USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 754 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 30 CYS SG : rot 174:sc= -1.36 USER MOD Set 1.2: A 80 CYS SG : rot 112:sc= 0.254 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 39:sc= 0.186 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0473 K(o=-0.047,f=-10!) USER MOD Single : A 10 CYS SG : rot 180:sc= -0.172 USER MOD Single : A 12 THR OG1 : rot -150:sc= -1.16 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0.908 K(o=0.91,f=-5.4!) USER MOD Single : A 19 GLN : amide:sc= -0.501 K(o=-0.5,f=-3.9!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.0906 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0433 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 115:sc= 0.335 USER MOD Single : A 34 HIS : no HD1:sc= -0.772 X(o=-0.77,f=-0.59) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc=-0.00158 (180deg=-0.00158) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -161:sc= -0.0791 (180deg=-0.534) USER MOD Single : A 54 HIS : no HD1:sc= -3.29! C(o=-3.3!,f=-2.3!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -3.9! C(o=-3.9!,f=-4.7!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= -0.0943 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0.216 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -26:sc= 0.846 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.884 K(o=-0.88,f=-1.8!) USER MOD Single : A 86 GLN : amide:sc= -4.99! C(o=-5!,f=-6.1!) USER MOD Single : A 87 SER OG : rot 51:sc= 0.036 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 94 GLN : amide:sc=-0.00963 X(o=-0.0096,f=-0.29) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.948 25.452 -4.705 1.00 0.00 N ATOM 2 CA GLY A 1 -3.126 26.848 -5.060 1.00 0.00 C ATOM 3 C GLY A 1 -1.821 27.521 -5.436 1.00 0.00 C ATOM 4 O GLY A 1 -1.319 28.371 -4.700 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.869 25.037 -4.456 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.543 24.937 -5.513 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.304 25.380 -3.891 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.823 26.921 -5.895 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.576 27.379 -4.221 1.00 0.00 H new ATOM 8 N SER A 2 -1.269 27.140 -6.583 1.00 0.00 N ATOM 9 CA SER A 2 -0.011 27.709 -7.052 1.00 0.00 C ATOM 10 C SER A 2 0.068 29.197 -6.725 1.00 0.00 C ATOM 11 O SER A 2 -0.779 29.983 -7.150 1.00 0.00 O ATOM 12 CB SER A 2 0.138 27.499 -8.560 1.00 0.00 C ATOM 13 OG SER A 2 -1.006 27.965 -9.255 1.00 0.00 O ATOM 0 H SER A 2 -1.673 26.440 -7.205 1.00 0.00 H new ATOM 0 HA SER A 2 0.803 27.198 -6.539 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.024 28.024 -8.918 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.289 26.440 -8.770 1.00 0.00 H new ATOM 0 HG SER A 2 -1.322 28.796 -8.844 1.00 0.00 H new ATOM 19 N SER A 3 1.091 29.576 -5.965 1.00 0.00 N ATOM 20 CA SER A 3 1.279 30.969 -5.577 1.00 0.00 C ATOM 21 C SER A 3 2.670 31.185 -4.988 1.00 0.00 C ATOM 22 O SER A 3 3.229 30.298 -4.345 1.00 0.00 O ATOM 23 CB SER A 3 0.213 31.386 -4.562 1.00 0.00 C ATOM 24 OG SER A 3 0.535 32.631 -3.966 1.00 0.00 O ATOM 0 H SER A 3 1.802 28.938 -5.606 1.00 0.00 H new ATOM 0 HA SER A 3 1.181 31.586 -6.470 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.756 31.456 -5.056 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.123 30.622 -3.790 1.00 0.00 H new ATOM 0 HG SER A 3 -0.163 32.876 -3.323 1.00 0.00 H new ATOM 30 N GLY A 4 3.223 32.373 -5.213 1.00 0.00 N ATOM 31 CA GLY A 4 4.544 32.686 -4.699 1.00 0.00 C ATOM 32 C GLY A 4 5.537 31.565 -4.932 1.00 0.00 C ATOM 33 O GLY A 4 5.781 31.170 -6.071 1.00 0.00 O ATOM 0 H GLY A 4 2.780 33.124 -5.742 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.910 33.596 -5.175 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.476 32.891 -3.631 1.00 0.00 H new ATOM 37 N SER A 5 6.112 31.052 -3.849 1.00 0.00 N ATOM 38 CA SER A 5 7.089 29.973 -3.941 1.00 0.00 C ATOM 39 C SER A 5 6.882 28.956 -2.823 1.00 0.00 C ATOM 40 O SER A 5 6.233 29.245 -1.817 1.00 0.00 O ATOM 41 CB SER A 5 8.510 30.536 -3.875 1.00 0.00 C ATOM 42 OG SER A 5 8.846 30.921 -2.554 1.00 0.00 O ATOM 0 H SER A 5 5.918 31.366 -2.898 1.00 0.00 H new ATOM 0 HA SER A 5 6.948 29.470 -4.898 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.218 29.787 -4.230 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.595 31.395 -4.540 1.00 0.00 H new ATOM 0 HG SER A 5 9.759 31.276 -2.539 1.00 0.00 H new ATOM 48 N SER A 6 7.437 27.762 -3.007 1.00 0.00 N ATOM 49 CA SER A 6 7.310 26.699 -2.017 1.00 0.00 C ATOM 50 C SER A 6 8.472 25.716 -2.124 1.00 0.00 C ATOM 51 O SER A 6 8.924 25.388 -3.220 1.00 0.00 O ATOM 52 CB SER A 6 5.983 25.959 -2.200 1.00 0.00 C ATOM 53 OG SER A 6 5.907 24.831 -1.346 1.00 0.00 O ATOM 0 H SER A 6 7.979 27.507 -3.833 1.00 0.00 H new ATOM 0 HA SER A 6 7.331 27.154 -1.027 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.154 26.635 -1.990 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.880 25.641 -3.238 1.00 0.00 H new ATOM 0 HG SER A 6 5.049 24.376 -1.480 1.00 0.00 H new ATOM 59 N GLY A 7 8.951 25.250 -0.974 1.00 0.00 N ATOM 60 CA GLY A 7 10.057 24.309 -0.959 1.00 0.00 C ATOM 61 C GLY A 7 9.630 22.907 -1.346 1.00 0.00 C ATOM 62 O GLY A 7 8.580 22.718 -1.959 1.00 0.00 O ATOM 0 H GLY A 7 8.594 25.507 -0.054 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.831 24.652 -1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.500 24.289 0.037 1.00 0.00 H new ATOM 66 N ALA A 8 10.448 21.922 -0.991 1.00 0.00 N ATOM 67 CA ALA A 8 10.150 20.530 -1.304 1.00 0.00 C ATOM 68 C ALA A 8 8.943 20.036 -0.515 1.00 0.00 C ATOM 69 O ALA A 8 8.530 20.661 0.461 1.00 0.00 O ATOM 70 CB ALA A 8 11.362 19.655 -1.024 1.00 0.00 C ATOM 0 H ALA A 8 11.323 22.062 -0.486 1.00 0.00 H new ATOM 0 HA ALA A 8 9.907 20.466 -2.365 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.125 18.618 -1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 8 12.199 19.986 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 8 11.631 19.733 0.029 1.00 0.00 H new ATOM 76 N ASN A 9 8.382 18.910 -0.944 1.00 0.00 N ATOM 77 CA ASN A 9 7.221 18.333 -0.276 1.00 0.00 C ATOM 78 C ASN A 9 7.645 17.265 0.728 1.00 0.00 C ATOM 79 O ASN A 9 8.779 16.784 0.695 1.00 0.00 O ATOM 80 CB ASN A 9 6.263 17.729 -1.306 1.00 0.00 C ATOM 81 CG ASN A 9 4.823 17.736 -0.830 1.00 0.00 C ATOM 82 OD1 ASN A 9 4.546 17.991 0.342 1.00 0.00 O ATOM 83 ND2 ASN A 9 3.898 17.456 -1.740 1.00 0.00 N ATOM 0 H ASN A 9 8.712 18.380 -1.750 1.00 0.00 H new ATOM 0 HA ASN A 9 6.710 19.130 0.264 1.00 0.00 H new ATOM 0 HB2 ASN A 9 6.337 18.288 -2.239 1.00 0.00 H new ATOM 0 HB3 ASN A 9 6.566 16.705 -1.523 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.912 17.446 -1.479 1.00 0.00 H new ATOM 0 HD22 ASN A 9 4.173 17.251 -2.700 1.00 0.00 H new ATOM 90 N CYS A 10 6.729 16.900 1.617 1.00 0.00 N ATOM 91 CA CYS A 10 7.008 15.889 2.631 1.00 0.00 C ATOM 92 C CYS A 10 5.717 15.245 3.126 1.00 0.00 C ATOM 93 O CYS A 10 4.620 15.687 2.786 1.00 0.00 O ATOM 94 CB CYS A 10 7.765 16.510 3.805 1.00 0.00 C ATOM 95 SG CYS A 10 6.793 17.691 4.769 1.00 0.00 S ATOM 0 H CYS A 10 5.787 17.289 1.657 1.00 0.00 H new ATOM 0 HA CYS A 10 7.628 15.116 2.177 1.00 0.00 H new ATOM 0 HB2 CYS A 10 8.107 15.713 4.465 1.00 0.00 H new ATOM 0 HB3 CYS A 10 8.654 17.013 3.425 1.00 0.00 H new ATOM 0 HG CYS A 10 7.519 18.160 5.740 1.00 0.00 H new ATOM 101 N PHE A 11 5.856 14.196 3.930 1.00 0.00 N ATOM 102 CA PHE A 11 4.701 13.489 4.471 1.00 0.00 C ATOM 103 C PHE A 11 4.468 13.863 5.931 1.00 0.00 C ATOM 104 O PHE A 11 5.300 13.585 6.796 1.00 0.00 O ATOM 105 CB PHE A 11 4.898 11.976 4.345 1.00 0.00 C ATOM 106 CG PHE A 11 4.729 11.464 2.944 1.00 0.00 C ATOM 107 CD1 PHE A 11 5.717 11.665 1.994 1.00 0.00 C ATOM 108 CD2 PHE A 11 3.580 10.782 2.576 1.00 0.00 C ATOM 109 CE1 PHE A 11 5.564 11.194 0.703 1.00 0.00 C ATOM 110 CE2 PHE A 11 3.422 10.308 1.287 1.00 0.00 C ATOM 111 CZ PHE A 11 4.415 10.516 0.349 1.00 0.00 C ATOM 0 H PHE A 11 6.757 13.817 4.221 1.00 0.00 H new ATOM 0 HA PHE A 11 3.824 13.784 3.895 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.895 11.717 4.700 1.00 0.00 H new ATOM 0 HB3 PHE A 11 4.186 11.470 4.997 1.00 0.00 H new ATOM 0 HD1 PHE A 11 6.618 12.196 2.265 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.799 10.619 3.304 1.00 0.00 H new ATOM 0 HE1 PHE A 11 6.343 11.356 -0.028 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.523 9.776 1.013 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.292 10.149 -0.659 1.00 0.00 H new ATOM 121 N THR A 12 3.331 14.497 6.200 1.00 0.00 N ATOM 122 CA THR A 12 2.988 14.911 7.554 1.00 0.00 C ATOM 123 C THR A 12 2.594 13.715 8.412 1.00 0.00 C ATOM 124 O THR A 12 2.895 13.669 9.604 1.00 0.00 O ATOM 125 CB THR A 12 1.833 15.931 7.554 1.00 0.00 C ATOM 126 OG1 THR A 12 0.757 15.452 6.740 1.00 0.00 O ATOM 127 CG2 THR A 12 2.305 17.282 7.037 1.00 0.00 C ATOM 0 H THR A 12 2.632 14.735 5.497 1.00 0.00 H new ATOM 0 HA THR A 12 3.877 15.380 7.976 1.00 0.00 H new ATOM 0 HB THR A 12 1.485 16.054 8.580 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.276 16.213 6.353 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.473 17.986 7.046 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.104 17.657 7.676 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.676 17.172 6.018 1.00 0.00 H new ATOM 135 N GLU A 13 1.919 12.748 7.798 1.00 0.00 N ATOM 136 CA GLU A 13 1.484 11.551 8.508 1.00 0.00 C ATOM 137 C GLU A 13 1.865 10.292 7.735 1.00 0.00 C ATOM 138 O GLU A 13 1.181 9.902 6.789 1.00 0.00 O ATOM 139 CB GLU A 13 -0.029 11.586 8.733 1.00 0.00 C ATOM 140 CG GLU A 13 -0.434 12.236 10.045 1.00 0.00 C ATOM 141 CD GLU A 13 -1.857 11.901 10.448 1.00 0.00 C ATOM 142 OE1 GLU A 13 -2.755 11.991 9.586 1.00 0.00 O ATOM 143 OE2 GLU A 13 -2.071 11.548 11.627 1.00 0.00 O ATOM 0 H GLU A 13 1.662 12.770 6.811 1.00 0.00 H new ATOM 0 HA GLU A 13 1.987 11.530 9.475 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -0.498 12.125 7.910 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.415 10.567 8.707 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.248 11.913 10.832 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.330 13.318 9.957 1.00 0.00 H new ATOM 150 N GLU A 14 2.961 9.661 8.145 1.00 0.00 N ATOM 151 CA GLU A 14 3.434 8.447 7.490 1.00 0.00 C ATOM 152 C GLU A 14 2.355 7.368 7.501 1.00 0.00 C ATOM 153 O GLU A 14 1.487 7.350 8.375 1.00 0.00 O ATOM 154 CB GLU A 14 4.697 7.928 8.180 1.00 0.00 C ATOM 155 CG GLU A 14 5.950 8.709 7.823 1.00 0.00 C ATOM 156 CD GLU A 14 7.101 8.431 8.771 1.00 0.00 C ATOM 157 OE1 GLU A 14 6.836 8.159 9.961 1.00 0.00 O ATOM 158 OE2 GLU A 14 8.265 8.486 8.323 1.00 0.00 O ATOM 0 H GLU A 14 3.538 9.970 8.927 1.00 0.00 H new ATOM 0 HA GLU A 14 3.669 8.691 6.454 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.552 7.964 9.260 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.843 6.881 7.913 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.253 8.458 6.806 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.724 9.775 7.834 1.00 0.00 H new ATOM 165 N LEU A 15 2.415 6.470 6.525 1.00 0.00 N ATOM 166 CA LEU A 15 1.443 5.386 6.420 1.00 0.00 C ATOM 167 C LEU A 15 1.427 4.545 7.692 1.00 0.00 C ATOM 168 O LEU A 15 2.309 4.667 8.543 1.00 0.00 O ATOM 169 CB LEU A 15 1.764 4.502 5.214 1.00 0.00 C ATOM 170 CG LEU A 15 1.291 5.021 3.856 1.00 0.00 C ATOM 171 CD1 LEU A 15 2.109 4.402 2.733 1.00 0.00 C ATOM 172 CD2 LEU A 15 -0.190 4.731 3.661 1.00 0.00 C ATOM 0 H LEU A 15 3.126 6.470 5.794 1.00 0.00 H new ATOM 0 HA LEU A 15 0.456 5.828 6.286 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.844 4.360 5.170 1.00 0.00 H new ATOM 0 HB3 LEU A 15 1.320 3.520 5.380 1.00 0.00 H new ATOM 0 HG LEU A 15 1.436 6.101 3.831 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.758 4.783 1.774 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.160 4.660 2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.996 3.318 2.756 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.510 5.107 2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.359 3.655 3.707 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.764 5.222 4.447 1.00 0.00 H new ATOM 184 N THR A 16 0.418 3.689 7.816 1.00 0.00 N ATOM 185 CA THR A 16 0.286 2.826 8.984 1.00 0.00 C ATOM 186 C THR A 16 0.035 1.380 8.573 1.00 0.00 C ATOM 187 O THR A 16 -0.753 1.110 7.668 1.00 0.00 O ATOM 188 CB THR A 16 -0.859 3.294 9.902 1.00 0.00 C ATOM 189 OG1 THR A 16 -1.037 2.363 10.975 1.00 0.00 O ATOM 190 CG2 THR A 16 -2.157 3.430 9.121 1.00 0.00 C ATOM 0 H THR A 16 -0.320 3.574 7.122 1.00 0.00 H new ATOM 0 HA THR A 16 1.227 2.887 9.530 1.00 0.00 H new ATOM 0 HB THR A 16 -0.594 4.270 10.308 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.765 2.668 11.555 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.951 3.762 9.790 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.026 4.161 8.323 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.425 2.465 8.690 1.00 0.00 H new ATOM 198 N ASN A 17 0.709 0.453 9.246 1.00 0.00 N ATOM 199 CA ASN A 17 0.558 -0.967 8.951 1.00 0.00 C ATOM 200 C ASN A 17 -0.893 -1.407 9.119 1.00 0.00 C ATOM 201 O ASN A 17 -1.476 -1.264 10.195 1.00 0.00 O ATOM 202 CB ASN A 17 1.464 -1.798 9.862 1.00 0.00 C ATOM 203 CG ASN A 17 2.889 -1.282 9.886 1.00 0.00 C ATOM 204 OD1 ASN A 17 3.434 -0.882 8.857 1.00 0.00 O ATOM 205 ND2 ASN A 17 3.501 -1.290 11.065 1.00 0.00 N ATOM 0 H ASN A 17 1.365 0.660 9.999 1.00 0.00 H new ATOM 0 HA ASN A 17 0.850 -1.130 7.914 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.061 -1.791 10.875 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.461 -2.835 9.525 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.461 -0.956 11.143 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.010 -1.631 11.892 1.00 0.00 H new ATOM 212 N LEU A 18 -1.471 -1.942 8.050 1.00 0.00 N ATOM 213 CA LEU A 18 -2.855 -2.404 8.079 1.00 0.00 C ATOM 214 C LEU A 18 -2.922 -3.910 8.312 1.00 0.00 C ATOM 215 O LEU A 18 -2.237 -4.681 7.641 1.00 0.00 O ATOM 216 CB LEU A 18 -3.560 -2.047 6.769 1.00 0.00 C ATOM 217 CG LEU A 18 -3.611 -0.560 6.417 1.00 0.00 C ATOM 218 CD1 LEU A 18 -4.044 -0.368 4.972 1.00 0.00 C ATOM 219 CD2 LEU A 18 -4.551 0.178 7.360 1.00 0.00 C ATOM 0 H LEU A 18 -1.004 -2.067 7.152 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.362 -1.905 8.905 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.062 -2.575 5.956 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.582 -2.424 6.815 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.610 -0.144 6.533 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.075 0.697 4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.334 -0.864 4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.035 -0.799 4.829 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.576 1.235 7.096 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.554 -0.241 7.275 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.198 0.069 8.385 1.00 0.00 H new ATOM 231 N GLN A 19 -3.753 -4.319 9.265 1.00 0.00 N ATOM 232 CA GLN A 19 -3.910 -5.733 9.585 1.00 0.00 C ATOM 233 C GLN A 19 -5.330 -6.203 9.291 1.00 0.00 C ATOM 234 O GLN A 19 -6.291 -5.724 9.893 1.00 0.00 O ATOM 235 CB GLN A 19 -3.570 -5.986 11.055 1.00 0.00 C ATOM 236 CG GLN A 19 -2.095 -6.259 11.301 1.00 0.00 C ATOM 237 CD GLN A 19 -1.203 -5.140 10.801 1.00 0.00 C ATOM 238 OE1 GLN A 19 -0.606 -5.240 9.729 1.00 0.00 O ATOM 239 NE2 GLN A 19 -1.108 -4.067 11.577 1.00 0.00 N ATOM 0 H GLN A 19 -4.327 -3.692 9.829 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.222 -6.300 8.958 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.874 -5.120 11.644 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.153 -6.835 11.413 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.929 -6.401 12.369 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -1.815 -7.190 10.808 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -1.621 -4.028 12.458 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.522 -3.282 11.292 1.00 0.00 H new ATOM 248 N VAL A 20 -5.456 -7.144 8.360 1.00 0.00 N ATOM 249 CA VAL A 20 -6.759 -7.680 7.986 1.00 0.00 C ATOM 250 C VAL A 20 -6.631 -9.085 7.410 1.00 0.00 C ATOM 251 O VAL A 20 -5.525 -9.565 7.160 1.00 0.00 O ATOM 252 CB VAL A 20 -7.463 -6.777 6.956 1.00 0.00 C ATOM 253 CG1 VAL A 20 -8.958 -7.054 6.936 1.00 0.00 C ATOM 254 CG2 VAL A 20 -7.188 -5.311 7.258 1.00 0.00 C ATOM 0 H VAL A 20 -4.671 -7.551 7.851 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.358 -7.717 8.896 1.00 0.00 H new ATOM 0 HB VAL A 20 -7.063 -7.003 5.967 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -9.438 -6.407 6.202 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -9.131 -8.096 6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.378 -6.858 7.923 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.693 -4.687 6.521 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -7.559 -5.069 8.254 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.115 -5.126 7.216 1.00 0.00 H new ATOM 264 N GLU A 21 -7.769 -9.740 7.200 1.00 0.00 N ATOM 265 CA GLU A 21 -7.782 -11.091 6.652 1.00 0.00 C ATOM 266 C GLU A 21 -7.955 -11.062 5.136 1.00 0.00 C ATOM 267 O GLU A 21 -8.500 -10.109 4.582 1.00 0.00 O ATOM 268 CB GLU A 21 -8.906 -11.912 7.289 1.00 0.00 C ATOM 269 CG GLU A 21 -8.798 -12.023 8.800 1.00 0.00 C ATOM 270 CD GLU A 21 -10.088 -12.489 9.445 1.00 0.00 C ATOM 271 OE1 GLU A 21 -11.164 -12.261 8.852 1.00 0.00 O ATOM 272 OE2 GLU A 21 -10.024 -13.082 10.542 1.00 0.00 O ATOM 0 H GLU A 21 -8.693 -9.357 7.401 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.824 -11.558 6.882 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.864 -11.459 7.034 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.902 -12.913 6.858 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.998 -12.719 9.053 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.520 -11.053 9.213 1.00 0.00 H new ATOM 279 N GLU A 22 -7.485 -12.114 4.473 1.00 0.00 N ATOM 280 CA GLU A 22 -7.586 -12.208 3.021 1.00 0.00 C ATOM 281 C GLU A 22 -9.028 -12.014 2.562 1.00 0.00 C ATOM 282 O GLU A 22 -9.965 -12.130 3.353 1.00 0.00 O ATOM 283 CB GLU A 22 -7.064 -13.563 2.539 1.00 0.00 C ATOM 284 CG GLU A 22 -8.004 -14.719 2.837 1.00 0.00 C ATOM 285 CD GLU A 22 -7.369 -16.071 2.573 1.00 0.00 C ATOM 286 OE1 GLU A 22 -6.540 -16.508 3.400 1.00 0.00 O ATOM 287 OE2 GLU A 22 -7.699 -16.691 1.541 1.00 0.00 O ATOM 0 H GLU A 22 -7.031 -12.912 4.917 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.976 -11.416 2.588 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.891 -13.515 1.464 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.100 -13.759 3.009 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.319 -14.667 3.879 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -8.902 -14.618 2.228 1.00 0.00 H new ATOM 294 N LYS A 23 -9.199 -11.716 1.279 1.00 0.00 N ATOM 295 CA LYS A 23 -10.526 -11.506 0.712 1.00 0.00 C ATOM 296 C LYS A 23 -11.231 -10.340 1.397 1.00 0.00 C ATOM 297 O LYS A 23 -12.460 -10.281 1.436 1.00 0.00 O ATOM 298 CB LYS A 23 -11.368 -12.776 0.847 1.00 0.00 C ATOM 299 CG LYS A 23 -10.778 -13.977 0.128 1.00 0.00 C ATOM 300 CD LYS A 23 -11.290 -14.080 -1.298 1.00 0.00 C ATOM 301 CE LYS A 23 -10.364 -13.372 -2.275 1.00 0.00 C ATOM 302 NZ LYS A 23 -9.321 -14.288 -2.814 1.00 0.00 N ATOM 0 H LYS A 23 -8.435 -11.614 0.611 1.00 0.00 H new ATOM 0 HA LYS A 23 -10.409 -11.267 -0.345 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -11.481 -13.016 1.904 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -12.367 -12.583 0.455 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.691 -13.900 0.120 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -11.029 -14.887 0.672 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -11.382 -15.129 -1.578 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -12.287 -13.645 -1.360 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.949 -12.963 -3.099 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.885 -12.530 -1.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -8.710 -13.768 -3.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -8.746 -14.659 -2.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -9.777 -15.078 -3.313 1.00 0.00 H new ATOM 316 N GLY A 24 -10.446 -9.412 1.935 1.00 0.00 N ATOM 317 CA GLY A 24 -11.013 -8.260 2.610 1.00 0.00 C ATOM 318 C GLY A 24 -10.726 -6.961 1.882 1.00 0.00 C ATOM 319 O GLY A 24 -10.759 -6.909 0.652 1.00 0.00 O ATOM 0 H GLY A 24 -9.427 -9.438 1.915 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.091 -8.391 2.702 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.612 -8.202 3.622 1.00 0.00 H new ATOM 323 N THR A 25 -10.444 -5.908 2.643 1.00 0.00 N ATOM 324 CA THR A 25 -10.153 -4.603 2.063 1.00 0.00 C ATOM 325 C THR A 25 -9.151 -3.833 2.917 1.00 0.00 C ATOM 326 O THR A 25 -9.352 -3.657 4.118 1.00 0.00 O ATOM 327 CB THR A 25 -11.432 -3.759 1.907 1.00 0.00 C ATOM 328 OG1 THR A 25 -12.552 -4.612 1.645 1.00 0.00 O ATOM 329 CG2 THR A 25 -11.281 -2.751 0.777 1.00 0.00 C ATOM 0 H THR A 25 -10.411 -5.934 3.662 1.00 0.00 H new ATOM 0 HA THR A 25 -9.724 -4.784 1.078 1.00 0.00 H new ATOM 0 HB THR A 25 -11.598 -3.216 2.837 1.00 0.00 H new ATOM 0 HG1 THR A 25 -13.362 -4.068 1.549 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.197 -2.167 0.686 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.445 -2.085 0.993 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.093 -3.278 -0.158 1.00 0.00 H new ATOM 337 N ALA A 26 -8.073 -3.376 2.289 1.00 0.00 N ATOM 338 CA ALA A 26 -7.042 -2.623 2.991 1.00 0.00 C ATOM 339 C ALA A 26 -6.772 -1.289 2.303 1.00 0.00 C ATOM 340 O ALA A 26 -6.223 -1.246 1.202 1.00 0.00 O ATOM 341 CB ALA A 26 -5.761 -3.440 3.082 1.00 0.00 C ATOM 0 H ALA A 26 -7.891 -3.514 1.295 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.401 -2.416 3.999 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.999 -2.865 3.609 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.957 -4.365 3.624 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.408 -3.676 2.078 1.00 0.00 H new ATOM 347 N VAL A 27 -7.163 -0.200 2.959 1.00 0.00 N ATOM 348 CA VAL A 27 -6.963 1.136 2.411 1.00 0.00 C ATOM 349 C VAL A 27 -5.831 1.861 3.129 1.00 0.00 C ATOM 350 O VAL A 27 -5.976 2.275 4.280 1.00 0.00 O ATOM 351 CB VAL A 27 -8.246 1.982 2.512 1.00 0.00 C ATOM 352 CG1 VAL A 27 -8.955 1.721 3.832 1.00 0.00 C ATOM 353 CG2 VAL A 27 -7.923 3.460 2.353 1.00 0.00 C ATOM 0 H VAL A 27 -7.620 -0.218 3.871 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.701 1.011 1.360 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.917 1.692 1.704 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.859 2.327 3.885 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.221 0.666 3.900 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.294 1.982 4.658 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.841 4.043 2.427 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -7.233 3.768 3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.463 3.629 1.379 1.00 0.00 H new ATOM 363 N PHE A 28 -4.703 2.013 2.443 1.00 0.00 N ATOM 364 CA PHE A 28 -3.544 2.688 3.016 1.00 0.00 C ATOM 365 C PHE A 28 -3.765 4.197 3.068 1.00 0.00 C ATOM 366 O PHE A 28 -3.680 4.884 2.049 1.00 0.00 O ATOM 367 CB PHE A 28 -2.289 2.372 2.201 1.00 0.00 C ATOM 368 CG PHE A 28 -1.579 1.128 2.652 1.00 0.00 C ATOM 369 CD1 PHE A 28 -1.196 0.973 3.975 1.00 0.00 C ATOM 370 CD2 PHE A 28 -1.293 0.113 1.753 1.00 0.00 C ATOM 371 CE1 PHE A 28 -0.543 -0.171 4.393 1.00 0.00 C ATOM 372 CE2 PHE A 28 -0.640 -1.033 2.165 1.00 0.00 C ATOM 373 CZ PHE A 28 -0.264 -1.175 3.487 1.00 0.00 C ATOM 0 H PHE A 28 -4.567 1.678 1.489 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.408 2.323 4.034 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.565 2.263 1.152 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.602 3.216 2.264 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.410 1.756 4.688 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.584 0.219 0.718 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -0.251 -0.280 5.427 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.424 -1.817 1.454 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.247 -2.070 3.811 1.00 0.00 H new ATOM 383 N THR A 29 -4.051 4.707 4.262 1.00 0.00 N ATOM 384 CA THR A 29 -4.286 6.134 4.447 1.00 0.00 C ATOM 385 C THR A 29 -2.996 6.861 4.808 1.00 0.00 C ATOM 386 O THR A 29 -2.211 6.383 5.628 1.00 0.00 O ATOM 387 CB THR A 29 -5.333 6.392 5.547 1.00 0.00 C ATOM 388 OG1 THR A 29 -5.247 5.377 6.553 1.00 0.00 O ATOM 389 CG2 THR A 29 -6.737 6.416 4.963 1.00 0.00 C ATOM 0 H THR A 29 -4.125 4.153 5.115 1.00 0.00 H new ATOM 0 HA THR A 29 -4.663 6.518 3.499 1.00 0.00 H new ATOM 0 HB THR A 29 -5.126 7.364 5.994 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.915 5.549 7.249 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.459 6.600 5.759 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.808 7.209 4.219 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.952 5.456 4.493 1.00 0.00 H new ATOM 397 N CYS A 30 -2.782 8.018 4.191 1.00 0.00 N ATOM 398 CA CYS A 30 -1.586 8.812 4.448 1.00 0.00 C ATOM 399 C CYS A 30 -1.892 10.303 4.353 1.00 0.00 C ATOM 400 O CYS A 30 -3.029 10.700 4.097 1.00 0.00 O ATOM 401 CB CYS A 30 -0.481 8.442 3.457 1.00 0.00 C ATOM 402 SG CYS A 30 -1.037 8.322 1.741 1.00 0.00 S ATOM 0 H CYS A 30 -3.421 8.427 3.509 1.00 0.00 H new ATOM 0 HA CYS A 30 -1.245 8.593 5.460 1.00 0.00 H new ATOM 0 HB2 CYS A 30 0.312 9.187 3.519 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -0.046 7.488 3.754 1.00 0.00 H new ATOM 0 HG CYS A 30 -0.012 8.131 0.965 1.00 0.00 H new ATOM 408 N LYS A 31 -0.870 11.126 4.562 1.00 0.00 N ATOM 409 CA LYS A 31 -1.029 12.574 4.501 1.00 0.00 C ATOM 410 C LYS A 31 0.227 13.236 3.941 1.00 0.00 C ATOM 411 O LYS A 31 1.313 12.655 3.969 1.00 0.00 O ATOM 412 CB LYS A 31 -1.336 13.134 5.892 1.00 0.00 C ATOM 413 CG LYS A 31 -2.216 14.371 5.869 1.00 0.00 C ATOM 414 CD LYS A 31 -2.312 15.012 7.243 1.00 0.00 C ATOM 415 CE LYS A 31 -3.151 16.281 7.208 1.00 0.00 C ATOM 416 NZ LYS A 31 -3.072 17.033 8.492 1.00 0.00 N ATOM 0 H LYS A 31 0.078 10.815 4.775 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.863 12.795 3.835 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.825 12.362 6.486 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.398 13.375 6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.813 15.092 5.157 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.214 14.103 5.521 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.750 14.304 7.946 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.312 15.246 7.608 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.811 16.919 6.392 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.190 16.024 7.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -3.657 17.891 8.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.420 16.433 9.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.084 17.300 8.678 1.00 0.00 H new ATOM 430 N THR A 32 0.072 14.455 3.433 1.00 0.00 N ATOM 431 CA THR A 32 1.193 15.195 2.868 1.00 0.00 C ATOM 432 C THR A 32 1.094 16.680 3.198 1.00 0.00 C ATOM 433 O THR A 32 -0.001 17.213 3.378 1.00 0.00 O ATOM 434 CB THR A 32 1.264 15.024 1.339 1.00 0.00 C ATOM 435 OG1 THR A 32 0.012 15.388 0.746 1.00 0.00 O ATOM 436 CG2 THR A 32 1.608 13.589 0.970 1.00 0.00 C ATOM 0 H THR A 32 -0.819 14.950 3.402 1.00 0.00 H new ATOM 0 HA THR A 32 2.099 14.786 3.315 1.00 0.00 H new ATOM 0 HB THR A 32 2.049 15.678 0.959 1.00 0.00 H new ATOM 0 HG1 THR A 32 0.136 16.176 0.177 1.00 0.00 H new ATOM 0 HG21 THR A 32 1.652 13.493 -0.115 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.575 13.325 1.398 1.00 0.00 H new ATOM 0 HG23 THR A 32 0.843 12.919 1.363 1.00 0.00 H new ATOM 444 N GLU A 33 2.243 17.342 3.275 1.00 0.00 N ATOM 445 CA GLU A 33 2.284 18.767 3.584 1.00 0.00 C ATOM 446 C GLU A 33 1.652 19.585 2.462 1.00 0.00 C ATOM 447 O GLU A 33 0.870 20.503 2.712 1.00 0.00 O ATOM 448 CB GLU A 33 3.728 19.221 3.810 1.00 0.00 C ATOM 449 CG GLU A 33 3.866 20.717 4.041 1.00 0.00 C ATOM 450 CD GLU A 33 3.167 21.179 5.304 1.00 0.00 C ATOM 451 OE1 GLU A 33 3.733 20.988 6.400 1.00 0.00 O ATOM 452 OE2 GLU A 33 2.053 21.733 5.196 1.00 0.00 O ATOM 0 H GLU A 33 3.158 16.915 3.128 1.00 0.00 H new ATOM 0 HA GLU A 33 1.712 18.932 4.497 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.137 18.690 4.670 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.329 18.938 2.945 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.923 20.976 4.100 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.454 21.252 3.186 1.00 0.00 H new ATOM 459 N HIS A 34 1.996 19.246 1.223 1.00 0.00 N ATOM 460 CA HIS A 34 1.463 19.949 0.062 1.00 0.00 C ATOM 461 C HIS A 34 0.641 19.007 -0.813 1.00 0.00 C ATOM 462 O HIS A 34 0.892 17.803 -0.877 1.00 0.00 O ATOM 463 CB HIS A 34 2.600 20.562 -0.756 1.00 0.00 C ATOM 464 CG HIS A 34 3.502 21.450 0.044 1.00 0.00 C ATOM 465 ND1 HIS A 34 3.035 22.455 0.865 1.00 0.00 N ATOM 466 CD2 HIS A 34 4.851 21.479 0.148 1.00 0.00 C ATOM 467 CE1 HIS A 34 4.057 23.065 1.437 1.00 0.00 C ATOM 468 NE2 HIS A 34 5.171 22.491 1.020 1.00 0.00 N ATOM 0 H HIS A 34 2.641 18.489 0.998 1.00 0.00 H new ATOM 0 HA HIS A 34 0.811 20.747 0.419 1.00 0.00 H new ATOM 0 HB2 HIS A 34 3.192 19.760 -1.198 1.00 0.00 H new ATOM 0 HB3 HIS A 34 2.176 21.136 -1.580 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.547 20.828 -0.360 1.00 0.00 H new ATOM 0 HE1 HIS A 34 3.993 23.892 2.128 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.115 22.756 1.300 1.00 0.00 H new ATOM 477 N PRO A 35 -0.364 19.565 -1.504 1.00 0.00 N ATOM 478 CA PRO A 35 -1.242 18.793 -2.387 1.00 0.00 C ATOM 479 C PRO A 35 -0.522 18.306 -3.640 1.00 0.00 C ATOM 480 O PRO A 35 -0.547 18.966 -4.678 1.00 0.00 O ATOM 481 CB PRO A 35 -2.341 19.792 -2.757 1.00 0.00 C ATOM 482 CG PRO A 35 -1.704 21.130 -2.605 1.00 0.00 C ATOM 483 CD PRO A 35 -0.720 20.994 -1.476 1.00 0.00 C ATOM 0 HA PRO A 35 -1.613 17.890 -1.903 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.692 19.634 -3.777 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -3.206 19.689 -2.102 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -1.203 21.431 -3.525 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.449 21.894 -2.383 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.153 21.629 -1.626 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.162 21.279 -0.521 1.00 0.00 H new ATOM 491 N ALA A 36 0.120 17.147 -3.535 1.00 0.00 N ATOM 492 CA ALA A 36 0.845 16.570 -4.661 1.00 0.00 C ATOM 493 C ALA A 36 0.003 16.606 -5.932 1.00 0.00 C ATOM 494 O ALA A 36 -1.226 16.622 -5.874 1.00 0.00 O ATOM 495 CB ALA A 36 1.265 15.143 -4.343 1.00 0.00 C ATOM 0 H ALA A 36 0.153 16.589 -2.682 1.00 0.00 H new ATOM 0 HA ALA A 36 1.739 17.170 -4.832 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.805 14.725 -5.192 1.00 0.00 H new ATOM 0 HB2 ALA A 36 1.911 15.141 -3.465 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.380 14.539 -4.143 1.00 0.00 H new ATOM 501 N ALA A 37 0.674 16.618 -7.080 1.00 0.00 N ATOM 502 CA ALA A 37 -0.013 16.650 -8.365 1.00 0.00 C ATOM 503 C ALA A 37 -0.212 15.242 -8.916 1.00 0.00 C ATOM 504 O ALA A 37 -1.003 15.030 -9.836 1.00 0.00 O ATOM 505 CB ALA A 37 0.764 17.503 -9.357 1.00 0.00 C ATOM 0 H ALA A 37 1.692 16.606 -7.146 1.00 0.00 H new ATOM 0 HA ALA A 37 -0.997 17.094 -8.213 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.240 17.518 -10.313 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.850 18.520 -8.974 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.760 17.083 -9.496 1.00 0.00 H new ATOM 511 N THR A 38 0.512 14.282 -8.350 1.00 0.00 N ATOM 512 CA THR A 38 0.416 12.894 -8.786 1.00 0.00 C ATOM 513 C THR A 38 1.015 11.950 -7.750 1.00 0.00 C ATOM 514 O THR A 38 1.931 12.318 -7.015 1.00 0.00 O ATOM 515 CB THR A 38 1.131 12.679 -10.133 1.00 0.00 C ATOM 516 OG1 THR A 38 0.785 11.398 -10.672 1.00 0.00 O ATOM 517 CG2 THR A 38 2.640 12.774 -9.967 1.00 0.00 C ATOM 0 H THR A 38 1.172 14.440 -7.588 1.00 0.00 H new ATOM 0 HA THR A 38 -0.644 12.672 -8.906 1.00 0.00 H new ATOM 0 HB THR A 38 0.808 13.461 -10.819 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.242 11.269 -11.529 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.123 12.619 -10.932 1.00 0.00 H new ATOM 0 HG22 THR A 38 2.903 13.760 -9.584 1.00 0.00 H new ATOM 0 HG23 THR A 38 2.978 12.011 -9.265 1.00 0.00 H new ATOM 525 N VAL A 39 0.491 10.729 -7.696 1.00 0.00 N ATOM 526 CA VAL A 39 0.975 9.731 -6.750 1.00 0.00 C ATOM 527 C VAL A 39 1.127 8.369 -7.419 1.00 0.00 C ATOM 528 O VAL A 39 0.211 7.886 -8.085 1.00 0.00 O ATOM 529 CB VAL A 39 0.027 9.595 -5.543 1.00 0.00 C ATOM 530 CG1 VAL A 39 0.593 8.614 -4.528 1.00 0.00 C ATOM 531 CG2 VAL A 39 -0.220 10.953 -4.905 1.00 0.00 C ATOM 0 H VAL A 39 -0.268 10.408 -8.296 1.00 0.00 H new ATOM 0 HA VAL A 39 1.949 10.072 -6.400 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.928 9.206 -5.895 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.090 8.531 -3.683 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.713 7.636 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.562 8.971 -4.178 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.892 10.839 -4.054 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.727 11.373 -4.566 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.673 11.622 -5.637 1.00 0.00 H new ATOM 541 N THR A 40 2.291 7.753 -7.236 1.00 0.00 N ATOM 542 CA THR A 40 2.565 6.447 -7.822 1.00 0.00 C ATOM 543 C THR A 40 2.874 5.415 -6.744 1.00 0.00 C ATOM 544 O THR A 40 3.994 5.350 -6.236 1.00 0.00 O ATOM 545 CB THR A 40 3.745 6.510 -8.810 1.00 0.00 C ATOM 546 OG1 THR A 40 3.430 7.393 -9.893 1.00 0.00 O ATOM 547 CG2 THR A 40 4.070 5.127 -9.354 1.00 0.00 C ATOM 0 H THR A 40 3.059 8.138 -6.686 1.00 0.00 H new ATOM 0 HA THR A 40 1.666 6.148 -8.361 1.00 0.00 H new ATOM 0 HB THR A 40 4.618 6.887 -8.276 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.186 7.429 -10.516 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.906 5.197 -10.049 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.338 4.466 -8.530 1.00 0.00 H new ATOM 0 HG23 THR A 40 3.199 4.726 -9.873 1.00 0.00 H new ATOM 555 N TRP A 41 1.876 4.609 -6.399 1.00 0.00 N ATOM 556 CA TRP A 41 2.043 3.579 -5.380 1.00 0.00 C ATOM 557 C TRP A 41 2.883 2.421 -5.910 1.00 0.00 C ATOM 558 O TRP A 41 2.953 2.195 -7.118 1.00 0.00 O ATOM 559 CB TRP A 41 0.679 3.065 -4.917 1.00 0.00 C ATOM 560 CG TRP A 41 -0.178 4.129 -4.300 1.00 0.00 C ATOM 561 CD1 TRP A 41 -0.874 5.103 -4.956 1.00 0.00 C ATOM 562 CD2 TRP A 41 -0.427 4.326 -2.904 1.00 0.00 C ATOM 563 NE1 TRP A 41 -1.541 5.895 -4.052 1.00 0.00 N ATOM 564 CE2 TRP A 41 -1.283 5.438 -2.786 1.00 0.00 C ATOM 565 CE3 TRP A 41 -0.011 3.671 -1.741 1.00 0.00 C ATOM 566 CZ2 TRP A 41 -1.729 5.907 -1.553 1.00 0.00 C ATOM 567 CZ3 TRP A 41 -0.454 4.137 -0.519 1.00 0.00 C ATOM 568 CH2 TRP A 41 -1.306 5.246 -0.432 1.00 0.00 C ATOM 0 H TRP A 41 0.943 4.649 -6.810 1.00 0.00 H new ATOM 0 HA TRP A 41 2.563 4.023 -4.531 1.00 0.00 H new ATOM 0 HB2 TRP A 41 0.153 2.633 -5.769 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.827 2.263 -4.194 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.897 5.232 -6.028 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -2.132 6.693 -4.285 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.646 2.815 -1.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.385 6.762 -1.484 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.138 3.638 0.385 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -1.635 5.586 0.539 1.00 0.00 H new ATOM 579 N ARG A 42 3.518 1.691 -4.998 1.00 0.00 N ATOM 580 CA ARG A 42 4.353 0.557 -5.375 1.00 0.00 C ATOM 581 C ARG A 42 4.230 -0.571 -4.355 1.00 0.00 C ATOM 582 O ARG A 42 4.362 -0.352 -3.151 1.00 0.00 O ATOM 583 CB ARG A 42 5.815 0.992 -5.496 1.00 0.00 C ATOM 584 CG ARG A 42 6.766 -0.152 -5.810 1.00 0.00 C ATOM 585 CD ARG A 42 8.208 0.225 -5.509 1.00 0.00 C ATOM 586 NE ARG A 42 8.484 1.626 -5.816 1.00 0.00 N ATOM 587 CZ ARG A 42 9.665 2.203 -5.622 1.00 0.00 C ATOM 588 NH1 ARG A 42 10.674 1.502 -5.125 1.00 0.00 N ATOM 589 NH2 ARG A 42 9.837 3.483 -5.925 1.00 0.00 N ATOM 0 H ARG A 42 3.470 1.865 -3.994 1.00 0.00 H new ATOM 0 HA ARG A 42 4.009 0.189 -6.342 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.897 1.747 -6.278 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.123 1.464 -4.563 1.00 0.00 H new ATOM 0 HG2 ARG A 42 6.488 -1.029 -5.225 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.672 -0.427 -6.861 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.420 0.036 -4.457 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.877 -0.411 -6.088 1.00 0.00 H new ATOM 0 HE ARG A 42 7.728 2.193 -6.201 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.545 0.518 -4.891 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.580 1.947 -4.977 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.062 4.025 -6.307 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.744 3.925 -5.776 1.00 0.00 H new ATOM 603 N LYS A 43 3.974 -1.779 -4.846 1.00 0.00 N ATOM 604 CA LYS A 43 3.833 -2.944 -3.979 1.00 0.00 C ATOM 605 C LYS A 43 5.125 -3.755 -3.943 1.00 0.00 C ATOM 606 O LYS A 43 5.383 -4.568 -4.829 1.00 0.00 O ATOM 607 CB LYS A 43 2.678 -3.825 -4.459 1.00 0.00 C ATOM 608 CG LYS A 43 2.517 -5.105 -3.658 1.00 0.00 C ATOM 609 CD LYS A 43 1.364 -5.948 -4.179 1.00 0.00 C ATOM 610 CE LYS A 43 1.375 -7.343 -3.572 1.00 0.00 C ATOM 611 NZ LYS A 43 0.427 -8.257 -4.267 1.00 0.00 N ATOM 0 H LYS A 43 3.860 -1.977 -5.840 1.00 0.00 H new ATOM 0 HA LYS A 43 3.618 -2.592 -2.970 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.751 -3.254 -4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 43 2.837 -4.079 -5.507 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.440 -5.682 -3.703 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.345 -4.860 -2.610 1.00 0.00 H new ATOM 0 HD2 LYS A 43 0.419 -5.457 -3.947 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.427 -6.022 -5.265 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.383 -7.755 -3.626 1.00 0.00 H new ATOM 0 HE3 LYS A 43 1.112 -7.282 -2.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 0.464 -9.197 -3.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -0.538 -7.877 -4.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 0.693 -8.336 -5.269 1.00 0.00 H new ATOM 625 N GLY A 44 5.932 -3.528 -2.911 1.00 0.00 N ATOM 626 CA GLY A 44 7.186 -4.246 -2.779 1.00 0.00 C ATOM 627 C GLY A 44 8.205 -3.832 -3.821 1.00 0.00 C ATOM 628 O GLY A 44 8.965 -2.885 -3.615 1.00 0.00 O ATOM 0 H GLY A 44 5.740 -2.860 -2.164 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.597 -4.072 -1.785 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.999 -5.316 -2.864 1.00 0.00 H new ATOM 632 N LEU A 45 8.223 -4.542 -4.944 1.00 0.00 N ATOM 633 CA LEU A 45 9.158 -4.244 -6.023 1.00 0.00 C ATOM 634 C LEU A 45 8.422 -4.071 -7.348 1.00 0.00 C ATOM 635 O LEU A 45 9.016 -4.194 -8.421 1.00 0.00 O ATOM 636 CB LEU A 45 10.198 -5.359 -6.146 1.00 0.00 C ATOM 637 CG LEU A 45 11.039 -5.632 -4.899 1.00 0.00 C ATOM 638 CD1 LEU A 45 11.473 -7.089 -4.856 1.00 0.00 C ATOM 639 CD2 LEU A 45 12.251 -4.712 -4.861 1.00 0.00 C ATOM 0 H LEU A 45 7.601 -5.328 -5.131 1.00 0.00 H new ATOM 0 HA LEU A 45 9.664 -3.309 -5.784 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.684 -6.280 -6.422 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.871 -5.112 -6.967 1.00 0.00 H new ATOM 0 HG LEU A 45 10.426 -5.430 -4.020 1.00 0.00 H new ATOM 0 HD11 LEU A 45 12.071 -7.264 -3.961 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.592 -7.731 -4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.068 -7.318 -5.740 1.00 0.00 H new ATOM 0 HD21 LEU A 45 12.838 -4.920 -3.967 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.865 -4.882 -5.746 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.919 -3.674 -4.844 1.00 0.00 H new ATOM 651 N LEU A 46 7.128 -3.784 -7.267 1.00 0.00 N ATOM 652 CA LEU A 46 6.311 -3.591 -8.460 1.00 0.00 C ATOM 653 C LEU A 46 5.514 -2.293 -8.371 1.00 0.00 C ATOM 654 O LEU A 46 5.043 -1.916 -7.299 1.00 0.00 O ATOM 655 CB LEU A 46 5.360 -4.774 -8.648 1.00 0.00 C ATOM 656 CG LEU A 46 4.983 -5.110 -10.091 1.00 0.00 C ATOM 657 CD1 LEU A 46 6.045 -5.993 -10.729 1.00 0.00 C ATOM 658 CD2 LEU A 46 3.622 -5.788 -10.143 1.00 0.00 C ATOM 0 H LEU A 46 6.622 -3.680 -6.388 1.00 0.00 H new ATOM 0 HA LEU A 46 6.978 -3.528 -9.320 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.816 -5.656 -8.198 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.445 -4.570 -8.093 1.00 0.00 H new ATOM 0 HG LEU A 46 4.925 -4.180 -10.657 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.759 -6.222 -11.756 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.002 -5.471 -10.726 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.136 -6.920 -10.163 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.370 -6.020 -11.178 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.652 -6.710 -9.562 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.867 -5.121 -9.727 1.00 0.00 H new ATOM 670 N GLU A 47 5.367 -1.616 -9.506 1.00 0.00 N ATOM 671 CA GLU A 47 4.625 -0.361 -9.555 1.00 0.00 C ATOM 672 C GLU A 47 3.128 -0.619 -9.692 1.00 0.00 C ATOM 673 O GLU A 47 2.706 -1.534 -10.401 1.00 0.00 O ATOM 674 CB GLU A 47 5.115 0.501 -10.720 1.00 0.00 C ATOM 675 CG GLU A 47 4.596 1.928 -10.681 1.00 0.00 C ATOM 676 CD GLU A 47 5.273 2.823 -11.702 1.00 0.00 C ATOM 677 OE1 GLU A 47 6.414 2.511 -12.101 1.00 0.00 O ATOM 678 OE2 GLU A 47 4.660 3.835 -12.101 1.00 0.00 O ATOM 0 H GLU A 47 5.751 -1.915 -10.402 1.00 0.00 H new ATOM 0 HA GLU A 47 4.799 0.172 -8.620 1.00 0.00 H new ATOM 0 HB2 GLU A 47 6.205 0.519 -10.714 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.809 0.037 -11.658 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.521 1.925 -10.862 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.750 2.340 -9.684 1.00 0.00 H new ATOM 685 N LEU A 48 2.329 0.193 -9.009 1.00 0.00 N ATOM 686 CA LEU A 48 0.877 0.054 -9.053 1.00 0.00 C ATOM 687 C LEU A 48 0.257 1.101 -9.973 1.00 0.00 C ATOM 688 O LEU A 48 0.936 2.024 -10.425 1.00 0.00 O ATOM 689 CB LEU A 48 0.289 0.182 -7.646 1.00 0.00 C ATOM 690 CG LEU A 48 0.968 -0.650 -6.557 1.00 0.00 C ATOM 691 CD1 LEU A 48 0.365 -0.341 -5.196 1.00 0.00 C ATOM 692 CD2 LEU A 48 0.851 -2.135 -6.870 1.00 0.00 C ATOM 0 H LEU A 48 2.662 0.955 -8.418 1.00 0.00 H new ATOM 0 HA LEU A 48 0.644 -0.934 -9.449 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.328 1.231 -7.352 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.763 -0.099 -7.687 1.00 0.00 H new ATOM 0 HG LEU A 48 2.025 -0.387 -6.531 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.860 -0.942 -4.434 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.501 0.716 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.699 -0.575 -5.208 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.340 -2.712 -6.085 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.201 -2.414 -6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.331 -2.344 -7.826 1.00 0.00 H new ATOM 704 N ARG A 49 -1.035 0.953 -10.243 1.00 0.00 N ATOM 705 CA ARG A 49 -1.747 1.886 -11.108 1.00 0.00 C ATOM 706 C ARG A 49 -3.248 1.842 -10.837 1.00 0.00 C ATOM 707 O ARG A 49 -3.788 0.806 -10.450 1.00 0.00 O ATOM 708 CB ARG A 49 -1.473 1.563 -12.578 1.00 0.00 C ATOM 709 CG ARG A 49 -1.969 0.191 -13.003 1.00 0.00 C ATOM 710 CD ARG A 49 -1.115 -0.389 -14.119 1.00 0.00 C ATOM 711 NE ARG A 49 -1.779 -1.501 -14.794 1.00 0.00 N ATOM 712 CZ ARG A 49 -1.808 -2.740 -14.314 1.00 0.00 C ATOM 713 NH1 ARG A 49 -1.214 -3.022 -13.163 1.00 0.00 N ATOM 714 NH2 ARG A 49 -2.432 -3.699 -14.986 1.00 0.00 N ATOM 0 H ARG A 49 -1.611 0.196 -9.875 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.386 2.891 -10.891 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.947 2.321 -13.202 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.400 1.625 -12.761 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -1.957 -0.483 -12.146 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -3.004 0.264 -13.336 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.887 0.392 -14.845 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.164 -0.730 -13.709 1.00 0.00 H new ATOM 0 HE ARG A 49 -2.246 -1.317 -15.682 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -0.733 -2.287 -12.644 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -1.238 -3.974 -12.797 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -2.890 -3.486 -15.872 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -2.454 -4.650 -14.617 1.00 0.00 H new ATOM 728 N ALA A 50 -3.915 2.973 -11.044 1.00 0.00 N ATOM 729 CA ALA A 50 -5.353 3.062 -10.824 1.00 0.00 C ATOM 730 C ALA A 50 -6.093 1.965 -11.580 1.00 0.00 C ATOM 731 O ALA A 50 -6.254 2.037 -12.798 1.00 0.00 O ATOM 732 CB ALA A 50 -5.866 4.432 -11.242 1.00 0.00 C ATOM 0 H ALA A 50 -3.482 3.840 -11.364 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.542 2.924 -9.759 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.941 4.485 -11.072 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.367 5.202 -10.654 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.657 4.592 -12.300 1.00 0.00 H new ATOM 738 N SER A 51 -6.541 0.948 -10.850 1.00 0.00 N ATOM 739 CA SER A 51 -7.261 -0.167 -11.453 1.00 0.00 C ATOM 740 C SER A 51 -8.196 -0.822 -10.441 1.00 0.00 C ATOM 741 O SER A 51 -8.122 -0.549 -9.243 1.00 0.00 O ATOM 742 CB SER A 51 -6.275 -1.203 -11.997 1.00 0.00 C ATOM 743 OG SER A 51 -6.829 -1.906 -13.097 1.00 0.00 O ATOM 0 H SER A 51 -6.418 0.874 -9.840 1.00 0.00 H new ATOM 0 HA SER A 51 -7.860 0.223 -12.276 1.00 0.00 H new ATOM 0 HB2 SER A 51 -5.354 -0.707 -12.305 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.010 -1.907 -11.208 1.00 0.00 H new ATOM 0 HG SER A 51 -6.179 -2.561 -13.428 1.00 0.00 H new ATOM 749 N GLY A 52 -9.078 -1.688 -10.932 1.00 0.00 N ATOM 750 CA GLY A 52 -10.015 -2.368 -10.058 1.00 0.00 C ATOM 751 C GLY A 52 -9.377 -2.813 -8.757 1.00 0.00 C ATOM 752 O GLY A 52 -10.049 -2.917 -7.730 1.00 0.00 O ATOM 0 H GLY A 52 -9.160 -1.930 -11.919 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.851 -1.704 -9.840 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -10.424 -3.237 -10.574 1.00 0.00 H new ATOM 756 N LYS A 53 -8.076 -3.079 -8.798 1.00 0.00 N ATOM 757 CA LYS A 53 -7.346 -3.516 -7.615 1.00 0.00 C ATOM 758 C LYS A 53 -6.895 -2.320 -6.781 1.00 0.00 C ATOM 759 O LYS A 53 -7.391 -2.099 -5.676 1.00 0.00 O ATOM 760 CB LYS A 53 -6.132 -4.355 -8.020 1.00 0.00 C ATOM 761 CG LYS A 53 -5.435 -5.023 -6.847 1.00 0.00 C ATOM 762 CD LYS A 53 -6.287 -6.131 -6.250 1.00 0.00 C ATOM 763 CE LYS A 53 -5.528 -6.903 -5.181 1.00 0.00 C ATOM 764 NZ LYS A 53 -4.276 -7.507 -5.717 1.00 0.00 N ATOM 0 H LYS A 53 -7.505 -2.999 -9.639 1.00 0.00 H new ATOM 0 HA LYS A 53 -8.017 -4.127 -7.010 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.450 -5.121 -8.727 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.418 -3.717 -8.541 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.480 -5.434 -7.176 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.215 -4.279 -6.081 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.192 -5.703 -5.818 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.602 -6.814 -7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.284 -6.235 -4.355 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.167 -7.689 -4.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.959 -8.269 -5.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -4.456 -7.897 -6.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.537 -6.778 -5.778 1.00 0.00 H new ATOM 778 N HIS A 54 -5.953 -1.552 -7.318 1.00 0.00 N ATOM 779 CA HIS A 54 -5.437 -0.377 -6.625 1.00 0.00 C ATOM 780 C HIS A 54 -6.078 0.898 -7.164 1.00 0.00 C ATOM 781 O HIS A 54 -5.735 1.365 -8.249 1.00 0.00 O ATOM 782 CB HIS A 54 -3.917 -0.299 -6.772 1.00 0.00 C ATOM 783 CG HIS A 54 -3.228 -1.615 -6.580 1.00 0.00 C ATOM 784 ND1 HIS A 54 -2.727 -2.361 -7.626 1.00 0.00 N ATOM 785 CD2 HIS A 54 -2.956 -2.316 -5.455 1.00 0.00 C ATOM 786 CE1 HIS A 54 -2.178 -3.466 -7.152 1.00 0.00 C ATOM 787 NE2 HIS A 54 -2.304 -3.462 -5.837 1.00 0.00 N ATOM 0 H HIS A 54 -5.531 -1.722 -8.231 1.00 0.00 H new ATOM 0 HA HIS A 54 -5.688 -0.470 -5.568 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -3.675 0.087 -7.762 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.526 0.415 -6.047 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -3.205 -2.028 -4.445 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -1.707 -4.240 -7.740 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -1.971 -4.192 -5.208 1.00 0.00 H new ATOM 796 N GLN A 55 -7.011 1.454 -6.398 1.00 0.00 N ATOM 797 CA GLN A 55 -7.701 2.674 -6.800 1.00 0.00 C ATOM 798 C GLN A 55 -7.409 3.812 -5.827 1.00 0.00 C ATOM 799 O GLN A 55 -8.125 4.024 -4.849 1.00 0.00 O ATOM 800 CB GLN A 55 -9.209 2.430 -6.880 1.00 0.00 C ATOM 801 CG GLN A 55 -9.996 3.637 -7.364 1.00 0.00 C ATOM 802 CD GLN A 55 -9.953 3.795 -8.871 1.00 0.00 C ATOM 803 OE1 GLN A 55 -10.698 3.136 -9.598 1.00 0.00 O ATOM 804 NE2 GLN A 55 -9.078 4.672 -9.350 1.00 0.00 N ATOM 0 H GLN A 55 -7.306 1.079 -5.496 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.334 2.960 -7.785 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.398 1.591 -7.550 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -9.574 2.140 -5.895 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -11.033 3.543 -7.042 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.597 4.537 -6.896 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -8.480 5.197 -8.711 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -9.004 4.821 -10.356 1.00 0.00 H new ATOM 813 N PRO A 56 -6.330 4.561 -6.099 1.00 0.00 N ATOM 814 CA PRO A 56 -5.918 5.690 -5.259 1.00 0.00 C ATOM 815 C PRO A 56 -6.883 6.867 -5.356 1.00 0.00 C ATOM 816 O PRO A 56 -7.836 6.838 -6.135 1.00 0.00 O ATOM 817 CB PRO A 56 -4.549 6.072 -5.826 1.00 0.00 C ATOM 818 CG PRO A 56 -4.580 5.605 -7.240 1.00 0.00 C ATOM 819 CD PRO A 56 -5.430 4.365 -7.248 1.00 0.00 C ATOM 0 HA PRO A 56 -5.898 5.426 -4.202 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.383 7.148 -5.768 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.743 5.595 -5.269 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.999 6.369 -7.894 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.575 5.391 -7.603 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -5.985 4.264 -8.181 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -4.827 3.464 -7.137 1.00 0.00 H new ATOM 827 N SER A 57 -6.628 7.902 -4.562 1.00 0.00 N ATOM 828 CA SER A 57 -7.476 9.088 -4.556 1.00 0.00 C ATOM 829 C SER A 57 -6.721 10.293 -4.003 1.00 0.00 C ATOM 830 O SER A 57 -5.589 10.168 -3.536 1.00 0.00 O ATOM 831 CB SER A 57 -8.736 8.836 -3.725 1.00 0.00 C ATOM 832 OG SER A 57 -9.823 9.612 -4.199 1.00 0.00 O ATOM 0 H SER A 57 -5.841 7.943 -3.915 1.00 0.00 H new ATOM 0 HA SER A 57 -7.765 9.303 -5.585 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.996 7.778 -3.764 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.541 9.078 -2.680 1.00 0.00 H new ATOM 0 HG SER A 57 -10.616 9.432 -3.653 1.00 0.00 H new ATOM 838 N GLN A 58 -7.356 11.459 -4.061 1.00 0.00 N ATOM 839 CA GLN A 58 -6.745 12.687 -3.566 1.00 0.00 C ATOM 840 C GLN A 58 -7.803 13.643 -3.026 1.00 0.00 C ATOM 841 O GLN A 58 -8.696 14.071 -3.756 1.00 0.00 O ATOM 842 CB GLN A 58 -5.946 13.367 -4.680 1.00 0.00 C ATOM 843 CG GLN A 58 -5.465 14.763 -4.317 1.00 0.00 C ATOM 844 CD GLN A 58 -4.238 14.743 -3.426 1.00 0.00 C ATOM 845 OE1 GLN A 58 -4.346 14.636 -2.204 1.00 0.00 O ATOM 846 NE2 GLN A 58 -3.062 14.847 -4.035 1.00 0.00 N ATOM 0 H GLN A 58 -8.293 11.579 -4.446 1.00 0.00 H new ATOM 0 HA GLN A 58 -6.070 12.425 -2.751 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.084 12.748 -4.928 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -6.564 13.426 -5.576 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.238 15.314 -5.230 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -6.268 15.300 -3.812 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.019 14.934 -5.050 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.202 14.840 -3.487 1.00 0.00 H new ATOM 855 N GLU A 59 -7.696 13.972 -1.742 1.00 0.00 N ATOM 856 CA GLU A 59 -8.645 14.876 -1.105 1.00 0.00 C ATOM 857 C GLU A 59 -7.918 15.982 -0.345 1.00 0.00 C ATOM 858 O GLU A 59 -7.753 15.909 0.872 1.00 0.00 O ATOM 859 CB GLU A 59 -9.559 14.103 -0.151 1.00 0.00 C ATOM 860 CG GLU A 59 -10.738 13.439 -0.842 1.00 0.00 C ATOM 861 CD GLU A 59 -11.775 14.439 -1.316 1.00 0.00 C ATOM 862 OE1 GLU A 59 -12.573 14.907 -0.477 1.00 0.00 O ATOM 863 OE2 GLU A 59 -11.789 14.753 -2.524 1.00 0.00 O ATOM 0 H GLU A 59 -6.962 13.626 -1.124 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.251 15.334 -1.887 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.973 13.341 0.362 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.933 14.785 0.613 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.378 12.863 -1.694 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -11.206 12.733 -0.156 1.00 0.00 H new ATOM 870 N GLY A 60 -7.483 17.005 -1.073 1.00 0.00 N ATOM 871 CA GLY A 60 -6.777 18.111 -0.453 1.00 0.00 C ATOM 872 C GLY A 60 -5.376 17.732 -0.016 1.00 0.00 C ATOM 873 O GLY A 60 -4.442 17.743 -0.819 1.00 0.00 O ATOM 0 H GLY A 60 -7.607 17.088 -2.082 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -6.723 18.943 -1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.342 18.460 0.411 1.00 0.00 H new ATOM 877 N LEU A 61 -5.226 17.398 1.261 1.00 0.00 N ATOM 878 CA LEU A 61 -3.927 17.015 1.805 1.00 0.00 C ATOM 879 C LEU A 61 -3.974 15.605 2.384 1.00 0.00 C ATOM 880 O LEU A 61 -3.101 15.211 3.159 1.00 0.00 O ATOM 881 CB LEU A 61 -3.492 18.008 2.883 1.00 0.00 C ATOM 882 CG LEU A 61 -3.119 19.409 2.395 1.00 0.00 C ATOM 883 CD1 LEU A 61 -2.783 20.312 3.572 1.00 0.00 C ATOM 884 CD2 LEU A 61 -1.951 19.341 1.422 1.00 0.00 C ATOM 0 H LEU A 61 -5.988 17.385 1.939 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.201 17.029 0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.299 18.101 3.610 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.635 17.589 3.410 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.977 19.832 1.873 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.520 21.304 3.206 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.647 20.386 4.232 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.941 19.894 4.123 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.699 20.347 1.085 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.088 18.898 1.920 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.228 18.729 0.563 1.00 0.00 H new ATOM 896 N THR A 62 -4.997 14.847 2.002 1.00 0.00 N ATOM 897 CA THR A 62 -5.157 13.480 2.483 1.00 0.00 C ATOM 898 C THR A 62 -5.236 12.495 1.322 1.00 0.00 C ATOM 899 O THR A 62 -6.103 12.611 0.455 1.00 0.00 O ATOM 900 CB THR A 62 -6.419 13.335 3.353 1.00 0.00 C ATOM 901 OG1 THR A 62 -6.467 14.383 4.326 1.00 0.00 O ATOM 902 CG2 THR A 62 -6.442 11.984 4.053 1.00 0.00 C ATOM 0 H THR A 62 -5.727 15.157 1.361 1.00 0.00 H new ATOM 0 HA THR A 62 -4.280 13.253 3.089 1.00 0.00 H new ATOM 0 HB THR A 62 -7.291 13.404 2.703 1.00 0.00 H new ATOM 0 HG1 THR A 62 -7.274 14.284 4.874 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.343 11.905 4.662 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.436 11.188 3.308 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.563 11.890 4.691 1.00 0.00 H new ATOM 910 N LEU A 63 -4.328 11.526 1.312 1.00 0.00 N ATOM 911 CA LEU A 63 -4.296 10.519 0.257 1.00 0.00 C ATOM 912 C LEU A 63 -4.640 9.140 0.810 1.00 0.00 C ATOM 913 O LEU A 63 -4.475 8.880 2.002 1.00 0.00 O ATOM 914 CB LEU A 63 -2.916 10.487 -0.403 1.00 0.00 C ATOM 915 CG LEU A 63 -2.427 11.806 -1.002 1.00 0.00 C ATOM 916 CD1 LEU A 63 -0.917 11.787 -1.175 1.00 0.00 C ATOM 917 CD2 LEU A 63 -3.115 12.075 -2.333 1.00 0.00 C ATOM 0 H LEU A 63 -3.604 11.416 2.022 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.043 10.787 -0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.189 10.156 0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.931 9.736 -1.193 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.683 12.612 -0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.588 12.734 -1.603 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.441 11.642 -0.205 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.637 10.971 -1.842 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.755 13.018 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.891 11.266 -3.028 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.193 12.134 -2.180 1.00 0.00 H new ATOM 929 N ARG A 64 -5.116 8.259 -0.064 1.00 0.00 N ATOM 930 CA ARG A 64 -5.482 6.906 0.337 1.00 0.00 C ATOM 931 C ARG A 64 -5.608 5.994 -0.880 1.00 0.00 C ATOM 932 O ARG A 64 -5.986 6.437 -1.965 1.00 0.00 O ATOM 933 CB ARG A 64 -6.799 6.921 1.115 1.00 0.00 C ATOM 934 CG ARG A 64 -8.026 7.082 0.233 1.00 0.00 C ATOM 935 CD ARG A 64 -9.285 7.287 1.062 1.00 0.00 C ATOM 936 NE ARG A 64 -10.469 7.461 0.225 1.00 0.00 N ATOM 937 CZ ARG A 64 -11.712 7.322 0.672 1.00 0.00 C ATOM 938 NH1 ARG A 64 -11.932 7.009 1.942 1.00 0.00 N ATOM 939 NH2 ARG A 64 -12.738 7.497 -0.151 1.00 0.00 N ATOM 0 H ARG A 64 -5.257 8.458 -1.054 1.00 0.00 H new ATOM 0 HA ARG A 64 -4.692 6.518 0.980 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.888 5.993 1.680 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.774 7.735 1.840 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.886 7.932 -0.435 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.142 6.199 -0.395 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.429 6.430 1.720 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.160 8.162 1.700 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.334 7.703 -0.757 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -11.146 6.875 2.578 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -12.887 6.903 2.283 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -12.573 7.739 -1.128 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -13.692 7.390 0.193 1.00 0.00 H new ATOM 953 N LEU A 65 -5.289 4.718 -0.692 1.00 0.00 N ATOM 954 CA LEU A 65 -5.366 3.743 -1.774 1.00 0.00 C ATOM 955 C LEU A 65 -6.191 2.530 -1.356 1.00 0.00 C ATOM 956 O LEU A 65 -5.740 1.700 -0.566 1.00 0.00 O ATOM 957 CB LEU A 65 -3.962 3.300 -2.189 1.00 0.00 C ATOM 958 CG LEU A 65 -3.890 2.134 -3.175 1.00 0.00 C ATOM 959 CD1 LEU A 65 -4.342 2.575 -4.558 1.00 0.00 C ATOM 960 CD2 LEU A 65 -2.479 1.567 -3.228 1.00 0.00 C ATOM 0 H LEU A 65 -4.975 4.335 0.199 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.856 4.218 -2.624 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.449 4.155 -2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.409 3.025 -1.291 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.563 1.349 -2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.284 1.732 -5.246 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.371 2.932 -4.508 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.696 3.378 -4.913 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.446 0.738 -3.935 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.786 2.345 -3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.192 1.211 -2.238 1.00 0.00 H new ATOM 972 N THR A 66 -7.404 2.432 -1.892 1.00 0.00 N ATOM 973 CA THR A 66 -8.292 1.321 -1.576 1.00 0.00 C ATOM 974 C THR A 66 -7.875 0.056 -2.317 1.00 0.00 C ATOM 975 O THR A 66 -7.811 0.038 -3.547 1.00 0.00 O ATOM 976 CB THR A 66 -9.754 1.651 -1.931 1.00 0.00 C ATOM 977 OG1 THR A 66 -10.148 2.873 -1.296 1.00 0.00 O ATOM 978 CG2 THR A 66 -10.683 0.527 -1.498 1.00 0.00 C ATOM 0 H THR A 66 -7.793 3.110 -2.547 1.00 0.00 H new ATOM 0 HA THR A 66 -8.216 1.152 -0.502 1.00 0.00 H new ATOM 0 HB THR A 66 -9.826 1.764 -3.013 1.00 0.00 H new ATOM 0 HG1 THR A 66 -11.078 3.077 -1.528 1.00 0.00 H new ATOM 0 HG21 THR A 66 -11.710 0.783 -1.759 1.00 0.00 H new ATOM 0 HG22 THR A 66 -10.399 -0.395 -2.004 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.607 0.387 -0.420 1.00 0.00 H new ATOM 986 N ILE A 67 -7.592 -1.001 -1.562 1.00 0.00 N ATOM 987 CA ILE A 67 -7.183 -2.271 -2.149 1.00 0.00 C ATOM 988 C ILE A 67 -8.159 -3.384 -1.785 1.00 0.00 C ATOM 989 O ILE A 67 -8.321 -3.724 -0.613 1.00 0.00 O ATOM 990 CB ILE A 67 -5.768 -2.673 -1.690 1.00 0.00 C ATOM 991 CG1 ILE A 67 -4.820 -1.476 -1.781 1.00 0.00 C ATOM 992 CG2 ILE A 67 -5.249 -3.831 -2.529 1.00 0.00 C ATOM 993 CD1 ILE A 67 -3.591 -1.611 -0.909 1.00 0.00 C ATOM 0 H ILE A 67 -7.639 -1.003 -0.543 1.00 0.00 H new ATOM 0 HA ILE A 67 -7.180 -2.133 -3.230 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.817 -2.996 -0.650 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.508 -1.348 -2.817 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.360 -0.573 -1.497 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.249 -4.104 -2.193 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.915 -4.687 -2.419 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.211 -3.533 -3.577 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.964 -0.727 -1.024 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.894 -1.708 0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.028 -2.496 -1.208 1.00 0.00 H new ATOM 1005 N SER A 68 -8.806 -3.951 -2.798 1.00 0.00 N ATOM 1006 CA SER A 68 -9.768 -5.026 -2.585 1.00 0.00 C ATOM 1007 C SER A 68 -9.234 -6.348 -3.129 1.00 0.00 C ATOM 1008 O SER A 68 -8.275 -6.373 -3.899 1.00 0.00 O ATOM 1009 CB SER A 68 -11.100 -4.687 -3.256 1.00 0.00 C ATOM 1010 OG SER A 68 -11.907 -3.885 -2.410 1.00 0.00 O ATOM 0 H SER A 68 -8.682 -3.684 -3.775 1.00 0.00 H new ATOM 0 HA SER A 68 -9.926 -5.132 -1.512 1.00 0.00 H new ATOM 0 HB2 SER A 68 -10.916 -4.162 -4.193 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.630 -5.606 -3.505 1.00 0.00 H new ATOM 0 HG SER A 68 -12.752 -3.680 -2.862 1.00 0.00 H new ATOM 1016 N ALA A 69 -9.864 -7.445 -2.721 1.00 0.00 N ATOM 1017 CA ALA A 69 -9.455 -8.771 -3.168 1.00 0.00 C ATOM 1018 C ALA A 69 -8.069 -9.125 -2.640 1.00 0.00 C ATOM 1019 O ALA A 69 -7.231 -9.655 -3.372 1.00 0.00 O ATOM 1020 CB ALA A 69 -9.479 -8.847 -4.688 1.00 0.00 C ATOM 0 H ALA A 69 -10.659 -7.442 -2.082 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.163 -9.497 -2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.171 -9.843 -5.007 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.489 -8.647 -5.046 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.794 -8.106 -5.100 1.00 0.00 H new ATOM 1026 N LEU A 70 -7.832 -8.829 -1.367 1.00 0.00 N ATOM 1027 CA LEU A 70 -6.546 -9.115 -0.742 1.00 0.00 C ATOM 1028 C LEU A 70 -6.208 -10.599 -0.846 1.00 0.00 C ATOM 1029 O LEU A 70 -7.003 -11.392 -1.348 1.00 0.00 O ATOM 1030 CB LEU A 70 -6.564 -8.686 0.727 1.00 0.00 C ATOM 1031 CG LEU A 70 -6.708 -7.186 0.986 1.00 0.00 C ATOM 1032 CD1 LEU A 70 -7.149 -6.933 2.420 1.00 0.00 C ATOM 1033 CD2 LEU A 70 -5.399 -6.467 0.694 1.00 0.00 C ATOM 0 H LEU A 70 -8.514 -8.391 -0.747 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.779 -8.549 -1.270 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.385 -9.201 1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.642 -9.029 1.196 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.473 -6.792 0.317 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.246 -5.860 2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.110 -7.416 2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.407 -7.341 3.106 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.520 -5.400 0.884 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.614 -6.864 1.338 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.124 -6.621 -0.349 1.00 0.00 H new ATOM 1045 N GLU A 71 -5.024 -10.966 -0.366 1.00 0.00 N ATOM 1046 CA GLU A 71 -4.582 -12.355 -0.404 1.00 0.00 C ATOM 1047 C GLU A 71 -3.266 -12.528 0.347 1.00 0.00 C ATOM 1048 O GLU A 71 -2.596 -11.552 0.684 1.00 0.00 O ATOM 1049 CB GLU A 71 -4.421 -12.822 -1.852 1.00 0.00 C ATOM 1050 CG GLU A 71 -3.527 -11.921 -2.687 1.00 0.00 C ATOM 1051 CD GLU A 71 -3.591 -12.244 -4.167 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -4.669 -12.058 -4.769 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -2.562 -12.682 -4.723 1.00 0.00 O ATOM 0 H GLU A 71 -4.354 -10.321 0.053 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.342 -12.965 0.085 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.010 -13.831 -1.856 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.405 -12.877 -2.319 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.819 -10.882 -2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.497 -12.017 -2.342 1.00 0.00 H new ATOM 1060 N LYS A 72 -2.900 -13.779 0.608 1.00 0.00 N ATOM 1061 CA LYS A 72 -1.664 -14.083 1.319 1.00 0.00 C ATOM 1062 C LYS A 72 -0.475 -13.386 0.666 1.00 0.00 C ATOM 1063 O LYS A 72 0.509 -13.065 1.330 1.00 0.00 O ATOM 1064 CB LYS A 72 -1.428 -15.595 1.351 1.00 0.00 C ATOM 1065 CG LYS A 72 -2.313 -16.328 2.345 1.00 0.00 C ATOM 1066 CD LYS A 72 -1.865 -17.768 2.533 1.00 0.00 C ATOM 1067 CE LYS A 72 -2.684 -18.470 3.605 1.00 0.00 C ATOM 1068 NZ LYS A 72 -2.758 -19.939 3.373 1.00 0.00 N ATOM 0 H LYS A 72 -3.443 -14.599 0.337 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.762 -13.715 2.340 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.600 -16.002 0.355 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.384 -15.786 1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.291 -15.811 3.304 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.346 -16.310 1.997 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.960 -18.306 1.590 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.810 -17.789 2.807 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.242 -18.279 4.583 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.691 -18.054 3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -3.325 -20.381 4.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.202 -20.123 2.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.799 -20.340 3.381 1.00 0.00 H new ATOM 1082 N ALA A 73 -0.575 -13.154 -0.639 1.00 0.00 N ATOM 1083 CA ALA A 73 0.491 -12.492 -1.381 1.00 0.00 C ATOM 1084 C ALA A 73 0.540 -11.002 -1.059 1.00 0.00 C ATOM 1085 O ALA A 73 1.608 -10.449 -0.795 1.00 0.00 O ATOM 1086 CB ALA A 73 0.304 -12.705 -2.876 1.00 0.00 C ATOM 0 H ALA A 73 -1.383 -13.415 -1.204 1.00 0.00 H new ATOM 0 HA ALA A 73 1.440 -12.934 -1.078 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.107 -12.205 -3.418 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.326 -13.772 -3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.655 -12.290 -3.185 1.00 0.00 H new ATOM 1092 N ASP A 74 -0.622 -10.358 -1.083 1.00 0.00 N ATOM 1093 CA ASP A 74 -0.711 -8.931 -0.794 1.00 0.00 C ATOM 1094 C ASP A 74 0.246 -8.544 0.329 1.00 0.00 C ATOM 1095 O ASP A 74 0.900 -7.503 0.270 1.00 0.00 O ATOM 1096 CB ASP A 74 -2.144 -8.555 -0.412 1.00 0.00 C ATOM 1097 CG ASP A 74 -2.980 -8.166 -1.615 1.00 0.00 C ATOM 1098 OD1 ASP A 74 -2.912 -8.877 -2.640 1.00 0.00 O ATOM 1099 OD2 ASP A 74 -3.702 -7.150 -1.533 1.00 0.00 O ATOM 0 H ASP A 74 -1.515 -10.801 -1.299 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.428 -8.384 -1.693 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.614 -9.397 0.097 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.123 -7.726 0.296 1.00 0.00 H new ATOM 1104 N SER A 75 0.321 -9.388 1.353 1.00 0.00 N ATOM 1105 CA SER A 75 1.194 -9.132 2.493 1.00 0.00 C ATOM 1106 C SER A 75 2.585 -8.710 2.028 1.00 0.00 C ATOM 1107 O SER A 75 3.422 -9.550 1.697 1.00 0.00 O ATOM 1108 CB SER A 75 1.295 -10.377 3.376 1.00 0.00 C ATOM 1109 OG SER A 75 0.086 -10.603 4.079 1.00 0.00 O ATOM 0 H SER A 75 -0.212 -10.255 1.417 1.00 0.00 H new ATOM 0 HA SER A 75 0.761 -8.318 3.074 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.529 -11.245 2.760 1.00 0.00 H new ATOM 0 HB3 SER A 75 2.115 -10.259 4.085 1.00 0.00 H new ATOM 0 HG SER A 75 0.176 -11.405 4.635 1.00 0.00 H new ATOM 1115 N ASP A 76 2.824 -7.404 2.005 1.00 0.00 N ATOM 1116 CA ASP A 76 4.113 -6.869 1.582 1.00 0.00 C ATOM 1117 C ASP A 76 4.250 -5.403 1.980 1.00 0.00 C ATOM 1118 O ASP A 76 3.382 -4.847 2.655 1.00 0.00 O ATOM 1119 CB ASP A 76 4.278 -7.017 0.069 1.00 0.00 C ATOM 1120 CG ASP A 76 5.734 -7.064 -0.353 1.00 0.00 C ATOM 1121 OD1 ASP A 76 6.611 -6.946 0.528 1.00 0.00 O ATOM 1122 OD2 ASP A 76 5.995 -7.221 -1.564 1.00 0.00 O ATOM 0 H ASP A 76 2.142 -6.695 2.274 1.00 0.00 H new ATOM 0 HA ASP A 76 4.897 -7.437 2.083 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.778 -7.927 -0.261 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.785 -6.183 -0.431 1.00 0.00 H new ATOM 1127 N THR A 77 5.347 -4.781 1.560 1.00 0.00 N ATOM 1128 CA THR A 77 5.600 -3.380 1.874 1.00 0.00 C ATOM 1129 C THR A 77 5.229 -2.478 0.702 1.00 0.00 C ATOM 1130 O THR A 77 5.764 -2.622 -0.398 1.00 0.00 O ATOM 1131 CB THR A 77 7.077 -3.144 2.241 1.00 0.00 C ATOM 1132 OG1 THR A 77 7.491 -4.088 3.235 1.00 0.00 O ATOM 1133 CG2 THR A 77 7.287 -1.730 2.759 1.00 0.00 C ATOM 0 H THR A 77 6.075 -5.226 1.001 1.00 0.00 H new ATOM 0 HA THR A 77 4.976 -3.131 2.732 1.00 0.00 H new ATOM 0 HB THR A 77 7.678 -3.277 1.341 1.00 0.00 H new ATOM 0 HG1 THR A 77 8.432 -3.933 3.462 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.338 -1.587 3.012 1.00 0.00 H new ATOM 0 HG22 THR A 77 6.998 -1.014 1.990 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.676 -1.574 3.648 1.00 0.00 H new ATOM 1141 N TYR A 78 4.312 -1.549 0.945 1.00 0.00 N ATOM 1142 CA TYR A 78 3.868 -0.624 -0.092 1.00 0.00 C ATOM 1143 C TYR A 78 4.513 0.747 0.089 1.00 0.00 C ATOM 1144 O TYR A 78 4.625 1.252 1.207 1.00 0.00 O ATOM 1145 CB TYR A 78 2.345 -0.491 -0.068 1.00 0.00 C ATOM 1146 CG TYR A 78 1.619 -1.786 -0.353 1.00 0.00 C ATOM 1147 CD1 TYR A 78 1.662 -2.842 0.550 1.00 0.00 C ATOM 1148 CD2 TYR A 78 0.891 -1.955 -1.524 1.00 0.00 C ATOM 1149 CE1 TYR A 78 1.001 -4.028 0.294 1.00 0.00 C ATOM 1150 CE2 TYR A 78 0.226 -3.137 -1.788 1.00 0.00 C ATOM 1151 CZ TYR A 78 0.284 -4.170 -0.876 1.00 0.00 C ATOM 1152 OH TYR A 78 -0.376 -5.350 -1.136 1.00 0.00 O ATOM 0 H TYR A 78 3.861 -1.416 1.850 1.00 0.00 H new ATOM 0 HA TYR A 78 4.175 -1.025 -1.058 1.00 0.00 H new ATOM 0 HB2 TYR A 78 2.037 -0.119 0.909 1.00 0.00 H new ATOM 0 HB3 TYR A 78 2.042 0.255 -0.803 1.00 0.00 H new ATOM 0 HD1 TYR A 78 2.222 -2.734 1.467 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.844 -1.148 -2.241 1.00 0.00 H new ATOM 0 HE1 TYR A 78 1.045 -4.839 1.006 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.336 -3.251 -2.703 1.00 0.00 H new ATOM 0 HH TYR A 78 0.063 -6.083 -0.655 1.00 0.00 H new ATOM 1162 N THR A 79 4.935 1.347 -1.020 1.00 0.00 N ATOM 1163 CA THR A 79 5.569 2.659 -0.985 1.00 0.00 C ATOM 1164 C THR A 79 4.718 3.699 -1.704 1.00 0.00 C ATOM 1165 O THR A 79 4.357 3.523 -2.869 1.00 0.00 O ATOM 1166 CB THR A 79 6.968 2.624 -1.628 1.00 0.00 C ATOM 1167 OG1 THR A 79 7.818 1.727 -0.903 1.00 0.00 O ATOM 1168 CG2 THR A 79 7.588 4.012 -1.650 1.00 0.00 C ATOM 0 H THR A 79 4.849 0.945 -1.953 1.00 0.00 H new ATOM 0 HA THR A 79 5.667 2.935 0.065 1.00 0.00 H new ATOM 0 HB THR A 79 6.863 2.274 -2.655 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.705 1.709 -1.319 1.00 0.00 H new ATOM 0 HG21 THR A 79 8.576 3.962 -2.109 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.954 4.685 -2.227 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.680 4.386 -0.630 1.00 0.00 H new ATOM 1176 N CYS A 80 4.400 4.783 -1.005 1.00 0.00 N ATOM 1177 CA CYS A 80 3.591 5.853 -1.577 1.00 0.00 C ATOM 1178 C CYS A 80 4.466 7.025 -2.009 1.00 0.00 C ATOM 1179 O CYS A 80 4.844 7.865 -1.192 1.00 0.00 O ATOM 1180 CB CYS A 80 2.546 6.326 -0.566 1.00 0.00 C ATOM 1181 SG CYS A 80 1.566 7.739 -1.125 1.00 0.00 S ATOM 0 H CYS A 80 4.690 4.944 -0.041 1.00 0.00 H new ATOM 0 HA CYS A 80 3.082 5.460 -2.457 1.00 0.00 H new ATOM 0 HB2 CYS A 80 1.874 5.498 -0.340 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.049 6.591 0.364 1.00 0.00 H new ATOM 0 HG CYS A 80 0.339 7.362 -1.331 1.00 0.00 H new ATOM 1187 N ASP A 81 4.785 7.075 -3.297 1.00 0.00 N ATOM 1188 CA ASP A 81 5.617 8.144 -3.838 1.00 0.00 C ATOM 1189 C ASP A 81 4.756 9.262 -4.417 1.00 0.00 C ATOM 1190 O ASP A 81 3.790 9.006 -5.136 1.00 0.00 O ATOM 1191 CB ASP A 81 6.553 7.595 -4.916 1.00 0.00 C ATOM 1192 CG ASP A 81 7.280 8.694 -5.666 1.00 0.00 C ATOM 1193 OD1 ASP A 81 8.083 9.412 -5.034 1.00 0.00 O ATOM 1194 OD2 ASP A 81 7.047 8.835 -6.884 1.00 0.00 O ATOM 0 H ASP A 81 4.480 6.388 -3.987 1.00 0.00 H new ATOM 0 HA ASP A 81 6.214 8.554 -3.023 1.00 0.00 H new ATOM 0 HB2 ASP A 81 7.283 6.930 -4.455 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.978 6.996 -5.622 1.00 0.00 H new ATOM 1199 N ILE A 82 5.111 10.502 -4.096 1.00 0.00 N ATOM 1200 CA ILE A 82 4.371 11.658 -4.584 1.00 0.00 C ATOM 1201 C ILE A 82 5.190 12.447 -5.600 1.00 0.00 C ATOM 1202 O ILE A 82 4.640 13.167 -6.432 1.00 0.00 O ATOM 1203 CB ILE A 82 3.965 12.595 -3.430 1.00 0.00 C ATOM 1204 CG1 ILE A 82 5.189 12.964 -2.590 1.00 0.00 C ATOM 1205 CG2 ILE A 82 2.900 11.938 -2.565 1.00 0.00 C ATOM 1206 CD1 ILE A 82 4.887 13.947 -1.481 1.00 0.00 C ATOM 0 H ILE A 82 5.907 10.731 -3.500 1.00 0.00 H new ATOM 0 HA ILE A 82 3.471 11.276 -5.065 1.00 0.00 H new ATOM 0 HB ILE A 82 3.549 13.510 -3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.608 12.056 -2.156 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.953 13.388 -3.242 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.623 12.612 -1.754 1.00 0.00 H new ATOM 0 HG22 ILE A 82 2.021 11.721 -3.172 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.291 11.010 -2.148 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.801 14.163 -0.927 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.496 14.870 -1.909 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.146 13.518 -0.806 1.00 0.00 H new ATOM 1218 N GLY A 83 6.510 12.305 -5.526 1.00 0.00 N ATOM 1219 CA GLY A 83 7.385 13.009 -6.446 1.00 0.00 C ATOM 1220 C GLY A 83 8.622 13.557 -5.764 1.00 0.00 C ATOM 1221 O GLY A 83 9.662 13.731 -6.399 1.00 0.00 O ATOM 0 H GLY A 83 6.989 11.715 -4.846 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.685 12.333 -7.247 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.836 13.829 -6.909 1.00 0.00 H new ATOM 1225 N GLN A 84 8.510 13.832 -4.468 1.00 0.00 N ATOM 1226 CA GLN A 84 9.628 14.367 -3.701 1.00 0.00 C ATOM 1227 C GLN A 84 9.952 13.468 -2.512 1.00 0.00 C ATOM 1228 O GLN A 84 11.093 13.413 -2.055 1.00 0.00 O ATOM 1229 CB GLN A 84 9.311 15.782 -3.215 1.00 0.00 C ATOM 1230 CG GLN A 84 10.540 16.662 -3.060 1.00 0.00 C ATOM 1231 CD GLN A 84 11.344 16.772 -4.340 1.00 0.00 C ATOM 1232 OE1 GLN A 84 12.152 15.898 -4.657 1.00 0.00 O ATOM 1233 NE2 GLN A 84 11.127 17.850 -5.085 1.00 0.00 N ATOM 0 H GLN A 84 7.656 13.693 -3.928 1.00 0.00 H new ATOM 0 HA GLN A 84 10.500 14.403 -4.354 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.624 16.253 -3.918 1.00 0.00 H new ATOM 0 HB3 GLN A 84 8.795 15.721 -2.257 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.231 17.658 -2.743 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.174 16.258 -2.271 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.448 18.549 -4.784 1.00 0.00 H new ATOM 0 HE22 GLN A 84 11.639 17.978 -5.958 1.00 0.00 H new ATOM 1242 N ALA A 85 8.939 12.766 -2.015 1.00 0.00 N ATOM 1243 CA ALA A 85 9.117 11.869 -0.880 1.00 0.00 C ATOM 1244 C ALA A 85 8.410 10.538 -1.116 1.00 0.00 C ATOM 1245 O ALA A 85 7.632 10.398 -2.059 1.00 0.00 O ATOM 1246 CB ALA A 85 8.603 12.522 0.395 1.00 0.00 C ATOM 0 H ALA A 85 7.987 12.801 -2.380 1.00 0.00 H new ATOM 0 HA ALA A 85 10.183 11.670 -0.770 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.742 11.841 1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.155 13.443 0.580 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.543 12.750 0.285 1.00 0.00 H new ATOM 1252 N GLN A 86 8.687 9.565 -0.254 1.00 0.00 N ATOM 1253 CA GLN A 86 8.078 8.245 -0.372 1.00 0.00 C ATOM 1254 C GLN A 86 7.937 7.587 0.997 1.00 0.00 C ATOM 1255 O GLN A 86 8.899 7.508 1.761 1.00 0.00 O ATOM 1256 CB GLN A 86 8.913 7.355 -1.295 1.00 0.00 C ATOM 1257 CG GLN A 86 9.286 8.022 -2.609 1.00 0.00 C ATOM 1258 CD GLN A 86 10.370 9.070 -2.444 1.00 0.00 C ATOM 1259 OE1 GLN A 86 11.256 8.936 -1.600 1.00 0.00 O ATOM 1260 NE2 GLN A 86 10.304 10.121 -3.253 1.00 0.00 N ATOM 0 H GLN A 86 9.328 9.665 0.533 1.00 0.00 H new ATOM 0 HA GLN A 86 7.083 8.368 -0.800 1.00 0.00 H new ATOM 0 HB2 GLN A 86 9.825 7.061 -0.775 1.00 0.00 H new ATOM 0 HB3 GLN A 86 8.357 6.441 -1.506 1.00 0.00 H new ATOM 0 HG2 GLN A 86 9.624 7.263 -3.314 1.00 0.00 H new ATOM 0 HG3 GLN A 86 8.400 8.486 -3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 86 9.552 10.191 -3.938 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.006 10.859 -3.189 1.00 0.00 H new ATOM 1269 N SER A 87 6.731 7.117 1.301 1.00 0.00 N ATOM 1270 CA SER A 87 6.463 6.470 2.579 1.00 0.00 C ATOM 1271 C SER A 87 6.504 4.951 2.438 1.00 0.00 C ATOM 1272 O SER A 87 6.740 4.424 1.351 1.00 0.00 O ATOM 1273 CB SER A 87 5.101 6.907 3.120 1.00 0.00 C ATOM 1274 OG SER A 87 4.852 6.339 4.395 1.00 0.00 O ATOM 0 H SER A 87 5.924 7.173 0.679 1.00 0.00 H new ATOM 0 HA SER A 87 7.239 6.773 3.282 1.00 0.00 H new ATOM 0 HB2 SER A 87 5.066 7.994 3.190 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.317 6.606 2.425 1.00 0.00 H new ATOM 0 HG SER A 87 5.618 6.507 4.983 1.00 0.00 H new ATOM 1280 N ARG A 88 6.272 4.254 3.546 1.00 0.00 N ATOM 1281 CA ARG A 88 6.283 2.796 3.547 1.00 0.00 C ATOM 1282 C ARG A 88 5.376 2.247 4.645 1.00 0.00 C ATOM 1283 O ARG A 88 5.338 2.776 5.755 1.00 0.00 O ATOM 1284 CB ARG A 88 7.708 2.276 3.741 1.00 0.00 C ATOM 1285 CG ARG A 88 8.577 2.404 2.501 1.00 0.00 C ATOM 1286 CD ARG A 88 9.705 1.384 2.502 1.00 0.00 C ATOM 1287 NE ARG A 88 10.850 1.832 1.714 1.00 0.00 N ATOM 1288 CZ ARG A 88 11.583 2.897 2.021 1.00 0.00 C ATOM 1289 NH1 ARG A 88 11.292 3.618 3.095 1.00 0.00 N ATOM 1290 NH2 ARG A 88 12.609 3.241 1.254 1.00 0.00 N ATOM 0 H ARG A 88 6.074 4.675 4.454 1.00 0.00 H new ATOM 0 HA ARG A 88 5.907 2.454 2.583 1.00 0.00 H new ATOM 0 HB2 ARG A 88 8.176 2.821 4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.666 1.228 4.038 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.964 2.269 1.610 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.995 3.410 2.451 1.00 0.00 H new ATOM 0 HD2 ARG A 88 10.022 1.196 3.528 1.00 0.00 H new ATOM 0 HD3 ARG A 88 9.339 0.438 2.103 1.00 0.00 H new ATOM 0 HE ARG A 88 11.101 1.298 0.882 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.504 3.356 3.687 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.856 4.435 3.329 1.00 0.00 H new ATOM 0 HH21 ARG A 88 12.836 2.688 0.428 1.00 0.00 H new ATOM 0 HH22 ARG A 88 13.171 4.059 1.491 1.00 0.00 H new ATOM 1304 N ALA A 89 4.647 1.182 4.325 1.00 0.00 N ATOM 1305 CA ALA A 89 3.742 0.560 5.284 1.00 0.00 C ATOM 1306 C ALA A 89 3.720 -0.955 5.114 1.00 0.00 C ATOM 1307 O ALA A 89 3.900 -1.467 4.010 1.00 0.00 O ATOM 1308 CB ALA A 89 2.340 1.131 5.133 1.00 0.00 C ATOM 0 H ALA A 89 4.666 0.733 3.410 1.00 0.00 H new ATOM 0 HA ALA A 89 4.106 0.781 6.287 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.675 0.658 5.855 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.364 2.206 5.312 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.976 0.939 4.124 1.00 0.00 H new ATOM 1314 N GLN A 90 3.498 -1.666 6.216 1.00 0.00 N ATOM 1315 CA GLN A 90 3.454 -3.123 6.188 1.00 0.00 C ATOM 1316 C GLN A 90 2.022 -3.627 6.336 1.00 0.00 C ATOM 1317 O GLN A 90 1.319 -3.264 7.280 1.00 0.00 O ATOM 1318 CB GLN A 90 4.329 -3.702 7.301 1.00 0.00 C ATOM 1319 CG GLN A 90 5.784 -3.269 7.219 1.00 0.00 C ATOM 1320 CD GLN A 90 6.599 -3.736 8.408 1.00 0.00 C ATOM 1321 OE1 GLN A 90 6.201 -3.553 9.559 1.00 0.00 O ATOM 1322 NE2 GLN A 90 7.748 -4.344 8.136 1.00 0.00 N ATOM 0 H GLN A 90 3.346 -1.257 7.138 1.00 0.00 H new ATOM 0 HA GLN A 90 3.839 -3.455 5.224 1.00 0.00 H new ATOM 0 HB2 GLN A 90 3.922 -3.399 8.266 1.00 0.00 H new ATOM 0 HB3 GLN A 90 4.280 -4.790 7.262 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.225 -3.663 6.303 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.833 -2.182 7.154 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.039 -4.475 7.167 1.00 0.00 H new ATOM 0 HE22 GLN A 90 8.339 -4.680 8.896 1.00 0.00 H new ATOM 1331 N LEU A 91 1.595 -4.465 5.397 1.00 0.00 N ATOM 1332 CA LEU A 91 0.246 -5.019 5.423 1.00 0.00 C ATOM 1333 C LEU A 91 0.257 -6.455 5.937 1.00 0.00 C ATOM 1334 O LEU A 91 1.272 -7.147 5.855 1.00 0.00 O ATOM 1335 CB LEU A 91 -0.373 -4.970 4.025 1.00 0.00 C ATOM 1336 CG LEU A 91 -1.685 -5.735 3.845 1.00 0.00 C ATOM 1337 CD1 LEU A 91 -2.791 -5.098 4.671 1.00 0.00 C ATOM 1338 CD2 LEU A 91 -2.076 -5.784 2.375 1.00 0.00 C ATOM 0 H LEU A 91 2.163 -4.775 4.609 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.356 -4.415 6.102 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.545 -3.926 3.762 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.354 -5.362 3.314 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.539 -6.757 4.196 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.717 -5.655 4.531 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.514 -5.115 5.725 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.936 -4.066 4.350 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -3.012 -6.332 2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -2.204 -4.769 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.293 -6.286 1.807 1.00 0.00 H new ATOM 1350 N LEU A 92 -0.879 -6.897 6.465 1.00 0.00 N ATOM 1351 CA LEU A 92 -1.001 -8.253 6.990 1.00 0.00 C ATOM 1352 C LEU A 92 -2.300 -8.902 6.524 1.00 0.00 C ATOM 1353 O LEU A 92 -3.388 -8.371 6.749 1.00 0.00 O ATOM 1354 CB LEU A 92 -0.947 -8.235 8.519 1.00 0.00 C ATOM 1355 CG LEU A 92 -0.907 -9.601 9.205 1.00 0.00 C ATOM 1356 CD1 LEU A 92 0.390 -10.325 8.877 1.00 0.00 C ATOM 1357 CD2 LEU A 92 -1.067 -9.446 10.710 1.00 0.00 C ATOM 0 H LEU A 92 -1.728 -6.337 6.541 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.166 -8.841 6.609 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.066 -7.671 8.825 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.817 -7.691 8.887 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.738 -10.199 8.831 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.401 -11.295 9.374 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.464 -10.468 7.799 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.236 -9.731 9.223 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.036 -10.428 11.182 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.257 -8.830 11.100 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.023 -8.969 10.927 1.00 0.00 H new ATOM 1369 N VAL A 93 -2.179 -10.056 5.874 1.00 0.00 N ATOM 1370 CA VAL A 93 -3.343 -10.780 5.379 1.00 0.00 C ATOM 1371 C VAL A 93 -3.566 -12.067 6.166 1.00 0.00 C ATOM 1372 O VAL A 93 -3.099 -13.135 5.773 1.00 0.00 O ATOM 1373 CB VAL A 93 -3.196 -11.125 3.885 1.00 0.00 C ATOM 1374 CG1 VAL A 93 -4.220 -12.173 3.475 1.00 0.00 C ATOM 1375 CG2 VAL A 93 -3.335 -9.872 3.034 1.00 0.00 C ATOM 0 H VAL A 93 -1.286 -10.509 5.678 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.203 -10.123 5.510 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.201 -11.540 3.722 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -4.101 -12.404 2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.069 -13.078 4.063 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.225 -11.789 3.651 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.229 -10.134 1.981 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.316 -9.426 3.200 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.560 -9.157 3.310 1.00 0.00 H new ATOM 1385 N GLN A 94 -4.284 -11.956 7.280 1.00 0.00 N ATOM 1386 CA GLN A 94 -4.569 -13.111 8.123 1.00 0.00 C ATOM 1387 C GLN A 94 -5.483 -14.097 7.404 1.00 0.00 C ATOM 1388 O GLN A 94 -6.561 -13.733 6.937 1.00 0.00 O ATOM 1389 CB GLN A 94 -5.214 -12.664 9.436 1.00 0.00 C ATOM 1390 CG GLN A 94 -4.303 -11.807 10.300 1.00 0.00 C ATOM 1391 CD GLN A 94 -5.072 -10.950 11.287 1.00 0.00 C ATOM 1392 OE1 GLN A 94 -6.021 -10.259 10.918 1.00 0.00 O ATOM 1393 NE2 GLN A 94 -4.664 -10.992 12.550 1.00 0.00 N ATOM 0 H GLN A 94 -4.678 -11.079 7.619 1.00 0.00 H new ATOM 0 HA GLN A 94 -3.626 -13.611 8.342 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -6.122 -12.104 9.213 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -5.514 -13.546 10.002 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -3.613 -12.452 10.845 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -3.700 -11.164 9.659 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -3.872 -11.580 12.811 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -5.143 -10.437 13.259 1.00 0.00 H new ATOM 1402 N GLY A 95 -5.043 -15.349 7.317 1.00 0.00 N ATOM 1403 CA GLY A 95 -5.833 -16.369 6.653 1.00 0.00 C ATOM 1404 C GLY A 95 -7.259 -16.423 7.166 1.00 0.00 C ATOM 1405 O GLY A 95 -7.493 -16.713 8.339 1.00 0.00 O ATOM 0 H GLY A 95 -4.153 -15.675 7.695 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -5.843 -16.176 5.580 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -5.361 -17.341 6.797 1.00 0.00 H new ATOM 1409 N ARG A 96 -8.214 -16.142 6.285 1.00 0.00 N ATOM 1410 CA ARG A 96 -9.623 -16.158 6.656 1.00 0.00 C ATOM 1411 C ARG A 96 -9.936 -17.352 7.554 1.00 0.00 C ATOM 1412 O ARG A 96 -10.636 -17.219 8.558 1.00 0.00 O ATOM 1413 CB ARG A 96 -10.502 -16.203 5.405 1.00 0.00 C ATOM 1414 CG ARG A 96 -11.938 -16.616 5.683 1.00 0.00 C ATOM 1415 CD ARG A 96 -12.683 -16.939 4.398 1.00 0.00 C ATOM 1416 NE ARG A 96 -13.920 -17.673 4.652 1.00 0.00 N ATOM 1417 CZ ARG A 96 -14.850 -17.889 3.728 1.00 0.00 C ATOM 1418 NH1 ARG A 96 -14.684 -17.429 2.496 1.00 0.00 N ATOM 1419 NH2 ARG A 96 -15.949 -18.566 4.036 1.00 0.00 N ATOM 0 H ARG A 96 -8.037 -15.901 5.310 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.837 -15.243 7.209 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.500 -15.220 4.935 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.065 -16.899 4.689 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -11.947 -17.487 6.339 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -12.453 -15.814 6.211 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.913 -16.014 3.870 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -12.040 -17.528 3.744 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.079 -18.040 5.590 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.841 -16.908 2.255 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -15.399 -17.596 1.788 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -16.081 -18.921 4.983 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -16.662 -18.731 3.326 1.00 0.00 H new ATOM 1433 N ARG A 97 -9.414 -18.516 7.184 1.00 0.00 N ATOM 1434 CA ARG A 97 -9.639 -19.734 7.954 1.00 0.00 C ATOM 1435 C ARG A 97 -8.603 -20.797 7.604 1.00 0.00 C ATOM 1436 O ARG A 97 -8.307 -21.029 6.432 1.00 0.00 O ATOM 1437 CB ARG A 97 -11.047 -20.273 7.695 1.00 0.00 C ATOM 1438 CG ARG A 97 -11.330 -21.595 8.390 1.00 0.00 C ATOM 1439 CD ARG A 97 -12.730 -22.100 8.078 1.00 0.00 C ATOM 1440 NE ARG A 97 -13.717 -21.604 9.034 1.00 0.00 N ATOM 1441 CZ ARG A 97 -14.867 -22.217 9.288 1.00 0.00 C ATOM 1442 NH1 ARG A 97 -15.174 -23.345 8.661 1.00 0.00 N ATOM 1443 NH2 ARG A 97 -15.714 -21.704 10.171 1.00 0.00 N ATOM 0 H ARG A 97 -8.832 -18.642 6.356 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.540 -19.490 9.012 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -11.777 -19.534 8.027 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.187 -20.399 6.621 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.596 -22.337 8.076 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -11.218 -21.472 9.467 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -13.012 -21.789 7.072 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.733 -23.190 8.087 1.00 0.00 H new ATOM 0 HE ARG A 97 -13.511 -20.739 9.534 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -14.526 -23.744 7.982 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -16.058 -23.814 8.858 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -15.482 -20.837 10.656 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -16.597 -22.176 10.365 1.00 0.00 H new ATOM 1457 N SER A 98 -8.054 -21.441 8.630 1.00 0.00 N ATOM 1458 CA SER A 98 -7.047 -22.477 8.432 1.00 0.00 C ATOM 1459 C SER A 98 -7.696 -23.855 8.342 1.00 0.00 C ATOM 1460 O SER A 98 -7.708 -24.612 9.312 1.00 0.00 O ATOM 1461 CB SER A 98 -6.029 -22.453 9.573 1.00 0.00 C ATOM 1462 OG SER A 98 -5.033 -23.445 9.389 1.00 0.00 O ATOM 0 H SER A 98 -8.290 -21.263 9.606 1.00 0.00 H new ATOM 0 HA SER A 98 -6.533 -22.275 7.492 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.562 -21.470 9.627 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.538 -22.616 10.523 1.00 0.00 H new ATOM 0 HG SER A 98 -4.394 -23.408 10.131 1.00 0.00 H new ATOM 1468 N GLY A 99 -8.236 -24.173 7.170 1.00 0.00 N ATOM 1469 CA GLY A 99 -8.880 -25.459 6.974 1.00 0.00 C ATOM 1470 C GLY A 99 -9.579 -25.954 8.224 1.00 0.00 C ATOM 1471 O GLY A 99 -10.717 -25.584 8.513 1.00 0.00 O ATOM 0 H GLY A 99 -8.239 -23.563 6.352 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -9.605 -25.379 6.164 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -8.135 -26.192 6.664 1.00 0.00 H new ATOM 1475 N PRO A 100 -8.891 -26.813 8.991 1.00 0.00 N ATOM 1476 CA PRO A 100 -9.433 -27.379 10.229 1.00 0.00 C ATOM 1477 C PRO A 100 -9.557 -26.338 11.337 1.00 0.00 C ATOM 1478 O PRO A 100 -8.596 -26.065 12.055 1.00 0.00 O ATOM 1479 CB PRO A 100 -8.405 -28.447 10.611 1.00 0.00 C ATOM 1480 CG PRO A 100 -7.134 -27.992 9.981 1.00 0.00 C ATOM 1481 CD PRO A 100 -7.529 -27.297 8.707 1.00 0.00 C ATOM 0 HA PRO A 100 -10.442 -27.769 10.091 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.303 -28.529 11.693 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -8.700 -29.430 10.243 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -6.591 -27.316 10.642 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -6.475 -28.836 9.777 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -6.852 -26.476 8.470 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.514 -27.978 7.856 1.00 0.00 H new ATOM 1489 N SER A 101 -10.747 -25.761 11.469 1.00 0.00 N ATOM 1490 CA SER A 101 -10.996 -24.747 12.488 1.00 0.00 C ATOM 1491 C SER A 101 -11.191 -25.390 13.858 1.00 0.00 C ATOM 1492 O SER A 101 -12.216 -26.020 14.120 1.00 0.00 O ATOM 1493 CB SER A 101 -12.227 -23.917 12.121 1.00 0.00 C ATOM 1494 OG SER A 101 -12.510 -22.954 13.122 1.00 0.00 O ATOM 0 H SER A 101 -11.554 -25.978 10.884 1.00 0.00 H new ATOM 0 HA SER A 101 -10.126 -24.092 12.534 1.00 0.00 H new ATOM 0 HB2 SER A 101 -12.061 -23.416 11.167 1.00 0.00 H new ATOM 0 HB3 SER A 101 -13.087 -24.574 11.991 1.00 0.00 H new ATOM 0 HG SER A 101 -13.300 -22.435 12.863 1.00 0.00 H new ATOM 1500 N SER A 102 -10.200 -25.226 14.728 1.00 0.00 N ATOM 1501 CA SER A 102 -10.260 -25.793 16.070 1.00 0.00 C ATOM 1502 C SER A 102 -11.229 -25.008 16.949 1.00 0.00 C ATOM 1503 O SER A 102 -12.209 -25.554 17.454 1.00 0.00 O ATOM 1504 CB SER A 102 -8.869 -25.800 16.706 1.00 0.00 C ATOM 1505 OG SER A 102 -7.978 -26.625 15.975 1.00 0.00 O ATOM 0 H SER A 102 -9.346 -24.705 14.528 1.00 0.00 H new ATOM 0 HA SER A 102 -10.620 -26.819 15.988 1.00 0.00 H new ATOM 0 HB2 SER A 102 -8.479 -24.783 16.745 1.00 0.00 H new ATOM 0 HB3 SER A 102 -8.938 -26.155 17.734 1.00 0.00 H new ATOM 0 HG SER A 102 -7.095 -26.611 16.401 1.00 0.00 H new ATOM 1511 N GLY A 103 -10.947 -23.720 17.127 1.00 0.00 N ATOM 1512 CA GLY A 103 -11.802 -22.880 17.944 1.00 0.00 C ATOM 1513 C GLY A 103 -11.056 -22.246 19.102 1.00 0.00 C ATOM 1514 O GLY A 103 -10.799 -22.896 20.114 1.00 0.00 O ATOM 0 H GLY A 103 -10.142 -23.244 16.720 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -12.237 -22.097 17.323 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -12.629 -23.476 18.331 1.00 0.00 H new TER 1518 GLY A 103