 0.00 C ATOM 1294 O ALA A 84 -8.544 -23.644 13.709 1.00 0.00 O ATOM 1295 CB ALA A 84 -9.842 -22.894 16.536 1.00 0.00 C ATOM 0 H ALA A 84 -8.129 -21.197 17.203 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.950 -23.841 16.175 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.424 -23.665 16.031 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.807 -23.108 17.604 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.309 -21.922 16.375 1.00 0.00 H new ATOM 1301 N LEU A 85 -8.410 -21.400 13.984 1.00 0.00 N ATOM 1302 CA LEU A 85 -8.287 -21.098 12.543 1.00 0.00 C ATOM 1303 C LEU A 85 -6.822 -21.166 12.085 1.00 0.00 C ATOM 1304 O LEU A 85 -6.536 -21.655 10.989 1.00 0.00 O ATOM 1305 CB LEU A 85 -8.853 -19.711 12.163 1.00 0.00 C ATOM 1306 CG LEU A 85 -8.827 -19.420 10.605 1.00 0.00 C ATOM 1307 CD1 LEU A 85 -10.230 -19.396 9.997 1.00 0.00 C ATOM 1308 CD2 LEU A 85 -7.992 -18.170 10.247 1.00 0.00 C ATOM 0 H LEU A 85 -8.465 -20.575 14.582 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.879 -21.860 12.036 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.880 -19.636 12.521 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.279 -18.940 12.678 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.311 -20.261 10.141 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.160 -19.193 8.928 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.710 -20.362 10.152 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.821 -18.616 10.477 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -8.009 -18.018 9.168 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.414 -17.296 10.743 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -6.963 -18.313 10.577 1.00 0.00 H new ATOM 1320 N LEU A 86 -5.905 -20.634 12.927 1.00 0.00 N ATOM 1321 CA LEU A 86 -4.453 -20.588 12.623 1.00 0.00 C ATOM 1322 C LEU A 86 -3.913 -21.991 12.322 1.00 0.00 C ATOM 1323 O LEU A 86 -3.019 -22.139 11.487 1.00 0.00 O ATOM 1324 CB LEU A 86 -3.642 -19.947 13.787 1.00 0.00 C ATOM 1325 CG LEU A 86 -3.894 -18.428 14.052 1.00 0.00 C ATOM 1326 CD1 LEU A 86 -3.102 -17.938 15.286 1.00 0.00 C ATOM 1327 CD2 LEU A 86 -3.582 -17.579 12.795 1.00 0.00 C ATOM 0 H LEU A 86 -6.147 -20.227 13.830 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.330 -19.963 11.738 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.865 -20.496 14.702 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.581 -20.087 13.582 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.953 -18.298 14.274 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.297 -16.878 15.446 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.414 -18.501 16.166 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.036 -18.089 15.118 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.767 -16.527 13.011 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.537 -17.714 12.515 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.222 -17.898 11.972 1.00 0.00 H new ATOM 1339 N GLU A 87 -4.507 -23.012 12.978 1.00 0.00 N ATOM 1340 CA GLU A 87 -4.115 -24.420 12.789 1.00 0.00 C ATOM 1341 C GLU A 87 -4.538 -24.913 11.392 1.00 0.00 C ATOM 1342 O GLU A 87 -3.838 -25.721 10.774 1.00 0.00 O ATOM 1343 CB GLU A 87 -4.700 -25.324 13.929 1.00 0.00 C ATOM 1344 CG GLU A 87 -6.184 -25.768 13.778 1.00 0.00 C ATOM 1345 CD GLU A 87 -6.355 -27.185 13.182 1.00 0.00 C ATOM 1346 OE1 GLU A 87 -6.152 -28.171 13.918 1.00 0.00 O ATOM 1347 OE2 GLU A 87 -6.690 -27.319 11.988 1.00 0.00 O ATOM 0 H GLU A 87 -5.265 -22.882 13.648 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.029 -24.490 12.850 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.083 -26.219 14.003 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.600 -24.788 14.873 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -6.664 -25.735 14.756 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -6.705 -25.052 13.143 1.00 0.00 H new ATOM 1354 N ARG A 88 -5.688 -24.401 10.903 1.00 0.00 N ATOM 1355 CA ARG A 88 -6.268 -24.813 9.618 1.00 0.00 C ATOM 1356 C ARG A 88 -5.452 -24.226 8.459 1.00 0.00 C ATOM 1357 O ARG A 88 -5.050 -24.931 7.540 1.00 0.00 O ATOM 1358 CB ARG A 88 -7.743 -24.341 9.525 1.00 0.00 C ATOM 1359 CG ARG A 88 -8.602 -24.746 10.735 1.00 0.00 C ATOM 1360 CD ARG A 88 -10.033 -24.191 10.678 1.00 0.00 C ATOM 1361 NE ARG A 88 -10.905 -24.933 9.750 1.00 0.00 N ATOM 1362 CZ ARG A 88 -12.245 -24.881 9.758 1.00 0.00 C ATOM 1363 NH1 ARG A 88 -12.883 -24.055 10.579 1.00 0.00 N ATOM 1364 NH2 ARG A 88 -12.941 -25.650 8.934 1.00 0.00 N ATOM 0 H ARG A 88 -6.235 -23.692 11.391 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.241 -25.901 9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.762 -23.256 9.425 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -8.190 -24.752 8.620 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -8.644 -25.834 10.794 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -8.120 -24.395 11.648 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -10.468 -24.220 11.677 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -9.998 -23.144 10.376 1.00 0.00 H new ATOM 0 HE ARG A 88 -10.458 -25.528 9.053 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -12.354 -23.454 11.210 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.902 -24.022 10.578 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -12.458 -26.281 8.294 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -13.960 -25.611 8.939 1.00 0.00 H new ATOM 1378 N GLU A 89 -5.177 -22.920 8.566 1.00 0.00 N ATOM 1379 CA GLU A 89 -4.515 -22.137 7.512 1.00 0.00 C ATOM 1380 C GLU A 89 -3.028 -22.500 7.401 1.00 0.00 C ATOM 1381 O GLU A 89 -2.470 -22.489 6.302 1.00 0.00 O ATOM 1382 CB GLU A 89 -4.713 -20.630 7.794 1.00 0.00 C ATOM 1383 CG GLU A 89 -6.186 -20.220 7.995 1.00 0.00 C ATOM 1384 CD GLU A 89 -7.098 -20.460 6.774 1.00 0.00 C ATOM 1385 OE1 GLU A 89 -7.631 -21.578 6.618 1.00 0.00 O ATOM 1386 OE2 GLU A 89 -7.294 -19.526 5.963 1.00 0.00 O ATOM 0 H GLU A 89 -5.409 -22.371 9.394 1.00 0.00 H new ATOM 0 HA GLU A 89 -4.969 -22.376 6.551 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.146 -20.360 8.685 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.297 -20.058 6.965 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.589 -20.771 8.845 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.222 -19.162 8.255 1.00 0.00 H new ATOM 1393 N ARG A 90 -2.399 -22.820 8.553 1.00 0.00 N ATOM 1394 CA ARG A 90 -0.985 -23.293 8.579 1.00 0.00 C ATOM 1395 C ARG A 90 -0.854 -24.712 8.009 1.00 0.00 C ATOM 1396 O ARG A 90 0.193 -25.069 7.459 1.00 0.00 O ATOM 1397 CB ARG A 90 -0.370 -23.228 10.007 1.00 0.00 C ATOM 1398 CG ARG A 90 -0.782 -24.360 10.974 1.00 0.00 C ATOM 1399 CD ARG A 90 -0.296 -24.116 12.407 1.00 0.00 C ATOM 1400 NE ARG A 90 -0.697 -25.208 13.322 1.00 0.00 N ATOM 1401 CZ ARG A 90 -0.924 -25.077 14.636 1.00 0.00 C ATOM 1402 NH1 ARG A 90 -0.794 -23.900 15.229 1.00 0.00 N ATOM 1403 NH2 ARG A 90 -1.294 -26.129 15.347 1.00 0.00 N ATOM 0 H ARG A 90 -2.837 -22.762 9.472 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.421 -22.611 7.942 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.716 -23.234 9.914 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.646 -22.274 10.457 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.868 -24.456 10.974 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.378 -25.306 10.613 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.790 -24.021 12.410 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.700 -23.171 12.771 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.810 -26.138 12.919 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.519 -23.082 14.685 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.969 -23.811 16.230 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -1.406 -27.036 14.895 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -1.468 -26.033 16.348 1.00 0.00 H new ATOM 1417 N ARG A 91 -1.929 -25.516 8.172 1.00 0.00 N ATOM 1418 CA ARG A 91 -2.007 -26.897 7.655 1.00 0.00 C ATOM 1419 C ARG A 91 -1.845 -26.889 6.125 1.00 0.00 C ATOM 1420 O ARG A 91 -1.026 -27.636 5.572 1.00 0.00 O ATOM 1421 CB ARG A 91 -3.360 -27.535 8.113 1.00 0.00 C ATOM 1422 CG ARG A 91 -3.665 -28.994 7.656 1.00 0.00 C ATOM 1423 CD ARG A 91 -4.337 -29.106 6.266 1.00 0.00 C ATOM 1424 NE ARG A 91 -4.732 -30.489 5.961 1.00 0.00 N ATOM 1425 CZ ARG A 91 -5.022 -30.976 4.744 1.00 0.00 C ATOM 1426 NH1 ARG A 91 -4.885 -30.233 3.654 1.00 0.00 N ATOM 1427 NH2 ARG A 91 -5.441 -32.215 4.628 1.00 0.00 N ATOM 0 H ARG A 91 -2.770 -25.221 8.669 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.198 -27.507 8.057 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.390 -27.512 9.202 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.169 -26.896 7.758 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -2.733 -29.559 7.641 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.311 -29.465 8.397 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.215 -28.461 6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.650 -28.747 5.500 1.00 0.00 H new ATOM 0 HE ARG A 91 -4.791 -31.138 6.746 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.554 -29.271 3.731 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -5.111 -30.623 2.739 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -5.544 -32.798 5.458 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -5.664 -32.594 3.708 1.00 0.00 H new ATOM 1441 N PHE A 92 -2.622 -26.011 5.462 1.00 0.00 N ATOM 1442 CA PHE A 92 -2.591 -25.842 4.002 1.00 0.00 C ATOM 1443 C PHE A 92 -1.296 -25.138 3.572 1.00 0.00 C ATOM 1444 O PHE A 92 -0.539 -25.662 2.747 1.00 0.00 O ATOM 1445 CB PHE A 92 -3.849 -25.067 3.526 1.00 0.00 C ATOM 1446 CG PHE A 92 -5.134 -25.875 3.691 1.00 0.00 C ATOM 1447 CD1 PHE A 92 -5.473 -26.860 2.766 1.00 0.00 C ATOM 1448 CD2 PHE A 92 -5.980 -25.676 4.776 1.00 0.00 C ATOM 1449 CE1 PHE A 92 -6.616 -27.613 2.925 1.00 0.00 C ATOM 1450 CE2 PHE A 92 -7.126 -26.428 4.933 1.00 0.00 C ATOM 1451 CZ PHE A 92 -7.443 -27.399 4.009 1.00 0.00 C ATOM 0 H PHE A 92 -3.290 -25.398 5.929 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.605 -26.824 3.529 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.934 -24.138 4.090 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -3.728 -24.794 2.478 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.832 -27.035 1.914 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.736 -24.920 5.508 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.865 -28.373 2.199 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -7.774 -26.255 5.780 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.337 -27.992 4.133 1.00 0.00 H new ATOM 1461 N ASP A 93 -1.025 -23.965 4.164 1.00 0.00 N ATOM 1462 CA ASP A 93 0.168 -23.159 3.846 1.00 0.00 C ATOM 1463 C ASP A 93 0.819 -22.656 5.138 1.00 0.00 C ATOM 1464 O ASP A 93 0.342 -21.695 5.751 1.00 0.00 O ATOM 1465 CB ASP A 93 -0.191 -21.961 2.922 1.00 0.00 C ATOM 1466 CG ASP A 93 -0.684 -22.402 1.533 1.00 0.00 C ATOM 1467 OD1 ASP A 93 0.155 -22.600 0.626 1.00 0.00 O ATOM 1468 OD2 ASP A 93 -1.908 -22.579 1.345 1.00 0.00 O ATOM 0 H ASP A 93 -1.624 -23.547 4.876 1.00 0.00 H new ATOM 0 HA ASP A 93 0.875 -23.794 3.312 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -0.962 -21.358 3.401 1.00 0.00 H new ATOM 0 HB3 ASP A 93 0.685 -21.324 2.805 1.00 0.00 H new ATOM 1473 N SER A 94 1.924 -23.318 5.535 1.00 0.00 N ATOM 1474 CA SER A 94 2.794 -22.877 6.642 1.00 0.00 C ATOM 1475 C SER A 94 3.598 -21.611 6.236 1.00 0.00 C ATOM 1476 O SER A 94 4.345 -21.049 7.040 1.00 0.00 O ATOM 1477 CB SER A 94 3.739 -24.023 7.079 1.00 0.00 C ATOM 1478 OG SER A 94 4.480 -23.676 8.243 1.00 0.00 O ATOM 0 H SER A 94 2.240 -24.181 5.092 1.00 0.00 H new ATOM 0 HA SER A 94 2.166 -22.615 7.493 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.155 -24.923 7.274 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.426 -24.259 6.266 1.00 0.00 H new ATOM 0 HG SER A 94 5.065 -24.421 8.493 1.00 0.00 H new ATOM 1484 N ASP A 95 3.413 -21.160 4.981 1.00 0.00 N ATOM 1485 CA ASP A 95 3.968 -19.895 4.471 1.00 0.00 C ATOM 1486 C ASP A 95 3.277 -18.661 5.091 1.00 0.00 C ATOM 1487 O ASP A 95 3.627 -17.528 4.740 1.00 0.00 O ATOM 1488 CB ASP A 95 3.832 -19.853 2.932 1.00 0.00 C ATOM 1489 CG ASP A 95 4.490 -21.063 2.258 1.00 0.00 C ATOM 1490 OD1 ASP A 95 5.730 -21.080 2.117 1.00 0.00 O ATOM 1491 OD2 ASP A 95 3.774 -22.018 1.901 1.00 0.00 O ATOM 0 H ASP A 95 2.868 -21.670 4.286 1.00 0.00 H new ATOM 0 HA ASP A 95 5.019 -19.857 4.757 1.00 0.00 H new ATOM 0 HB2 ASP A 95 2.776 -19.819 2.663 1.00 0.00 H new ATOM 0 HB3 ASP A 95 4.286 -18.937 2.554 1.00 0.00 H new ATOM 1496 N LEU A 96 2.299 -18.874 6.003 1.00 0.00 N ATOM 1497 CA LEU A 96 1.629 -17.778 6.703 1.00 0.00 C ATOM 1498 C LEU A 96 2.522 -17.211 7.822 1.00 0.00 C ATOM 1499 O LEU A 96 3.318 -17.938 8.447 1.00 0.00 O ATOM 1500 CB LEU A 96 0.241 -18.201 7.279 1.00 0.00 C ATOM 1501 CG LEU A 96 0.227 -18.941 8.655 1.00 0.00 C ATOM 1502 CD1 LEU A 96 -1.209 -19.124 9.187 1.00 0.00 C ATOM 1503 CD2 LEU A 96 0.962 -20.281 8.594 1.00 0.00 C ATOM 0 H LEU A 96 1.963 -19.801 6.264 1.00 0.00 H new ATOM 0 HA LEU A 96 1.451 -16.997 5.964 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.372 -17.304 7.373 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.246 -18.844 6.546 1.00 0.00 H new ATOM 0 HG LEU A 96 0.766 -18.305 9.357 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.179 -19.642 10.145 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.676 -18.148 9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.789 -19.711 8.475 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.927 -20.760 9.572 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.483 -20.926 7.857 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.001 -20.114 8.309 1.00 0.00 H new ATOM 1515 N TRP A 97 2.390 -15.902 8.041 1.00 0.00 N ATOM 1516 CA TRP A 97 3.003 -15.202 9.169 1.00 0.00 C ATOM 1517 C TRP A 97 1.909 -14.889 10.178 1.00 0.00 C ATOM 1518 O TRP A 97 0.920 -14.250 9.824 1.00 0.00 O ATOM 1519 CB TRP A 97 3.637 -13.875 8.691 1.00 0.00 C ATOM 1520 CG TRP A 97 4.794 -14.023 7.731 1.00 0.00 C ATOM 1521 CD1 TRP A 97 4.811 -14.678 6.530 1.00 0.00 C ATOM 1522 CD2 TRP A 97 6.081 -13.442 7.879 1.00 0.00 C ATOM 1523 NE1 TRP A 97 6.045 -14.577 5.964 1.00 0.00 N ATOM 1524 CE2 TRP A 97 6.841 -13.813 6.766 1.00 0.00 C ATOM 1525 CE3 TRP A 97 6.665 -12.655 8.872 1.00 0.00 C ATOM 1526 CZ2 TRP A 97 8.159 -13.423 6.613 1.00 0.00 C ATOM 1527 CZ3 TRP A 97 7.974 -12.257 8.724 1.00 0.00 C ATOM 1528 CH2 TRP A 97 8.706 -12.638 7.600 1.00 0.00 C ATOM 0 H TRP A 97 1.847 -15.291 7.431 1.00 0.00 H new ATOM 0 HA TRP A 97 3.779 -15.825 9.613 1.00 0.00 H new ATOM 0 HB2 TRP A 97 2.864 -13.273 8.213 1.00 0.00 H new ATOM 0 HB3 TRP A 97 3.979 -13.319 9.564 1.00 0.00 H new ATOM 0 HD1 TRP A 97 3.970 -15.198 6.095 1.00 0.00 H new ATOM 0 HE1 TRP A 97 6.329 -15.004 5.082 1.00 0.00 H new ATOM 0 HE3 TRP A 97 6.098 -12.363 9.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 8.736 -13.724 5.751 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 8.438 -11.645 9.484 1.00 0.00 H new ATOM 0 HH2 TRP A 97 9.730 -12.308 7.502 1.00 0.00 H new ATOM 1539 N VAL A 98 2.091 -15.301 11.433 1.00 0.00 N ATOM 1540 CA VAL A 98 1.141 -14.977 12.499 1.00 0.00 C ATOM 1541 C VAL A 98 1.707 -13.791 13.273 1.00 0.00 C ATOM 1542 O VAL A 98 2.777 -13.891 13.872 1.00 0.00 O ATOM 1543 CB VAL A 98 0.857 -16.195 13.442 1.00 0.00 C ATOM 1544 CG1 VAL A 98 -0.130 -15.805 14.573 1.00 0.00 C ATOM 1545 CG2 VAL A 98 0.328 -17.410 12.627 1.00 0.00 C ATOM 0 H VAL A 98 2.888 -15.860 11.737 1.00 0.00 H new ATOM 0 HA VAL A 98 0.176 -14.722 12.060 1.00 0.00 H new ATOM 0 HB VAL A 98 1.796 -16.488 13.911 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.310 -16.669 15.213 1.00 0.00 H new ATOM 0 HG12 VAL A 98 0.297 -14.997 15.166 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.072 -15.475 14.136 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.137 -18.245 13.301 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -0.597 -17.134 12.121 1.00 0.00 H new ATOM 0 HG23 VAL A 98 1.073 -17.704 11.887 1.00 0.00 H new ATOM 1555 N VAL A 99 1.002 -12.654 13.213 1.00 0.00 N ATOM 1556 CA VAL A 99 1.426 -11.402 13.864 1.00 0.00 C ATOM 1557 C VAL A 99 0.404 -11.049 14.936 1.00 0.00 C ATOM 1558 O VAL A 99 -0.766 -10.810 14.615 1.00 0.00 O ATOM 1559 CB VAL A 99 1.539 -10.199 12.840 1.00 0.00 C ATOM 1560 CG1 VAL A 99 2.346 -9.009 13.433 1.00 0.00 C ATOM 1561 CG2 VAL A 99 2.120 -10.669 11.486 1.00 0.00 C ATOM 0 H VAL A 99 0.118 -12.573 12.710 1.00 0.00 H new ATOM 0 HA VAL A 99 2.416 -11.560 14.292 1.00 0.00 H new ATOM 0 HB VAL A 99 0.529 -9.833 12.653 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.400 -8.205 12.699 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.850 -8.646 14.333 1.00 0.00 H new ATOM 0 HG13 VAL A 99 3.354 -9.341 13.682 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.185 -9.821 10.804 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.115 -11.087 11.642 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.470 -11.431 11.056 1.00 0.00 H new ATOM 1571 N GLU A 100 0.829 -11.021 16.199 1.00 0.00 N ATOM 1572 CA GLU A 100 -0.028 -10.582 17.295 1.00 0.00 C ATOM 1573 C GLU A 100 0.063 -9.052 17.408 1.00 0.00 C ATOM 1574 O GLU A 100 1.106 -8.502 17.759 1.00 0.00 O ATOM 1575 CB GLU A 100 0.341 -11.286 18.635 1.00 0.00 C ATOM 1576 CG GLU A 100 1.776 -11.033 19.166 1.00 0.00 C ATOM 1577 CD GLU A 100 2.018 -11.618 20.563 1.00 0.00 C ATOM 1578 OE1 GLU A 100 1.180 -11.384 21.461 1.00 0.00 O ATOM 1579 OE2 GLU A 100 3.039 -12.306 20.777 1.00 0.00 O ATOM 0 H GLU A 100 1.767 -11.299 16.487 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.059 -10.865 17.082 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.369 -10.965 19.398 1.00 0.00 H new ATOM 0 HB3 GLU A 100 0.207 -12.360 18.506 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.495 -11.464 18.470 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.962 -9.959 19.192 1.00 0.00 H new ATOM 1586 N ILE A 101 -1.011 -8.366 17.010 1.00 0.00 N ATOM 1587 CA ILE A 101 -1.171 -6.927 17.243 1.00 0.00 C ATOM 1588 C ILE A 101 -2.160 -6.730 18.402 1.00 0.00 C ATOM 1589 O ILE A 101 -2.916 -7.646 18.746 1.00 0.00 O ATOM 1590 CB ILE A 101 -1.625 -6.138 15.947 1.00 0.00 C ATOM 1591 CG1 ILE A 101 -3.043 -6.567 15.466 1.00 0.00 C ATOM 1592 CG2 ILE A 101 -0.591 -6.319 14.802 1.00 0.00 C ATOM 1593 CD1 ILE A 101 -3.622 -5.710 14.351 1.00 0.00 C ATOM 0 H ILE A 101 -1.795 -8.792 16.517 1.00 0.00 H new ATOM 0 HA ILE A 101 -0.200 -6.508 17.506 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.675 -5.083 16.217 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.999 -7.601 15.125 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.724 -6.541 16.317 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -0.923 -5.769 13.922 1.00 0.00 H new ATOM 0 HG22 ILE A 101 0.378 -5.938 15.124 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -0.502 -7.377 14.556 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -4.610 -6.083 14.081 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -3.704 -4.678 14.691 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -2.967 -5.755 13.481 1.00 0.00 H new ATOM 1605 N GLU A 102 -2.128 -5.551 19.020 1.00 0.00 N ATOM 1606 CA GLU A 102 -2.895 -5.255 20.237 1.00 0.00 C ATOM 1607 C GLU A 102 -3.360 -3.801 20.155 1.00 0.00 C ATOM 1608 O GLU A 102 -2.548 -2.876 20.271 1.00 0.00 O ATOM 1609 CB GLU A 102 -2.000 -5.554 21.484 1.00 0.00 C ATOM 1610 CG GLU A 102 -2.667 -5.408 22.880 1.00 0.00 C ATOM 1611 CD GLU A 102 -2.660 -3.970 23.429 1.00 0.00 C ATOM 1612 OE1 GLU A 102 -1.583 -3.504 23.858 1.00 0.00 O ATOM 1613 OE2 GLU A 102 -3.712 -3.297 23.429 1.00 0.00 O ATOM 0 H GLU A 102 -1.566 -4.766 18.691 1.00 0.00 H new ATOM 0 HA GLU A 102 -3.782 -5.882 20.332 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.622 -6.572 21.394 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.137 -4.889 21.449 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -3.698 -5.757 22.817 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.152 -6.059 23.587 1.00 0.00 H new ATOM 1620 N THR A 103 -4.669 -3.620 19.926 1.00 0.00 N ATOM 1621 CA THR A 103 -5.277 -2.303 19.644 1.00 0.00 C ATOM 1622 C THR A 103 -6.817 -2.403 19.670 1.00 0.00 C ATOM 1623 O THR A 103 -7.383 -3.503 19.632 1.00 0.00 O ATOM 1624 CB THR A 103 -4.782 -1.718 18.259 1.00 0.00 C ATOM 1625 OG1 THR A 103 -5.434 -0.465 17.955 1.00 0.00 O ATOM 1626 CG2 THR A 103 -5.004 -2.709 17.104 1.00 0.00 C ATOM 0 H THR A 103 -5.343 -4.385 19.930 1.00 0.00 H new ATOM 0 HA THR A 103 -4.956 -1.615 20.426 1.00 0.00 H new ATOM 0 HB THR A 103 -3.711 -1.545 18.361 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.975 -0.566 17.144 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.650 -2.267 16.172 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.452 -3.628 17.302 1.00 0.00 H new ATOM 0 HG23 THR A 103 -6.067 -2.935 17.018 1.00 0.00 H new ATOM 1634 N ASP A 104 -7.475 -1.237 19.762 1.00 0.00 N ATOM 1635 CA ASP A 104 -8.947 -1.116 19.746 1.00 0.00 C ATOM 1636 C ASP A 104 -9.466 -1.118 18.297 1.00 0.00 C ATOM 1637 O ASP A 104 -10.396 -1.855 17.955 1.00 0.00 O ATOM 1638 CB ASP A 104 -9.397 0.191 20.465 1.00 0.00 C ATOM 1639 CG ASP A 104 -9.117 0.201 21.980 1.00 0.00 C ATOM 1640 OD1 ASP A 104 -7.942 0.035 22.384 1.00 0.00 O ATOM 1641 OD2 ASP A 104 -10.068 0.375 22.780 1.00 0.00 O ATOM 0 H ASP A 104 -6.998 -0.340 19.851 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.366 -1.971 20.277 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -8.889 1.039 20.006 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -10.465 0.334 20.302 1.00 0.00 H new ATOM 1646 N GLU A 105 -8.832 -0.292 17.441 1.00 0.00 N ATOM 1647 CA GLU A 105 -9.262 -0.085 16.043 1.00 0.00 C ATOM 1648 C GLU A 105 -8.265 -0.741 15.075 1.00 0.00 C ATOM 1649 O GLU A 105 -7.072 -0.847 15.377 1.00 0.00 O ATOM 1650 CB GLU A 105 -9.406 1.434 15.745 1.00 0.00 C ATOM 1651 CG GLU A 105 -8.095 2.247 15.864 1.00 0.00 C ATOM 1652 CD GLU A 105 -8.274 3.746 15.560 1.00 0.00 C ATOM 1653 OE1 GLU A 105 -8.592 4.086 14.401 1.00 0.00 O ATOM 1654 OE2 GLU A 105 -8.071 4.593 16.460 1.00 0.00 O ATOM 0 H GLU A 105 -8.008 0.250 17.699 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.235 -0.556 15.900 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.802 1.556 14.737 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.142 1.856 16.430 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.696 2.134 16.872 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.355 1.831 15.180 1.00 0.00 H new ATOM 1661 N ILE A 106 -8.769 -1.166 13.907 1.00 0.00 N ATOM 1662 CA ILE A 106 -7.959 -1.853 12.881 1.00 0.00 C ATOM 1663 C ILE A 106 -7.781 -0.965 11.630 1.00 0.00 C ATOM 1664 O ILE A 106 -6.707 -0.968 11.013 1.00 0.00 O ATOM 1665 CB ILE A 106 -8.598 -3.242 12.487 1.00 0.00 C ATOM 1666 CG1 ILE A 106 -7.648 -4.046 11.537 1.00 0.00 C ATOM 1667 CG2 ILE A 106 -10.023 -3.093 11.883 1.00 0.00 C ATOM 1668 CD1 ILE A 106 -6.328 -4.443 12.169 1.00 0.00 C ATOM 0 H ILE A 106 -9.747 -1.045 13.644 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.975 -2.041 13.310 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.715 -3.813 13.408 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.164 -4.946 11.203 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.447 -3.446 10.649 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.416 -4.078 11.630 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.679 -2.617 12.612 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.975 -2.479 10.983 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.730 -4.996 11.445 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.788 -3.548 12.477 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.516 -5.071 13.040 1.00 0.00 H new ATOM 1680 N GLY A 107 -8.836 -0.187 11.290 1.00 0.00 N ATOM 1681 CA GLY A 107 -8.891 0.592 10.041 1.00 0.00 C ATOM 1682 C GLY A 107 -8.083 1.887 10.106 1.00 0.00 C ATOM 1683 O GLY A 107 -8.644 2.984 10.049 1.00 0.00 O ATOM 0 H GLY A 107 -9.666 -0.085 11.874 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.518 -0.021 9.221 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.930 0.830 9.814 1.00 0.00 H new ATOM 1687 N THR A 108 -6.760 1.723 10.215 1.00 0.00 N ATOM 1688 CA THR A 108 -5.785 2.809 10.358 1.00 0.00 C ATOM 1689 C THR A 108 -4.369 2.210 10.326 1.00 0.00 C ATOM 1690 O THR A 108 -3.443 2.798 9.767 1.00 0.00 O ATOM 1691 CB THR A 108 -5.994 3.631 11.687 1.00 0.00 C ATOM 1692 OG1 THR A 108 -5.102 4.753 11.731 1.00 0.00 O ATOM 1693 CG2 THR A 108 -5.799 2.783 12.958 1.00 0.00 C ATOM 0 H THR A 108 -6.325 0.801 10.206 1.00 0.00 H new ATOM 0 HA THR A 108 -5.926 3.504 9.530 1.00 0.00 H new ATOM 0 HB THR A 108 -7.029 3.971 11.672 1.00 0.00 H new ATOM 0 HG1 THR A 108 -5.246 5.253 12.561 1.00 0.00 H new ATOM 0 HG21 THR A 108 -5.956 3.406 13.839 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.516 1.962 12.961 1.00 0.00 H new ATOM 0 HG23 THR A 108 -4.786 2.380 12.975 1.00 0.00 H new ATOM 1701 N LEU A 109 -4.236 1.001 10.909 1.00 0.00 N ATOM 1702 CA LEU A 109 -2.942 0.315 11.082 1.00 0.00 C ATOM 1703 C LEU A 109 -2.873 -0.993 10.271 1.00 0.00 C ATOM 1704 O LEU A 109 -1.827 -1.633 10.222 1.00 0.00 O ATOM 1705 CB LEU A 109 -2.661 0.119 12.605 1.00 0.00 C ATOM 1706 CG LEU A 109 -3.855 -0.383 13.503 1.00 0.00 C ATOM 1707 CD1 LEU A 109 -4.048 -1.910 13.451 1.00 0.00 C ATOM 1708 CD2 LEU A 109 -3.705 0.105 14.961 1.00 0.00 C ATOM 0 H LEU A 109 -5.028 0.472 11.274 1.00 0.00 H new ATOM 0 HA LEU A 109 -2.144 0.938 10.676 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.840 -0.591 12.708 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.312 1.070 13.008 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.758 0.059 13.082 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.885 -2.193 14.090 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.255 -2.216 12.425 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -3.141 -2.403 13.801 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.544 -0.258 15.554 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.773 -0.277 15.378 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.691 1.195 14.980 1.00 0.00 H new ATOM 1720 N LEU A 110 -3.990 -1.356 9.624 1.00 0.00 N ATOM 1721 CA LEU A 110 -4.072 -2.468 8.656 1.00 0.00 C ATOM 1722 C LEU A 110 -5.274 -2.210 7.729 1.00 0.00 C ATOM 1723 O LEU A 110 -6.255 -1.572 8.142 1.00 0.00 O ATOM 1724 CB LEU A 110 -4.214 -3.840 9.383 1.00 0.00 C ATOM 1725 CG LEU A 110 -4.320 -5.117 8.477 1.00 0.00 C ATOM 1726 CD1 LEU A 110 -3.073 -5.291 7.588 1.00 0.00 C ATOM 1727 CD2 LEU A 110 -4.597 -6.390 9.316 1.00 0.00 C ATOM 0 H LEU A 110 -4.881 -0.878 9.759 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.153 -2.514 8.071 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.356 -3.964 10.044 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -5.101 -3.798 10.015 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.173 -4.969 7.815 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.185 -6.186 6.976 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -2.963 -4.420 6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.188 -5.390 8.217 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -4.664 -7.254 8.655 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -3.786 -6.540 10.028 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.537 -6.273 9.856 1.00 0.00 H new ATOM 1739 N THR A 111 -5.186 -2.695 6.478 1.00 0.00 N ATOM 1740 CA THR A 111 -6.240 -2.513 5.468 1.00 0.00 C ATOM 1741 C THR A 111 -6.964 -3.843 5.191 1.00 0.00 C ATOM 1742 O THR A 111 -6.322 -4.870 4.943 1.00 0.00 O ATOM 1743 CB THR A 111 -5.657 -1.948 4.137 1.00 0.00 C ATOM 1744 OG1 THR A 111 -4.905 -0.763 4.425 1.00 0.00 O ATOM 1745 CG2 THR A 111 -6.777 -1.619 3.130 1.00 0.00 C ATOM 0 H THR A 111 -4.382 -3.224 6.140 1.00 0.00 H new ATOM 0 HA THR A 111 -6.954 -1.793 5.868 1.00 0.00 H new ATOM 0 HB THR A 111 -5.014 -2.705 3.689 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.533 -0.402 3.594 1.00 0.00 H new ATOM 0 HG21 THR A 111 -6.338 -1.227 2.213 1.00 0.00 H new ATOM 0 HG22 THR A 111 -7.341 -2.524 2.905 1.00 0.00 H new ATOM 0 HG23 THR A 111 -7.445 -0.873 3.560 1.00 0.00 H new ATOM 1753 N LEU A 112 -8.310 -3.789 5.212 1.00 0.00 N ATOM 1754 CA LEU A 112 -9.199 -4.954 5.010 1.00 0.00 C ATOM 1755 C LEU A 112 -10.211 -4.649 3.903 1.00 0.00 C ATOM 1756 O LEU A 112 -10.423 -3.493 3.574 1.00 0.00 O ATOM 1757 CB LEU A 112 -9.943 -5.277 6.330 1.00 0.00 C ATOM 1758 CG LEU A 112 -9.022 -5.422 7.582 1.00 0.00 C ATOM 1759 CD1 LEU A 112 -9.821 -5.328 8.872 1.00 0.00 C ATOM 1760 CD2 LEU A 112 -8.193 -6.717 7.522 1.00 0.00 C ATOM 0 H LEU A 112 -8.820 -2.921 5.372 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.600 -5.816 4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.672 -4.490 6.522 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.502 -6.203 6.198 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.321 -4.587 7.573 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.150 -5.433 9.724 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.321 -4.361 8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.566 -6.123 8.897 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.563 -6.787 8.409 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.863 -7.576 7.484 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.566 -6.706 6.631 1.00 0.00 H new ATOM 1772 N VAL A 113 -10.830 -5.700 3.347 1.00 0.00 N ATOM 1773 CA VAL A 113 -11.946 -5.582 2.380 1.00 0.00 C ATOM 1774 C VAL A 113 -13.285 -5.938 3.058 1.00 0.00 C ATOM 1775 O VAL A 113 -14.343 -5.891 2.422 1.00 0.00 O ATOM 1776 CB VAL A 113 -11.737 -6.513 1.123 1.00 0.00 C ATOM 1777 CG1 VAL A 113 -10.514 -6.074 0.299 1.00 0.00 C ATOM 1778 CG2 VAL A 113 -11.618 -8.002 1.526 1.00 0.00 C ATOM 0 H VAL A 113 -10.573 -6.665 3.553 1.00 0.00 H new ATOM 0 HA VAL A 113 -11.966 -4.547 2.040 1.00 0.00 H new ATOM 0 HB VAL A 113 -12.624 -6.408 0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -10.397 -6.735 -0.560 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -10.657 -5.051 -0.048 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -9.620 -6.125 0.920 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -11.475 -8.610 0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -10.766 -8.131 2.193 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -12.529 -8.315 2.036 1.00 0.00 H new ATOM 1788 N ASP A 114 -13.226 -6.277 4.361 1.00 0.00 N ATOM 1789 CA ASP A 114 -14.357 -6.856 5.104 1.00 0.00 C ATOM 1790 C ASP A 114 -14.998 -5.797 6.015 1.00 0.00 C ATOM 1791 O ASP A 114 -16.211 -5.561 5.945 1.00 0.00 O ATOM 1792 CB ASP A 114 -13.860 -8.064 5.928 1.00 0.00 C ATOM 1793 CG ASP A 114 -15.005 -8.924 6.486 1.00 0.00 C ATOM 1794 OD1 ASP A 114 -15.469 -9.839 5.770 1.00 0.00 O ATOM 1795 OD2 ASP A 114 -15.455 -8.683 7.627 1.00 0.00 O ATOM 0 H ASP A 114 -12.387 -6.155 4.928 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.118 -7.195 4.401 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.219 -8.685 5.302 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -13.247 -7.705 6.755 1.00 0.00 H new ATOM 1800 N GLN A 115 -14.167 -5.178 6.887 1.00 0.00 N ATOM 1801 CA GLN A 115 -14.609 -4.077 7.775 1.00 0.00 C ATOM 1802 C GLN A 115 -14.959 -2.823 6.935 1.00 0.00 C ATOM 1803 O GLN A 115 -14.304 -2.587 5.912 1.00 0.00 O ATOM 1804 CB GLN A 115 -13.515 -3.734 8.836 1.00 0.00 C ATOM 1805 CG GLN A 115 -13.179 -4.865 9.827 1.00 0.00 C ATOM 1806 CD GLN A 115 -14.379 -5.409 10.601 1.00 0.00 C ATOM 1807 OE1 GLN A 115 -15.027 -6.365 10.174 1.00 0.00 O ATOM 1808 NE2 GLN A 115 -14.688 -4.804 11.739 1.00 0.00 N ATOM 0 H GLN A 115 -13.183 -5.424 6.994 1.00 0.00 H new ATOM 0 HA GLN A 115 -15.501 -4.407 8.308 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -12.602 -3.449 8.313 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -13.843 -2.863 9.403 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -12.715 -5.685 9.279 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -12.440 -4.499 10.539 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -14.130 -4.014 12.065 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -15.483 -5.128 12.289 1.00 0.00 H new ATOM 1817 N PRO A 116 -15.992 -2.008 7.357 1.00 0.00 N ATOM 1818 CA PRO A 116 -16.472 -0.824 6.585 1.00 0.00 C ATOM 1819 C PRO A 116 -15.344 0.195 6.272 1.00 0.00 C ATOM 1820 O PRO A 116 -14.900 0.945 7.152 1.00 0.00 O ATOM 1821 CB PRO A 116 -17.585 -0.207 7.497 1.00 0.00 C ATOM 1822 CG PRO A 116 -17.350 -0.802 8.858 1.00 0.00 C ATOM 1823 CD PRO A 116 -16.786 -2.183 8.610 1.00 0.00 C ATOM 0 HA PRO A 116 -16.842 -1.107 5.600 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -17.514 0.880 7.524 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -18.580 -0.453 7.126 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -16.655 -0.193 9.436 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -18.278 -0.855 9.428 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -16.162 -2.518 9.439 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -17.576 -2.924 8.486 1.00 0.00 H new ATOM 1831 N GLN A 117 -14.866 0.161 5.013 1.00 0.00 N ATOM 1832 CA GLN A 117 -13.808 1.060 4.519 1.00 0.00 C ATOM 1833 C GLN A 117 -14.378 2.468 4.273 1.00 0.00 C ATOM 1834 O GLN A 117 -15.384 2.604 3.560 1.00 0.00 O ATOM 1835 CB GLN A 117 -13.190 0.504 3.207 1.00 0.00 C ATOM 1836 CG GLN A 117 -12.423 -0.818 3.369 1.00 0.00 C ATOM 1837 CD GLN A 117 -11.897 -1.373 2.039 1.00 0.00 C ATOM 1838 OE1 GLN A 117 -10.787 -1.050 1.605 1.00 0.00 O ATOM 1839 NE2 GLN A 117 -12.674 -2.236 1.402 1.00 0.00 N ATOM 0 H GLN A 117 -15.205 -0.494 4.308 1.00 0.00 H new ATOM 0 HA GLN A 117 -13.027 1.120 5.277 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -13.988 0.359 2.479 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -12.514 1.253 2.794 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.585 -0.664 4.049 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -13.077 -1.557 3.831 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -13.586 -2.482 1.787 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -12.360 -2.655 0.526 1.00 0.00 H new ATOM 1848 N ALA A 118 -13.731 3.481 4.892 1.00 0.00 N ATOM 1849 CA ALA A 118 -14.049 4.911 4.714 1.00 0.00 C ATOM 1850 C ALA A 118 -15.532 5.215 5.071 1.00 0.00 C ATOM 1851 O ALA A 118 -15.870 5.180 6.273 1.00 0.00 O ATOM 1852 CB ALA A 118 -13.654 5.372 3.285 1.00 0.00 C ATOM 1853 OXT ALA A 118 -16.353 5.475 4.166 1.00 0.00 O ATOM 0 H ALA A 118 -12.960 3.322 5.540 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.455 5.497 5.415 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.893 6.429 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -12.584 5.223 3.137 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -14.207 4.789 2.549 1.00 0.00 H new TER 1859 ALA A 118