USER MOD reduce.3.24.130724 H: found=0, std=0, add=524, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 522 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 Single : A 1 GLY N :NH3+ -115:sc= 0.0566 (180deg=-1.34!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 42:sc= 0.704 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -120:sc= -0.298 (180deg=-3.2!) USER MOD Single : A 11 GLN : amide:sc= -0.587 K(o=-0.59,f=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.945 K(o=-0.94,f=-1.8) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -2.13! K(o=-2.1!,f=-0.033) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -4.36 K(o=-4.4,f=-13!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 63 SER OG : rot -170:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.621 8.615 8.293 1.00 0.00 N ATOM 2 CA GLY A 1 13.798 8.452 7.459 1.00 0.00 C ATOM 3 C GLY A 1 14.745 9.631 7.556 1.00 0.00 C ATOM 4 O GLY A 1 14.358 10.712 7.998 1.00 0.00 O ATOM 0 H1 GLY A 1 12.621 7.891 9.039 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.632 9.560 8.727 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.766 8.511 7.710 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.324 7.543 7.751 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.489 8.322 6.422 1.00 0.00 H new ATOM 8 N SER A 2 15.991 9.423 7.142 1.00 0.00 N ATOM 9 CA SER A 2 16.998 10.477 7.189 1.00 0.00 C ATOM 10 C SER A 2 16.764 11.501 6.083 1.00 0.00 C ATOM 11 O SER A 2 16.425 11.146 4.955 1.00 0.00 O ATOM 12 CB SER A 2 18.400 9.878 7.057 1.00 0.00 C ATOM 13 OG SER A 2 18.858 9.374 8.300 1.00 0.00 O ATOM 0 H SER A 2 16.327 8.535 6.770 1.00 0.00 H new ATOM 0 HA SER A 2 16.916 10.982 8.151 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.389 9.077 6.318 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.091 10.638 6.692 1.00 0.00 H new ATOM 0 HG SER A 2 19.755 8.995 8.189 1.00 0.00 H new ATOM 19 N SER A 3 16.949 12.775 6.417 1.00 0.00 N ATOM 20 CA SER A 3 16.754 13.853 5.454 1.00 0.00 C ATOM 21 C SER A 3 15.308 13.896 4.972 1.00 0.00 C ATOM 22 O SER A 3 15.043 14.020 3.777 1.00 0.00 O ATOM 23 CB SER A 3 17.696 13.676 4.261 1.00 0.00 C ATOM 24 OG SER A 3 18.997 14.148 4.564 1.00 0.00 O ATOM 0 H SER A 3 17.233 13.085 7.346 1.00 0.00 H new ATOM 0 HA SER A 3 16.981 14.796 5.951 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.743 12.623 3.984 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.302 14.215 3.399 1.00 0.00 H new ATOM 0 HG SER A 3 19.580 14.022 3.786 1.00 0.00 H new ATOM 30 N GLY A 4 14.373 13.794 5.913 1.00 0.00 N ATOM 31 CA GLY A 4 12.965 13.823 5.566 1.00 0.00 C ATOM 32 C GLY A 4 12.269 12.508 5.854 1.00 0.00 C ATOM 33 O GLY A 4 12.749 11.445 5.460 1.00 0.00 O ATOM 0 H GLY A 4 14.567 13.692 6.909 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.473 14.620 6.123 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.860 14.062 4.508 1.00 0.00 H new ATOM 37 N SER A 5 11.135 12.579 6.545 1.00 0.00 N ATOM 38 CA SER A 5 10.375 11.383 6.890 1.00 0.00 C ATOM 39 C SER A 5 9.955 10.625 5.635 1.00 0.00 C ATOM 40 O SER A 5 8.983 10.989 4.973 1.00 0.00 O ATOM 41 CB SER A 5 9.140 11.758 7.711 1.00 0.00 C ATOM 42 OG SER A 5 8.321 12.678 7.009 1.00 0.00 O ATOM 0 H SER A 5 10.723 13.451 6.876 1.00 0.00 H new ATOM 0 HA SER A 5 11.016 10.734 7.487 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.567 10.860 7.943 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.449 12.193 8.661 1.00 0.00 H new ATOM 0 HG SER A 5 8.268 12.415 6.066 1.00 0.00 H new ATOM 48 N SER A 6 10.694 9.568 5.314 1.00 0.00 N ATOM 49 CA SER A 6 10.401 8.760 4.136 1.00 0.00 C ATOM 50 C SER A 6 9.608 7.513 4.516 1.00 0.00 C ATOM 51 O SER A 6 10.143 6.406 4.543 1.00 0.00 O ATOM 52 CB SER A 6 11.699 8.357 3.433 1.00 0.00 C ATOM 53 OG SER A 6 12.288 9.465 2.775 1.00 0.00 O ATOM 0 H SER A 6 11.500 9.251 5.853 1.00 0.00 H new ATOM 0 HA SER A 6 9.797 9.360 3.455 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.399 7.949 4.162 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.495 7.567 2.710 1.00 0.00 H new ATOM 0 HG SER A 6 13.117 9.182 2.335 1.00 0.00 H new ATOM 59 N GLY A 7 8.325 7.703 4.811 1.00 0.00 N ATOM 60 CA GLY A 7 7.477 6.587 5.186 1.00 0.00 C ATOM 61 C GLY A 7 6.223 6.501 4.339 1.00 0.00 C ATOM 62 O GLY A 7 5.668 7.523 3.932 1.00 0.00 O ATOM 0 H GLY A 7 7.858 8.610 4.797 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.040 5.659 5.091 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.197 6.684 6.235 1.00 0.00 H new ATOM 66 N LEU A 8 5.774 5.280 4.071 1.00 0.00 N ATOM 67 CA LEU A 8 4.578 5.064 3.265 1.00 0.00 C ATOM 68 C LEU A 8 3.620 4.101 3.959 1.00 0.00 C ATOM 69 O LEU A 8 3.984 2.971 4.281 1.00 0.00 O ATOM 70 CB LEU A 8 4.958 4.519 1.887 1.00 0.00 C ATOM 71 CG LEU A 8 3.891 4.639 0.799 1.00 0.00 C ATOM 72 CD1 LEU A 8 2.503 4.439 1.388 1.00 0.00 C ATOM 73 CD2 LEU A 8 3.988 5.990 0.105 1.00 0.00 C ATOM 0 H LEU A 8 6.220 4.424 4.400 1.00 0.00 H new ATOM 0 HA LEU A 8 4.075 6.023 3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.854 5.039 1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.221 3.467 1.995 1.00 0.00 H new ATOM 0 HG LEU A 8 4.065 3.858 0.058 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.757 4.528 0.599 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.438 3.449 1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.318 5.197 2.149 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.221 6.059 -0.667 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.840 6.786 0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.972 6.095 -0.351 1.00 0.00 H new ATOM 85 N LYS A 9 2.392 4.557 4.184 1.00 0.00 N ATOM 86 CA LYS A 9 1.379 3.736 4.837 1.00 0.00 C ATOM 87 C LYS A 9 0.190 3.500 3.910 1.00 0.00 C ATOM 88 O LYS A 9 -0.279 4.421 3.242 1.00 0.00 O ATOM 89 CB LYS A 9 0.907 4.404 6.130 1.00 0.00 C ATOM 90 CG LYS A 9 1.910 4.306 7.266 1.00 0.00 C ATOM 91 CD LYS A 9 1.687 3.056 8.101 1.00 0.00 C ATOM 92 CE LYS A 9 2.901 2.734 8.958 1.00 0.00 C ATOM 93 NZ LYS A 9 3.091 3.731 10.048 1.00 0.00 N ATOM 0 H LYS A 9 2.074 5.491 3.924 1.00 0.00 H new ATOM 0 HA LYS A 9 1.827 2.772 5.077 1.00 0.00 H new ATOM 0 HB2 LYS A 9 0.698 5.455 5.931 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -0.031 3.946 6.444 1.00 0.00 H new ATOM 0 HG2 LYS A 9 2.921 4.298 6.860 1.00 0.00 H new ATOM 0 HG3 LYS A 9 1.829 5.188 7.901 1.00 0.00 H new ATOM 0 HD2 LYS A 9 0.815 3.195 8.741 1.00 0.00 H new ATOM 0 HD3 LYS A 9 1.470 2.213 7.445 1.00 0.00 H new ATOM 0 HE2 LYS A 9 2.787 1.740 9.391 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.792 2.708 8.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 3.929 3.476 10.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.226 4.676 9.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.252 3.738 10.662 1.00 0.00 H new ATOM 107 N MET A 10 -0.293 2.262 3.878 1.00 0.00 N ATOM 108 CA MET A 10 -1.429 1.908 3.035 1.00 0.00 C ATOM 109 C MET A 10 -2.357 0.935 3.756 1.00 0.00 C ATOM 110 O MET A 10 -1.978 0.328 4.756 1.00 0.00 O ATOM 111 CB MET A 10 -0.944 1.290 1.722 1.00 0.00 C ATOM 112 CG MET A 10 -0.155 2.254 0.852 1.00 0.00 C ATOM 113 SD MET A 10 -0.172 1.791 -0.891 1.00 0.00 S ATOM 114 CE MET A 10 -1.382 2.945 -1.535 1.00 0.00 C ATOM 0 H MET A 10 0.084 1.488 4.425 1.00 0.00 H new ATOM 0 HA MET A 10 -1.985 2.819 2.815 1.00 0.00 H new ATOM 0 HB2 MET A 10 -0.322 0.423 1.946 1.00 0.00 H new ATOM 0 HB3 MET A 10 -1.805 0.928 1.160 1.00 0.00 H new ATOM 0 HG2 MET A 10 -0.568 3.257 0.961 1.00 0.00 H new ATOM 0 HG3 MET A 10 0.876 2.294 1.203 1.00 0.00 H new ATOM 0 HE1 MET A 10 -2.214 2.393 -1.973 1.00 0.00 H new ATOM 0 HE2 MET A 10 -1.751 3.575 -0.726 1.00 0.00 H new ATOM 0 HE3 MET A 10 -0.919 3.570 -2.299 1.00 0.00 H new ATOM 124 N GLN A 11 -3.575 0.795 3.241 1.00 0.00 N ATOM 125 CA GLN A 11 -4.557 -0.103 3.837 1.00 0.00 C ATOM 126 C GLN A 11 -4.915 -1.233 2.877 1.00 0.00 C ATOM 127 O GLN A 11 -4.858 -1.067 1.658 1.00 0.00 O ATOM 128 CB GLN A 11 -5.818 0.671 4.225 1.00 0.00 C ATOM 129 CG GLN A 11 -6.548 1.279 3.038 1.00 0.00 C ATOM 130 CD GLN A 11 -7.864 1.921 3.429 1.00 0.00 C ATOM 131 OE1 GLN A 11 -8.894 1.251 3.514 1.00 0.00 O ATOM 132 NE2 GLN A 11 -7.837 3.227 3.671 1.00 0.00 N ATOM 0 H GLN A 11 -3.905 1.292 2.413 1.00 0.00 H new ATOM 0 HA GLN A 11 -4.116 -0.539 4.734 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.496 0.002 4.754 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -5.547 1.466 4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.909 2.026 2.567 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.733 0.504 2.294 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -6.961 3.743 3.589 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -8.692 3.714 3.939 1.00 0.00 H new ATOM 141 N VAL A 12 -5.284 -2.382 3.434 1.00 0.00 N ATOM 142 CA VAL A 12 -5.652 -3.539 2.627 1.00 0.00 C ATOM 143 C VAL A 12 -7.113 -3.467 2.197 1.00 0.00 C ATOM 144 O VAL A 12 -8.017 -3.439 3.032 1.00 0.00 O ATOM 145 CB VAL A 12 -5.419 -4.855 3.394 1.00 0.00 C ATOM 146 CG1 VAL A 12 -5.791 -6.050 2.530 1.00 0.00 C ATOM 147 CG2 VAL A 12 -3.974 -4.951 3.858 1.00 0.00 C ATOM 0 H VAL A 12 -5.336 -2.536 4.441 1.00 0.00 H new ATOM 0 HA VAL A 12 -5.015 -3.524 1.743 1.00 0.00 H new ATOM 0 HB VAL A 12 -6.061 -4.861 4.275 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.620 -6.970 3.089 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.843 -5.985 2.252 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.177 -6.053 1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.827 -5.886 4.398 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.311 -4.923 2.993 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.747 -4.112 4.516 1.00 0.00 H new ATOM 157 N LEU A 13 -7.337 -3.437 0.888 1.00 0.00 N ATOM 158 CA LEU A 13 -8.689 -3.368 0.344 1.00 0.00 C ATOM 159 C LEU A 13 -9.281 -4.764 0.178 1.00 0.00 C ATOM 160 O LEU A 13 -10.496 -4.947 0.250 1.00 0.00 O ATOM 161 CB LEU A 13 -8.682 -2.641 -1.002 1.00 0.00 C ATOM 162 CG LEU A 13 -9.965 -1.894 -1.367 1.00 0.00 C ATOM 163 CD1 LEU A 13 -10.191 -0.726 -0.418 1.00 0.00 C ATOM 164 CD2 LEU A 13 -9.908 -1.409 -2.808 1.00 0.00 C ATOM 0 H LEU A 13 -6.600 -3.459 0.183 1.00 0.00 H new ATOM 0 HA LEU A 13 -9.309 -2.812 1.047 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.857 -1.928 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.474 -3.370 -1.785 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.804 -2.583 -1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.109 -0.206 -0.693 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.277 -1.098 0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -9.350 -0.036 -0.483 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -10.829 -0.880 -3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -9.059 -0.736 -2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.794 -2.263 -3.475 1.00 0.00 H new ATOM 176 N TYR A 14 -8.414 -5.746 -0.042 1.00 0.00 N ATOM 177 CA TYR A 14 -8.850 -7.126 -0.218 1.00 0.00 C ATOM 178 C TYR A 14 -7.914 -8.090 0.505 1.00 0.00 C ATOM 179 O TYR A 14 -6.695 -7.930 0.471 1.00 0.00 O ATOM 180 CB TYR A 14 -8.913 -7.478 -1.705 1.00 0.00 C ATOM 181 CG TYR A 14 -9.798 -6.552 -2.509 1.00 0.00 C ATOM 182 CD1 TYR A 14 -11.182 -6.615 -2.401 1.00 0.00 C ATOM 183 CD2 TYR A 14 -9.250 -5.615 -3.376 1.00 0.00 C ATOM 184 CE1 TYR A 14 -11.994 -5.772 -3.135 1.00 0.00 C ATOM 185 CE2 TYR A 14 -10.055 -4.767 -4.113 1.00 0.00 C ATOM 186 CZ TYR A 14 -11.426 -4.850 -3.989 1.00 0.00 C ATOM 187 OH TYR A 14 -12.232 -4.008 -4.720 1.00 0.00 O ATOM 0 H TYR A 14 -7.405 -5.612 -0.103 1.00 0.00 H new ATOM 0 HA TYR A 14 -9.846 -7.223 0.214 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.905 -7.454 -2.119 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.277 -8.500 -1.813 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.630 -7.335 -1.732 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -8.177 -5.548 -3.476 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.068 -5.835 -3.041 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.613 -4.044 -4.782 1.00 0.00 H new ATOM 0 HH TYR A 14 -11.675 -3.419 -5.271 1.00 0.00 H new ATOM 197 N GLU A 15 -8.496 -9.092 1.158 1.00 0.00 N ATOM 198 CA GLU A 15 -7.714 -10.082 1.889 1.00 0.00 C ATOM 199 C GLU A 15 -6.921 -10.965 0.931 1.00 0.00 C ATOM 200 O GLU A 15 -7.464 -11.489 -0.042 1.00 0.00 O ATOM 201 CB GLU A 15 -8.631 -10.947 2.757 1.00 0.00 C ATOM 202 CG GLU A 15 -7.982 -12.239 3.226 1.00 0.00 C ATOM 203 CD GLU A 15 -8.606 -12.775 4.500 1.00 0.00 C ATOM 204 OE1 GLU A 15 -9.235 -11.983 5.233 1.00 0.00 O ATOM 205 OE2 GLU A 15 -8.464 -13.988 4.765 1.00 0.00 O ATOM 0 H GLU A 15 -9.505 -9.239 1.195 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.011 -9.551 2.531 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -8.944 -10.370 3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -9.532 -11.187 2.193 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.066 -12.990 2.440 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -6.918 -12.068 3.391 1.00 0.00 H new ATOM 212 N PHE A 16 -5.632 -11.124 1.212 1.00 0.00 N ATOM 213 CA PHE A 16 -4.762 -11.942 0.375 1.00 0.00 C ATOM 214 C PHE A 16 -3.975 -12.939 1.220 1.00 0.00 C ATOM 215 O PHE A 16 -3.333 -12.566 2.201 1.00 0.00 O ATOM 216 CB PHE A 16 -3.798 -11.054 -0.416 1.00 0.00 C ATOM 217 CG PHE A 16 -2.716 -11.822 -1.119 1.00 0.00 C ATOM 218 CD1 PHE A 16 -3.019 -12.653 -2.186 1.00 0.00 C ATOM 219 CD2 PHE A 16 -1.396 -11.713 -0.714 1.00 0.00 C ATOM 220 CE1 PHE A 16 -2.025 -13.361 -2.834 1.00 0.00 C ATOM 221 CE2 PHE A 16 -0.397 -12.419 -1.358 1.00 0.00 C ATOM 222 CZ PHE A 16 -0.712 -13.243 -2.420 1.00 0.00 C ATOM 0 H PHE A 16 -5.167 -10.697 2.013 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.388 -12.498 -0.322 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.364 -10.483 -1.152 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.340 -10.334 0.262 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.043 -12.748 -2.515 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.144 -11.068 0.115 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.274 -14.006 -3.664 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.628 -12.326 -1.031 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.066 -13.794 -2.926 1.00 0.00 H new ATOM 232 N GLU A 17 -4.031 -14.209 0.830 1.00 0.00 N ATOM 233 CA GLU A 17 -3.325 -15.261 1.553 1.00 0.00 C ATOM 234 C GLU A 17 -1.936 -15.488 0.962 1.00 0.00 C ATOM 235 O GLU A 17 -1.792 -15.736 -0.234 1.00 0.00 O ATOM 236 CB GLU A 17 -4.127 -16.564 1.515 1.00 0.00 C ATOM 237 CG GLU A 17 -3.647 -17.603 2.513 1.00 0.00 C ATOM 238 CD GLU A 17 -2.514 -18.453 1.972 1.00 0.00 C ATOM 239 OE1 GLU A 17 -2.605 -18.891 0.806 1.00 0.00 O ATOM 240 OE2 GLU A 17 -1.536 -18.680 2.714 1.00 0.00 O ATOM 0 H GLU A 17 -4.557 -14.534 0.019 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.213 -14.943 2.589 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.176 -16.341 1.711 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -4.073 -16.985 0.511 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.317 -17.102 3.423 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.481 -18.249 2.789 1.00 0.00 H new ATOM 247 N ALA A 18 -0.917 -15.401 1.811 1.00 0.00 N ATOM 248 CA ALA A 18 0.459 -15.599 1.375 1.00 0.00 C ATOM 249 C ALA A 18 0.812 -17.081 1.324 1.00 0.00 C ATOM 250 O ALA A 18 0.920 -17.739 2.359 1.00 0.00 O ATOM 251 CB ALA A 18 1.416 -14.858 2.298 1.00 0.00 C ATOM 0 H ALA A 18 -1.019 -15.195 2.805 1.00 0.00 H new ATOM 0 HA ALA A 18 0.556 -15.195 0.367 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.441 -15.014 1.961 1.00 0.00 H new ATOM 0 HB2 ALA A 18 1.187 -13.793 2.280 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.307 -15.236 3.315 1.00 0.00 H new ATOM 257 N ARG A 19 0.988 -17.602 0.114 1.00 0.00 N ATOM 258 CA ARG A 19 1.326 -19.008 -0.072 1.00 0.00 C ATOM 259 C ARG A 19 2.829 -19.184 -0.270 1.00 0.00 C ATOM 260 O ARG A 19 3.288 -20.240 -0.701 1.00 0.00 O ATOM 261 CB ARG A 19 0.572 -19.581 -1.273 1.00 0.00 C ATOM 262 CG ARG A 19 0.937 -18.922 -2.593 1.00 0.00 C ATOM 263 CD ARG A 19 -0.017 -17.786 -2.930 1.00 0.00 C ATOM 264 NE ARG A 19 -1.148 -18.242 -3.734 1.00 0.00 N ATOM 265 CZ ARG A 19 -1.034 -18.681 -4.982 1.00 0.00 C ATOM 266 NH1 ARG A 19 0.155 -18.725 -5.567 1.00 0.00 N ATOM 267 NH2 ARG A 19 -2.110 -19.079 -5.648 1.00 0.00 N ATOM 0 H ARG A 19 0.902 -17.071 -0.753 1.00 0.00 H new ATOM 0 HA ARG A 19 1.029 -19.549 0.826 1.00 0.00 H new ATOM 0 HB2 ARG A 19 0.775 -20.650 -1.342 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -0.499 -19.470 -1.105 1.00 0.00 H new ATOM 0 HG2 ARG A 19 1.956 -18.539 -2.541 1.00 0.00 H new ATOM 0 HG3 ARG A 19 0.916 -19.665 -3.390 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -0.385 -17.336 -2.008 1.00 0.00 H new ATOM 0 HD3 ARG A 19 0.522 -17.008 -3.471 1.00 0.00 H new ATOM 0 HE ARG A 19 -2.077 -18.222 -3.313 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.985 -18.421 -5.058 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.239 -19.063 -6.526 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.027 -19.048 -5.202 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.021 -19.416 -6.607 1.00 0.00 H new ATOM 281 N ASN A 20 3.589 -18.141 0.048 1.00 0.00 N ATOM 282 CA ASN A 20 5.039 -18.180 -0.097 1.00 0.00 C ATOM 283 C ASN A 20 5.726 -17.759 1.199 1.00 0.00 C ATOM 284 O ASN A 20 5.167 -17.031 2.020 1.00 0.00 O ATOM 285 CB ASN A 20 5.484 -17.268 -1.242 1.00 0.00 C ATOM 286 CG ASN A 20 4.436 -17.157 -2.333 1.00 0.00 C ATOM 287 OD1 ASN A 20 3.511 -16.350 -2.241 1.00 0.00 O ATOM 288 ND2 ASN A 20 4.577 -17.971 -3.373 1.00 0.00 N ATOM 0 H ASN A 20 3.225 -17.259 0.408 1.00 0.00 H new ATOM 0 HA ASN A 20 5.328 -19.206 -0.326 1.00 0.00 H new ATOM 0 HB2 ASN A 20 5.702 -16.275 -0.849 1.00 0.00 H new ATOM 0 HB3 ASN A 20 6.410 -17.652 -1.669 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.903 -17.943 -4.138 1.00 0.00 H new ATOM 0 HD22 ASN A 20 5.360 -18.624 -3.407 1.00 0.00 H new ATOM 295 N PRO A 21 6.969 -18.226 1.389 1.00 0.00 N ATOM 296 CA PRO A 21 7.760 -17.911 2.582 1.00 0.00 C ATOM 297 C PRO A 21 8.198 -16.450 2.617 1.00 0.00 C ATOM 298 O PRO A 21 8.333 -15.859 3.689 1.00 0.00 O ATOM 299 CB PRO A 21 8.977 -18.831 2.455 1.00 0.00 C ATOM 300 CG PRO A 21 9.101 -19.094 0.994 1.00 0.00 C ATOM 301 CD PRO A 21 7.698 -19.098 0.453 1.00 0.00 C ATOM 0 HA PRO A 21 7.191 -18.060 3.499 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.875 -18.356 2.850 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.834 -19.756 3.013 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.704 -18.326 0.509 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.593 -20.049 0.810 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.659 -18.714 -0.567 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.279 -20.104 0.431 1.00 0.00 H new ATOM 309 N ARG A 22 8.418 -15.875 1.440 1.00 0.00 N ATOM 310 CA ARG A 22 8.842 -14.483 1.337 1.00 0.00 C ATOM 311 C ARG A 22 7.645 -13.542 1.437 1.00 0.00 C ATOM 312 O ARG A 22 7.758 -12.434 1.961 1.00 0.00 O ATOM 313 CB ARG A 22 9.580 -14.249 0.018 1.00 0.00 C ATOM 314 CG ARG A 22 8.668 -14.243 -1.198 1.00 0.00 C ATOM 315 CD ARG A 22 9.298 -13.498 -2.364 1.00 0.00 C ATOM 316 NE ARG A 22 8.708 -13.883 -3.643 1.00 0.00 N ATOM 317 CZ ARG A 22 8.938 -15.049 -4.237 1.00 0.00 C ATOM 318 NH1 ARG A 22 9.741 -15.939 -3.669 1.00 0.00 N ATOM 319 NH2 ARG A 22 8.364 -15.327 -5.400 1.00 0.00 N ATOM 0 H ARG A 22 8.310 -16.351 0.544 1.00 0.00 H new ATOM 0 HA ARG A 22 9.518 -14.272 2.166 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.107 -13.297 0.071 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.335 -15.025 -0.109 1.00 0.00 H new ATOM 0 HG2 ARG A 22 8.450 -15.269 -1.496 1.00 0.00 H new ATOM 0 HG3 ARG A 22 7.717 -13.777 -0.939 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.176 -12.425 -2.217 1.00 0.00 H new ATOM 0 HD3 ARG A 22 10.370 -13.697 -2.385 1.00 0.00 H new ATOM 0 HE ARG A 22 8.085 -13.221 -4.106 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.183 -15.729 -2.774 1.00 0.00 H new ATOM 0 HH12 ARG A 22 9.916 -16.833 -4.127 1.00 0.00 H new ATOM 0 HH21 ARG A 22 7.745 -14.645 -5.839 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.541 -16.222 -5.855 1.00 0.00 H new ATOM 333 N GLU A 23 6.501 -13.991 0.931 1.00 0.00 N ATOM 334 CA GLU A 23 5.285 -13.188 0.962 1.00 0.00 C ATOM 335 C GLU A 23 4.746 -13.072 2.385 1.00 0.00 C ATOM 336 O GLU A 23 5.331 -13.607 3.328 1.00 0.00 O ATOM 337 CB GLU A 23 4.220 -13.799 0.050 1.00 0.00 C ATOM 338 CG GLU A 23 4.266 -13.276 -1.376 1.00 0.00 C ATOM 339 CD GLU A 23 5.589 -13.561 -2.060 1.00 0.00 C ATOM 340 OE1 GLU A 23 5.831 -14.734 -2.416 1.00 0.00 O ATOM 341 OE2 GLU A 23 6.382 -12.614 -2.238 1.00 0.00 O ATOM 0 H GLU A 23 6.391 -14.906 0.495 1.00 0.00 H new ATOM 0 HA GLU A 23 5.531 -12.189 0.602 1.00 0.00 H new ATOM 0 HB2 GLU A 23 4.345 -14.882 0.035 1.00 0.00 H new ATOM 0 HB3 GLU A 23 3.235 -13.597 0.470 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.459 -13.729 -1.951 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.088 -12.201 -1.370 1.00 0.00 H new ATOM 348 N LEU A 24 3.629 -12.369 2.533 1.00 0.00 N ATOM 349 CA LEU A 24 3.010 -12.181 3.840 1.00 0.00 C ATOM 350 C LEU A 24 1.490 -12.143 3.723 1.00 0.00 C ATOM 351 O LEU A 24 0.945 -11.743 2.693 1.00 0.00 O ATOM 352 CB LEU A 24 3.515 -10.890 4.485 1.00 0.00 C ATOM 353 CG LEU A 24 2.922 -10.545 5.852 1.00 0.00 C ATOM 354 CD1 LEU A 24 3.623 -11.327 6.951 1.00 0.00 C ATOM 355 CD2 LEU A 24 3.020 -9.049 6.113 1.00 0.00 C ATOM 0 H LEU A 24 3.133 -11.919 1.763 1.00 0.00 H new ATOM 0 HA LEU A 24 3.286 -13.027 4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.598 -10.959 4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.311 -10.064 3.804 1.00 0.00 H new ATOM 0 HG LEU A 24 1.869 -10.825 5.851 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.188 -11.068 7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.500 -12.395 6.772 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.684 -11.079 6.954 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.593 -8.821 7.090 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.066 -8.744 6.094 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.471 -8.508 5.342 1.00 0.00 H new ATOM 367 N THR A 25 0.808 -12.560 4.786 1.00 0.00 N ATOM 368 CA THR A 25 -0.649 -12.573 4.802 1.00 0.00 C ATOM 369 C THR A 25 -1.205 -11.246 5.306 1.00 0.00 C ATOM 370 O THR A 25 -0.659 -10.644 6.230 1.00 0.00 O ATOM 371 CB THR A 25 -1.191 -13.712 5.687 1.00 0.00 C ATOM 372 OG1 THR A 25 -0.500 -14.931 5.393 1.00 0.00 O ATOM 373 CG2 THR A 25 -2.684 -13.903 5.469 1.00 0.00 C ATOM 0 H THR A 25 1.242 -12.893 5.647 1.00 0.00 H new ATOM 0 HA THR A 25 -0.975 -12.734 3.774 1.00 0.00 H new ATOM 0 HB THR A 25 -1.025 -13.443 6.730 1.00 0.00 H new ATOM 0 HG1 THR A 25 -0.849 -15.650 5.961 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.044 -14.712 6.104 1.00 0.00 H new ATOM 0 HG22 THR A 25 -3.209 -12.982 5.722 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.870 -14.152 4.424 1.00 0.00 H new ATOM 381 N VAL A 26 -2.294 -10.794 4.691 1.00 0.00 N ATOM 382 CA VAL A 26 -2.925 -9.538 5.078 1.00 0.00 C ATOM 383 C VAL A 26 -4.438 -9.607 4.904 1.00 0.00 C ATOM 384 O VAL A 26 -4.940 -10.271 3.997 1.00 0.00 O ATOM 385 CB VAL A 26 -2.377 -8.358 4.254 1.00 0.00 C ATOM 386 CG1 VAL A 26 -0.891 -8.168 4.516 1.00 0.00 C ATOM 387 CG2 VAL A 26 -2.642 -8.575 2.772 1.00 0.00 C ATOM 0 H VAL A 26 -2.757 -11.279 3.923 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.691 -9.376 6.130 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.895 -7.450 4.563 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.522 -7.330 3.925 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.731 -7.964 5.575 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.353 -9.074 4.236 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.248 -7.732 2.205 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.152 -9.492 2.445 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -3.716 -8.657 2.602 1.00 0.00 H new ATOM 397 N VAL A 27 -5.160 -8.915 5.779 1.00 0.00 N ATOM 398 CA VAL A 27 -6.617 -8.895 5.722 1.00 0.00 C ATOM 399 C VAL A 27 -7.137 -7.491 5.434 1.00 0.00 C ATOM 400 O VAL A 27 -6.472 -6.500 5.733 1.00 0.00 O ATOM 401 CB VAL A 27 -7.238 -9.401 7.038 1.00 0.00 C ATOM 402 CG1 VAL A 27 -6.863 -10.855 7.281 1.00 0.00 C ATOM 403 CG2 VAL A 27 -6.800 -8.527 8.203 1.00 0.00 C ATOM 0 H VAL A 27 -4.760 -8.361 6.536 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.911 -9.561 4.911 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.323 -9.340 6.955 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -7.311 -11.195 8.215 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.231 -11.468 6.458 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -5.779 -10.945 7.344 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.248 -8.898 9.125 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.714 -8.555 8.290 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.124 -7.501 8.030 1.00 0.00 H new ATOM 413 N GLN A 28 -8.330 -7.415 4.854 1.00 0.00 N ATOM 414 CA GLN A 28 -8.939 -6.132 4.526 1.00 0.00 C ATOM 415 C GLN A 28 -9.066 -5.256 5.769 1.00 0.00 C ATOM 416 O GLN A 28 -9.220 -5.759 6.881 1.00 0.00 O ATOM 417 CB GLN A 28 -10.316 -6.343 3.894 1.00 0.00 C ATOM 418 CG GLN A 28 -11.064 -5.049 3.616 1.00 0.00 C ATOM 419 CD GLN A 28 -12.389 -5.279 2.918 1.00 0.00 C ATOM 420 OE1 GLN A 28 -12.498 -6.126 2.030 1.00 0.00 O ATOM 421 NE2 GLN A 28 -13.407 -4.524 3.315 1.00 0.00 N ATOM 0 H GLN A 28 -8.894 -8.227 4.602 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.293 -5.624 3.810 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.197 -6.892 2.960 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -10.918 -6.966 4.555 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -11.239 -4.526 4.556 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -10.442 -4.399 3.001 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -13.273 -3.834 4.054 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -14.323 -4.634 2.881 1.00 0.00 H new ATOM 430 N GLY A 29 -9.001 -3.943 5.571 1.00 0.00 N ATOM 431 CA GLY A 29 -9.110 -3.019 6.684 1.00 0.00 C ATOM 432 C GLY A 29 -7.784 -2.797 7.385 1.00 0.00 C ATOM 433 O GLY A 29 -7.483 -1.686 7.819 1.00 0.00 O ATOM 0 H GLY A 29 -8.875 -3.503 4.659 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -9.491 -2.064 6.323 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.837 -3.402 7.400 1.00 0.00 H new ATOM 437 N GLU A 30 -6.992 -3.859 7.499 1.00 0.00 N ATOM 438 CA GLU A 30 -5.693 -3.775 8.156 1.00 0.00 C ATOM 439 C GLU A 30 -4.774 -2.804 7.421 1.00 0.00 C ATOM 440 O GLU A 30 -4.850 -2.661 6.200 1.00 0.00 O ATOM 441 CB GLU A 30 -5.042 -5.158 8.226 1.00 0.00 C ATOM 442 CG GLU A 30 -3.657 -5.147 8.851 1.00 0.00 C ATOM 443 CD GLU A 30 -3.695 -4.921 10.350 1.00 0.00 C ATOM 444 OE1 GLU A 30 -4.393 -5.688 11.047 1.00 0.00 O ATOM 445 OE2 GLU A 30 -3.029 -3.979 10.826 1.00 0.00 O ATOM 0 H GLU A 30 -7.227 -4.786 7.145 1.00 0.00 H new ATOM 0 HA GLU A 30 -5.849 -3.404 9.169 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.685 -5.825 8.800 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.974 -5.570 7.219 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.161 -6.095 8.643 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.058 -4.365 8.384 1.00 0.00 H new ATOM 452 N LYS A 31 -3.904 -2.137 8.173 1.00 0.00 N ATOM 453 CA LYS A 31 -2.969 -1.180 7.595 1.00 0.00 C ATOM 454 C LYS A 31 -1.534 -1.685 7.708 1.00 0.00 C ATOM 455 O LYS A 31 -1.151 -2.279 8.717 1.00 0.00 O ATOM 456 CB LYS A 31 -3.099 0.176 8.292 1.00 0.00 C ATOM 457 CG LYS A 31 -4.487 0.443 8.849 1.00 0.00 C ATOM 458 CD LYS A 31 -4.616 -0.043 10.282 1.00 0.00 C ATOM 459 CE LYS A 31 -5.742 0.672 11.014 1.00 0.00 C ATOM 460 NZ LYS A 31 -6.155 -0.058 12.244 1.00 0.00 N ATOM 0 H LYS A 31 -3.828 -2.242 9.185 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.213 -1.064 6.539 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.374 0.228 9.105 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.843 0.965 7.585 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.698 1.512 8.806 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.231 -0.054 8.227 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.801 -1.117 10.288 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.676 0.121 10.809 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -5.420 1.679 11.280 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.599 0.776 10.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.924 0.461 12.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.486 -1.010 11.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.344 -0.136 12.890 1.00 0.00 H new ATOM 474 N LEU A 32 -0.744 -1.445 6.667 1.00 0.00 N ATOM 475 CA LEU A 32 0.650 -1.875 6.650 1.00 0.00 C ATOM 476 C LEU A 32 1.559 -0.756 6.153 1.00 0.00 C ATOM 477 O LEU A 32 1.086 0.266 5.657 1.00 0.00 O ATOM 478 CB LEU A 32 0.813 -3.111 5.764 1.00 0.00 C ATOM 479 CG LEU A 32 -0.017 -4.333 6.158 1.00 0.00 C ATOM 480 CD1 LEU A 32 -0.283 -5.212 4.946 1.00 0.00 C ATOM 481 CD2 LEU A 32 0.686 -5.126 7.250 1.00 0.00 C ATOM 0 H LEU A 32 -1.045 -0.955 5.824 1.00 0.00 H new ATOM 0 HA LEU A 32 0.939 -2.127 7.670 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.556 -2.837 4.741 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.865 -3.396 5.763 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.975 -3.987 6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.875 -6.077 5.246 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.830 -4.641 4.195 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.665 -5.549 4.526 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.081 -5.992 7.518 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.658 -5.461 6.888 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.823 -4.494 8.127 1.00 0.00 H new ATOM 493 N GLU A 33 2.866 -0.958 6.286 1.00 0.00 N ATOM 494 CA GLU A 33 3.841 0.035 5.848 1.00 0.00 C ATOM 495 C GLU A 33 4.594 -0.450 4.613 1.00 0.00 C ATOM 496 O GLU A 33 5.299 -1.458 4.658 1.00 0.00 O ATOM 497 CB GLU A 33 4.830 0.342 6.974 1.00 0.00 C ATOM 498 CG GLU A 33 6.027 1.163 6.526 1.00 0.00 C ATOM 499 CD GLU A 33 6.723 1.859 7.680 1.00 0.00 C ATOM 500 OE1 GLU A 33 6.045 2.603 8.418 1.00 0.00 O ATOM 501 OE2 GLU A 33 7.944 1.659 7.844 1.00 0.00 O ATOM 0 H GLU A 33 3.274 -1.799 6.693 1.00 0.00 H new ATOM 0 HA GLU A 33 3.302 0.946 5.589 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.309 0.878 7.767 1.00 0.00 H new ATOM 0 HB3 GLU A 33 5.183 -0.596 7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.738 0.513 6.017 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.701 1.908 5.801 1.00 0.00 H new ATOM 508 N VAL A 34 4.438 0.275 3.510 1.00 0.00 N ATOM 509 CA VAL A 34 5.102 -0.080 2.261 1.00 0.00 C ATOM 510 C VAL A 34 6.593 0.236 2.323 1.00 0.00 C ATOM 511 O VAL A 34 7.007 1.202 2.965 1.00 0.00 O ATOM 512 CB VAL A 34 4.480 0.662 1.064 1.00 0.00 C ATOM 513 CG1 VAL A 34 5.205 0.300 -0.224 1.00 0.00 C ATOM 514 CG2 VAL A 34 2.996 0.349 0.956 1.00 0.00 C ATOM 0 H VAL A 34 3.858 1.112 3.456 1.00 0.00 H new ATOM 0 HA VAL A 34 4.966 -1.153 2.123 1.00 0.00 H new ATOM 0 HB VAL A 34 4.591 1.734 1.226 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.752 0.834 -1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.255 0.580 -0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.128 -0.774 -0.395 1.00 0.00 H new ATOM 0 HG21 VAL A 34 2.573 0.882 0.105 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.860 -0.723 0.817 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.490 0.664 1.869 1.00 0.00 H new ATOM 524 N LEU A 35 7.394 -0.583 1.652 1.00 0.00 N ATOM 525 CA LEU A 35 8.840 -0.391 1.629 1.00 0.00 C ATOM 526 C LEU A 35 9.362 -0.354 0.196 1.00 0.00 C ATOM 527 O LEU A 35 9.923 0.649 -0.245 1.00 0.00 O ATOM 528 CB LEU A 35 9.535 -1.509 2.408 1.00 0.00 C ATOM 529 CG LEU A 35 9.276 -1.538 3.915 1.00 0.00 C ATOM 530 CD1 LEU A 35 9.494 -2.938 4.467 1.00 0.00 C ATOM 531 CD2 LEU A 35 10.170 -0.535 4.630 1.00 0.00 C ATOM 0 H LEU A 35 7.067 -1.387 1.116 1.00 0.00 H new ATOM 0 HA LEU A 35 9.062 0.566 2.102 1.00 0.00 H new ATOM 0 HB2 LEU A 35 9.224 -2.465 1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 35 10.610 -1.424 2.246 1.00 0.00 H new ATOM 0 HG LEU A 35 8.237 -1.258 4.091 1.00 0.00 H new ATOM 0 HD11 LEU A 35 9.305 -2.939 5.541 1.00 0.00 H new ATOM 0 HD12 LEU A 35 8.811 -3.632 3.978 1.00 0.00 H new ATOM 0 HD13 LEU A 35 10.522 -3.247 4.279 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.972 -0.570 5.701 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.215 -0.784 4.446 1.00 0.00 H new ATOM 0 HD23 LEU A 35 9.964 0.468 4.255 1.00 0.00 H new ATOM 543 N ASP A 36 9.171 -1.453 -0.526 1.00 0.00 N ATOM 544 CA ASP A 36 9.620 -1.545 -1.910 1.00 0.00 C ATOM 545 C ASP A 36 8.453 -1.347 -2.874 1.00 0.00 C ATOM 546 O ASP A 36 7.779 -2.305 -3.254 1.00 0.00 O ATOM 547 CB ASP A 36 10.283 -2.899 -2.165 1.00 0.00 C ATOM 548 CG ASP A 36 11.330 -2.835 -3.260 1.00 0.00 C ATOM 549 OD1 ASP A 36 11.262 -1.905 -4.091 1.00 0.00 O ATOM 550 OD2 ASP A 36 12.217 -3.713 -3.284 1.00 0.00 O ATOM 0 H ASP A 36 8.709 -2.292 -0.176 1.00 0.00 H new ATOM 0 HA ASP A 36 10.350 -0.754 -2.083 1.00 0.00 H new ATOM 0 HB2 ASP A 36 10.746 -3.252 -1.244 1.00 0.00 H new ATOM 0 HB3 ASP A 36 9.520 -3.628 -2.438 1.00 0.00 H new ATOM 555 N HIS A 37 8.220 -0.098 -3.264 1.00 0.00 N ATOM 556 CA HIS A 37 7.134 0.226 -4.183 1.00 0.00 C ATOM 557 C HIS A 37 7.673 0.507 -5.582 1.00 0.00 C ATOM 558 O HIS A 37 7.217 1.428 -6.260 1.00 0.00 O ATOM 559 CB HIS A 37 6.350 1.435 -3.673 1.00 0.00 C ATOM 560 CG HIS A 37 7.196 2.434 -2.945 1.00 0.00 C ATOM 561 ND1 HIS A 37 7.425 3.710 -3.416 1.00 0.00 N ATOM 562 CD2 HIS A 37 7.867 2.340 -1.774 1.00 0.00 C ATOM 563 CE1 HIS A 37 8.203 4.357 -2.566 1.00 0.00 C ATOM 564 NE2 HIS A 37 8.485 3.548 -1.560 1.00 0.00 N ATOM 0 H HIS A 37 8.768 0.706 -2.958 1.00 0.00 H new ATOM 0 HA HIS A 37 6.466 -0.634 -4.236 1.00 0.00 H new ATOM 0 HB2 HIS A 37 5.867 1.927 -4.517 1.00 0.00 H new ATOM 0 HB3 HIS A 37 5.557 1.090 -3.009 1.00 0.00 H new ATOM 0 HD2 HIS A 37 7.909 1.476 -1.128 1.00 0.00 H new ATOM 0 HE1 HIS A 37 8.549 5.374 -2.675 1.00 0.00 H new ATOM 0 HE2 HIS A 37 9.067 3.782 -0.756 1.00 0.00 H new ATOM 573 N SER A 38 8.646 -0.291 -6.008 1.00 0.00 N ATOM 574 CA SER A 38 9.250 -0.125 -7.325 1.00 0.00 C ATOM 575 C SER A 38 8.747 -1.192 -8.292 1.00 0.00 C ATOM 576 O SER A 38 8.264 -0.882 -9.382 1.00 0.00 O ATOM 577 CB SER A 38 10.775 -0.192 -7.222 1.00 0.00 C ATOM 578 OG SER A 38 11.298 0.979 -6.620 1.00 0.00 O ATOM 0 H SER A 38 9.033 -1.059 -5.460 1.00 0.00 H new ATOM 0 HA SER A 38 8.961 0.853 -7.709 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.065 -1.065 -6.638 1.00 0.00 H new ATOM 0 HB3 SER A 38 11.205 -0.316 -8.216 1.00 0.00 H new ATOM 0 HG SER A 38 12.274 0.910 -6.564 1.00 0.00 H new ATOM 584 N LYS A 39 8.863 -2.452 -7.886 1.00 0.00 N ATOM 585 CA LYS A 39 8.420 -3.567 -8.714 1.00 0.00 C ATOM 586 C LYS A 39 6.901 -3.704 -8.674 1.00 0.00 C ATOM 587 O LYS A 39 6.254 -3.269 -7.722 1.00 0.00 O ATOM 588 CB LYS A 39 9.073 -4.869 -8.244 1.00 0.00 C ATOM 589 CG LYS A 39 9.012 -5.986 -9.272 1.00 0.00 C ATOM 590 CD LYS A 39 9.656 -7.259 -8.751 1.00 0.00 C ATOM 591 CE LYS A 39 11.174 -7.172 -8.791 1.00 0.00 C ATOM 592 NZ LYS A 39 11.809 -8.518 -8.724 1.00 0.00 N ATOM 0 H LYS A 39 9.261 -2.726 -6.988 1.00 0.00 H new ATOM 0 HA LYS A 39 8.722 -3.367 -9.742 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.116 -4.673 -7.994 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.583 -5.202 -7.329 1.00 0.00 H new ATOM 0 HG2 LYS A 39 7.973 -6.184 -9.534 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.516 -5.669 -10.185 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.328 -7.442 -7.728 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.323 -8.107 -9.349 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.485 -6.669 -9.707 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.525 -6.563 -7.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.844 -8.416 -8.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.533 -8.988 -7.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 11.494 -9.091 -9.533 1.00 0.00 H new ATOM 606 N ARG A 40 6.339 -4.312 -9.714 1.00 0.00 N ATOM 607 CA ARG A 40 4.897 -4.506 -9.797 1.00 0.00 C ATOM 608 C ARG A 40 4.304 -4.777 -8.417 1.00 0.00 C ATOM 609 O ARG A 40 3.275 -4.210 -8.050 1.00 0.00 O ATOM 610 CB ARG A 40 4.570 -5.665 -10.741 1.00 0.00 C ATOM 611 CG ARG A 40 5.103 -5.472 -12.151 1.00 0.00 C ATOM 612 CD ARG A 40 4.092 -4.760 -13.036 1.00 0.00 C ATOM 613 NE ARG A 40 4.711 -4.204 -14.236 1.00 0.00 N ATOM 614 CZ ARG A 40 4.031 -3.577 -15.190 1.00 0.00 C ATOM 615 NH1 ARG A 40 2.718 -3.428 -15.084 1.00 0.00 N ATOM 616 NH2 ARG A 40 4.666 -3.098 -16.252 1.00 0.00 N ATOM 0 H ARG A 40 6.861 -4.678 -10.510 1.00 0.00 H new ATOM 0 HA ARG A 40 4.455 -3.590 -10.190 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.983 -6.586 -10.329 1.00 0.00 H new ATOM 0 HB3 ARG A 40 3.488 -5.792 -10.785 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.027 -4.895 -12.116 1.00 0.00 H new ATOM 0 HG3 ARG A 40 5.348 -6.442 -12.584 1.00 0.00 H new ATOM 0 HD2 ARG A 40 3.307 -5.459 -13.324 1.00 0.00 H new ATOM 0 HD3 ARG A 40 3.615 -3.960 -12.470 1.00 0.00 H new ATOM 0 HE ARG A 40 5.720 -4.302 -14.348 1.00 0.00 H new ATOM 0 HH11 ARG A 40 2.227 -3.795 -14.269 1.00 0.00 H new ATOM 0 HH12 ARG A 40 2.199 -2.946 -15.818 1.00 0.00 H new ATOM 0 HH21 ARG A 40 5.676 -3.211 -16.336 1.00 0.00 H new ATOM 0 HH22 ARG A 40 4.144 -2.617 -16.984 1.00 0.00 H new ATOM 630 N TRP A 41 4.960 -5.648 -7.658 1.00 0.00 N ATOM 631 CA TRP A 41 4.498 -5.994 -6.319 1.00 0.00 C ATOM 632 C TRP A 41 5.096 -5.056 -5.277 1.00 0.00 C ATOM 633 O TRP A 41 6.256 -4.658 -5.381 1.00 0.00 O ATOM 634 CB TRP A 41 4.864 -7.442 -5.990 1.00 0.00 C ATOM 635 CG TRP A 41 3.914 -8.443 -6.574 1.00 0.00 C ATOM 636 CD1 TRP A 41 3.693 -8.686 -7.900 1.00 0.00 C ATOM 637 CD2 TRP A 41 3.055 -9.333 -5.853 1.00 0.00 C ATOM 638 NE1 TRP A 41 2.749 -9.674 -8.046 1.00 0.00 N ATOM 639 CE2 TRP A 41 2.343 -10.088 -6.805 1.00 0.00 C ATOM 640 CE3 TRP A 41 2.821 -9.568 -4.495 1.00 0.00 C ATOM 641 CZ2 TRP A 41 1.412 -11.058 -6.440 1.00 0.00 C ATOM 642 CZ3 TRP A 41 1.898 -10.530 -4.135 1.00 0.00 C ATOM 643 CH2 TRP A 41 1.203 -11.266 -5.104 1.00 0.00 C ATOM 0 H TRP A 41 5.813 -6.127 -7.947 1.00 0.00 H new ATOM 0 HA TRP A 41 3.414 -5.886 -6.297 1.00 0.00 H new ATOM 0 HB2 TRP A 41 5.869 -7.648 -6.359 1.00 0.00 H new ATOM 0 HB3 TRP A 41 4.890 -7.565 -4.907 1.00 0.00 H new ATOM 0 HD1 TRP A 41 4.187 -8.177 -8.714 1.00 0.00 H new ATOM 0 HE1 TRP A 41 2.406 -10.040 -8.934 1.00 0.00 H new ATOM 0 HE3 TRP A 41 3.353 -9.007 -3.741 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.874 -11.626 -7.185 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.709 -10.718 -3.089 1.00 0.00 H new ATOM 0 HH2 TRP A 41 0.488 -12.012 -4.790 1.00 0.00 H new ATOM 654 N TRP A 42 4.299 -4.707 -4.274 1.00 0.00 N ATOM 655 CA TRP A 42 4.751 -3.815 -3.212 1.00 0.00 C ATOM 656 C TRP A 42 5.039 -4.594 -1.933 1.00 0.00 C ATOM 657 O TRP A 42 4.201 -5.361 -1.460 1.00 0.00 O ATOM 658 CB TRP A 42 3.700 -2.737 -2.942 1.00 0.00 C ATOM 659 CG TRP A 42 3.522 -1.782 -4.083 1.00 0.00 C ATOM 660 CD1 TRP A 42 3.760 -2.031 -5.405 1.00 0.00 C ATOM 661 CD2 TRP A 42 3.070 -0.426 -4.004 1.00 0.00 C ATOM 662 NE1 TRP A 42 3.483 -0.911 -6.152 1.00 0.00 N ATOM 663 CE2 TRP A 42 3.057 0.087 -5.315 1.00 0.00 C ATOM 664 CE3 TRP A 42 2.673 0.404 -2.952 1.00 0.00 C ATOM 665 CZ2 TRP A 42 2.664 1.392 -5.600 1.00 0.00 C ATOM 666 CZ3 TRP A 42 2.283 1.699 -3.237 1.00 0.00 C ATOM 667 CH2 TRP A 42 2.280 2.183 -4.552 1.00 0.00 C ATOM 0 H TRP A 42 3.336 -5.028 -4.173 1.00 0.00 H new ATOM 0 HA TRP A 42 5.674 -3.338 -3.540 1.00 0.00 H new ATOM 0 HB2 TRP A 42 2.745 -3.217 -2.727 1.00 0.00 H new ATOM 0 HB3 TRP A 42 3.984 -2.178 -2.051 1.00 0.00 H new ATOM 0 HD1 TRP A 42 4.114 -2.970 -5.804 1.00 0.00 H new ATOM 0 HE1 TRP A 42 3.579 -0.835 -7.165 1.00 0.00 H new ATOM 0 HE3 TRP A 42 2.671 0.040 -1.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 2.662 1.767 -6.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 1.975 2.350 -2.432 1.00 0.00 H new ATOM 0 HH2 TRP A 42 1.969 3.200 -4.742 1.00 0.00 H new ATOM 678 N LEU A 43 6.229 -4.391 -1.378 1.00 0.00 N ATOM 679 CA LEU A 43 6.628 -5.074 -0.153 1.00 0.00 C ATOM 680 C LEU A 43 6.267 -4.245 1.075 1.00 0.00 C ATOM 681 O LEU A 43 6.718 -3.109 1.225 1.00 0.00 O ATOM 682 CB LEU A 43 8.131 -5.356 -0.168 1.00 0.00 C ATOM 683 CG LEU A 43 8.764 -5.700 1.181 1.00 0.00 C ATOM 684 CD1 LEU A 43 8.210 -7.014 1.710 1.00 0.00 C ATOM 685 CD2 LEU A 43 10.279 -5.769 1.057 1.00 0.00 C ATOM 0 H LEU A 43 6.934 -3.759 -1.757 1.00 0.00 H new ATOM 0 HA LEU A 43 6.088 -6.020 -0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.319 -6.181 -0.855 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.640 -4.482 -0.573 1.00 0.00 H new ATOM 0 HG LEU A 43 8.513 -4.911 1.891 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.672 -7.243 2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.131 -6.929 1.837 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.430 -7.813 1.002 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.713 -6.015 2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 43 10.550 -6.537 0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.661 -4.804 0.723 1.00 0.00 H new ATOM 697 N VAL A 44 5.452 -4.821 1.954 1.00 0.00 N ATOM 698 CA VAL A 44 5.033 -4.136 3.171 1.00 0.00 C ATOM 699 C VAL A 44 5.500 -4.887 4.413 1.00 0.00 C ATOM 700 O VAL A 44 6.018 -6.001 4.321 1.00 0.00 O ATOM 701 CB VAL A 44 3.502 -3.976 3.226 1.00 0.00 C ATOM 702 CG1 VAL A 44 2.983 -3.351 1.941 1.00 0.00 C ATOM 703 CG2 VAL A 44 2.836 -5.320 3.482 1.00 0.00 C ATOM 0 H VAL A 44 5.069 -5.760 1.846 1.00 0.00 H new ATOM 0 HA VAL A 44 5.494 -3.148 3.153 1.00 0.00 H new ATOM 0 HB VAL A 44 3.253 -3.309 4.051 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.900 -3.246 1.999 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.436 -2.369 1.805 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.241 -3.989 1.096 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.754 -5.189 3.518 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.091 -6.011 2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.184 -5.724 4.433 1.00 0.00 H new ATOM 713 N LYS A 45 5.313 -4.271 5.575 1.00 0.00 N ATOM 714 CA LYS A 45 5.713 -4.882 6.838 1.00 0.00 C ATOM 715 C LYS A 45 4.614 -4.734 7.885 1.00 0.00 C ATOM 716 O LYS A 45 3.748 -3.868 7.772 1.00 0.00 O ATOM 717 CB LYS A 45 7.008 -4.245 7.348 1.00 0.00 C ATOM 718 CG LYS A 45 7.813 -5.153 8.261 1.00 0.00 C ATOM 719 CD LYS A 45 9.294 -4.813 8.220 1.00 0.00 C ATOM 720 CE LYS A 45 9.657 -3.774 9.271 1.00 0.00 C ATOM 721 NZ LYS A 45 11.122 -3.510 9.307 1.00 0.00 N ATOM 0 H LYS A 45 4.887 -3.349 5.669 1.00 0.00 H new ATOM 0 HA LYS A 45 5.883 -5.944 6.662 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.625 -3.962 6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.765 -3.327 7.884 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.446 -5.061 9.283 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.669 -6.191 7.963 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.881 -5.717 8.383 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.555 -4.438 7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.126 -2.845 9.062 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.326 -4.118 10.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.328 -2.797 10.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 11.628 -4.391 9.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.434 -3.158 8.380 1.00 0.00 H new ATOM 735 N ASN A 46 4.657 -5.585 8.905 1.00 0.00 N ATOM 736 CA ASN A 46 3.665 -5.549 9.973 1.00 0.00 C ATOM 737 C ASN A 46 4.305 -5.137 11.296 1.00 0.00 C ATOM 738 O ASN A 46 5.510 -4.899 11.365 1.00 0.00 O ATOM 739 CB ASN A 46 2.995 -6.916 10.122 1.00 0.00 C ATOM 740 CG ASN A 46 3.982 -8.061 9.999 1.00 0.00 C ATOM 741 OD1 ASN A 46 5.078 -8.012 10.557 1.00 0.00 O ATOM 742 ND2 ASN A 46 3.596 -9.098 9.265 1.00 0.00 N ATOM 0 H ASN A 46 5.368 -6.308 9.014 1.00 0.00 H new ATOM 0 HA ASN A 46 2.910 -4.809 9.709 1.00 0.00 H new ATOM 0 HB2 ASN A 46 2.499 -6.970 11.091 1.00 0.00 H new ATOM 0 HB3 ASN A 46 2.222 -7.023 9.361 1.00 0.00 H new ATOM 0 HD21 ASN A 46 4.218 -9.898 9.145 1.00 0.00 H new ATOM 0 HD22 ASN A 46 2.678 -9.095 8.821 1.00 0.00 H new ATOM 749 N GLU A 47 3.489 -5.055 12.342 1.00 0.00 N ATOM 750 CA GLU A 47 3.976 -4.672 13.662 1.00 0.00 C ATOM 751 C GLU A 47 4.983 -5.691 14.187 1.00 0.00 C ATOM 752 O GLU A 47 5.930 -5.338 14.889 1.00 0.00 O ATOM 753 CB GLU A 47 2.808 -4.540 14.642 1.00 0.00 C ATOM 754 CG GLU A 47 2.254 -5.875 15.111 1.00 0.00 C ATOM 755 CD GLU A 47 1.339 -5.737 16.313 1.00 0.00 C ATOM 756 OE1 GLU A 47 0.579 -4.747 16.369 1.00 0.00 O ATOM 757 OE2 GLU A 47 1.384 -6.617 17.197 1.00 0.00 O ATOM 0 H GLU A 47 2.488 -5.249 12.301 1.00 0.00 H new ATOM 0 HA GLU A 47 4.476 -3.707 13.572 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.135 -3.967 15.509 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.009 -3.971 14.167 1.00 0.00 H new ATOM 0 HG2 GLU A 47 1.706 -6.344 14.294 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.081 -6.539 15.363 1.00 0.00 H new ATOM 764 N ALA A 48 4.769 -6.957 13.843 1.00 0.00 N ATOM 765 CA ALA A 48 5.658 -8.027 14.278 1.00 0.00 C ATOM 766 C ALA A 48 7.044 -7.875 13.660 1.00 0.00 C ATOM 767 O ALA A 48 8.050 -8.234 14.271 1.00 0.00 O ATOM 768 CB ALA A 48 5.065 -9.383 13.922 1.00 0.00 C ATOM 0 H ALA A 48 3.988 -7.266 13.265 1.00 0.00 H new ATOM 0 HA ALA A 48 5.763 -7.961 15.361 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.739 -10.173 14.253 1.00 0.00 H new ATOM 0 HB2 ALA A 48 4.100 -9.499 14.416 1.00 0.00 H new ATOM 0 HB3 ALA A 48 4.930 -9.449 12.842 1.00 0.00 H new ATOM 774 N GLY A 49 7.089 -7.341 12.443 1.00 0.00 N ATOM 775 CA GLY A 49 8.357 -7.153 11.762 1.00 0.00 C ATOM 776 C GLY A 49 8.433 -7.918 10.456 1.00 0.00 C ATOM 777 O GLY A 49 9.276 -7.627 9.607 1.00 0.00 O ATOM 0 H GLY A 49 6.270 -7.035 11.917 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.507 -6.091 11.567 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.168 -7.475 12.415 1.00 0.00 H new ATOM 781 N ARG A 50 7.552 -8.899 10.294 1.00 0.00 N ATOM 782 CA ARG A 50 7.525 -9.710 9.083 1.00 0.00 C ATOM 783 C ARG A 50 7.006 -8.901 7.898 1.00 0.00 C ATOM 784 O ARG A 50 5.926 -8.314 7.960 1.00 0.00 O ATOM 785 CB ARG A 50 6.650 -10.948 9.292 1.00 0.00 C ATOM 786 CG ARG A 50 7.393 -12.122 9.907 1.00 0.00 C ATOM 787 CD ARG A 50 6.670 -13.435 9.648 1.00 0.00 C ATOM 788 NE ARG A 50 7.091 -14.055 8.395 1.00 0.00 N ATOM 789 CZ ARG A 50 6.916 -15.341 8.116 1.00 0.00 C ATOM 790 NH1 ARG A 50 6.330 -16.141 8.996 1.00 0.00 N ATOM 791 NH2 ARG A 50 7.327 -15.831 6.953 1.00 0.00 N ATOM 0 H ARG A 50 6.847 -9.152 10.986 1.00 0.00 H new ATOM 0 HA ARG A 50 8.545 -10.027 8.865 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.810 -10.684 9.934 1.00 0.00 H new ATOM 0 HB3 ARG A 50 6.234 -11.255 8.332 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.401 -12.173 9.495 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.495 -11.967 10.981 1.00 0.00 H new ATOM 0 HD2 ARG A 50 6.859 -14.122 10.473 1.00 0.00 H new ATOM 0 HD3 ARG A 50 5.595 -13.257 9.621 1.00 0.00 H new ATOM 0 HE ARG A 50 7.545 -13.468 7.695 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.012 -15.769 9.891 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.197 -17.129 8.778 1.00 0.00 H new ATOM 0 HH21 ARG A 50 7.778 -15.219 6.273 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.192 -16.819 6.740 1.00 0.00 H new ATOM 805 N SER A 51 7.784 -8.874 6.821 1.00 0.00 N ATOM 806 CA SER A 51 7.406 -8.133 5.623 1.00 0.00 C ATOM 807 C SER A 51 7.255 -9.071 4.429 1.00 0.00 C ATOM 808 O SER A 51 8.101 -9.933 4.192 1.00 0.00 O ATOM 809 CB SER A 51 8.448 -7.057 5.313 1.00 0.00 C ATOM 810 OG SER A 51 9.758 -7.596 5.329 1.00 0.00 O ATOM 0 H SER A 51 8.680 -9.357 6.753 1.00 0.00 H new ATOM 0 HA SER A 51 6.445 -7.654 5.810 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.244 -6.619 4.336 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.373 -6.253 6.045 1.00 0.00 H new ATOM 0 HG SER A 51 10.405 -6.889 5.126 1.00 0.00 H new ATOM 816 N GLY A 52 6.171 -8.895 3.679 1.00 0.00 N ATOM 817 CA GLY A 52 5.929 -9.732 2.519 1.00 0.00 C ATOM 818 C GLY A 52 5.497 -8.931 1.307 1.00 0.00 C ATOM 819 O GLY A 52 5.047 -7.792 1.434 1.00 0.00 O ATOM 0 H GLY A 52 5.457 -8.188 3.854 1.00 0.00 H new ATOM 0 HA2 GLY A 52 6.836 -10.287 2.280 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.160 -10.466 2.759 1.00 0.00 H new ATOM 823 N TYR A 53 5.634 -9.526 0.127 1.00 0.00 N ATOM 824 CA TYR A 53 5.259 -8.859 -1.114 1.00 0.00 C ATOM 825 C TYR A 53 3.773 -9.049 -1.407 1.00 0.00 C ATOM 826 O TYR A 53 3.314 -10.168 -1.639 1.00 0.00 O ATOM 827 CB TYR A 53 6.092 -9.396 -2.279 1.00 0.00 C ATOM 828 CG TYR A 53 7.576 -9.147 -2.127 1.00 0.00 C ATOM 829 CD1 TYR A 53 8.148 -7.958 -2.559 1.00 0.00 C ATOM 830 CD2 TYR A 53 8.405 -10.103 -1.552 1.00 0.00 C ATOM 831 CE1 TYR A 53 9.504 -7.726 -2.423 1.00 0.00 C ATOM 832 CE2 TYR A 53 9.761 -9.879 -1.411 1.00 0.00 C ATOM 833 CZ TYR A 53 10.306 -8.690 -1.848 1.00 0.00 C ATOM 834 OH TYR A 53 11.656 -8.464 -1.710 1.00 0.00 O ATOM 0 H TYR A 53 6.002 -10.469 0.004 1.00 0.00 H new ATOM 0 HA TYR A 53 5.455 -7.793 -0.997 1.00 0.00 H new ATOM 0 HB2 TYR A 53 5.920 -10.468 -2.374 1.00 0.00 H new ATOM 0 HB3 TYR A 53 5.747 -8.934 -3.204 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.523 -7.201 -3.009 1.00 0.00 H new ATOM 0 HD2 TYR A 53 7.982 -11.036 -1.210 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.933 -6.796 -2.765 1.00 0.00 H new ATOM 0 HE2 TYR A 53 10.391 -10.632 -0.961 1.00 0.00 H new ATOM 0 HH TYR A 53 12.076 -9.241 -1.285 1.00 0.00 H new ATOM 844 N ILE A 54 3.029 -7.949 -1.394 1.00 0.00 N ATOM 845 CA ILE A 54 1.597 -7.993 -1.660 1.00 0.00 C ATOM 846 C ILE A 54 1.248 -7.218 -2.926 1.00 0.00 C ATOM 847 O ILE A 54 1.926 -6.263 -3.306 1.00 0.00 O ATOM 848 CB ILE A 54 0.788 -7.419 -0.481 1.00 0.00 C ATOM 849 CG1 ILE A 54 1.143 -5.948 -0.259 1.00 0.00 C ATOM 850 CG2 ILE A 54 1.044 -8.229 0.781 1.00 0.00 C ATOM 851 CD1 ILE A 54 0.111 -5.192 0.548 1.00 0.00 C ATOM 0 H ILE A 54 3.394 -7.016 -1.202 1.00 0.00 H new ATOM 0 HA ILE A 54 1.334 -9.042 -1.795 1.00 0.00 H new ATOM 0 HB ILE A 54 -0.273 -7.484 -0.721 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.105 -5.888 0.249 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.263 -5.462 -1.227 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.466 -7.811 1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.745 -9.264 0.616 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.105 -8.193 1.028 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.429 -4.156 0.666 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.848 -5.221 0.031 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.008 -5.654 1.530 1.00 0.00 H new ATOM 863 N PRO A 55 0.164 -7.636 -3.596 1.00 0.00 N ATOM 864 CA PRO A 55 -0.301 -6.994 -4.829 1.00 0.00 C ATOM 865 C PRO A 55 -0.872 -5.603 -4.578 1.00 0.00 C ATOM 866 O PRO A 55 -1.878 -5.450 -3.885 1.00 0.00 O ATOM 867 CB PRO A 55 -1.396 -7.939 -5.330 1.00 0.00 C ATOM 868 CG PRO A 55 -1.884 -8.635 -4.107 1.00 0.00 C ATOM 869 CD PRO A 55 -0.691 -8.768 -3.202 1.00 0.00 C ATOM 0 HA PRO A 55 0.510 -6.844 -5.541 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -2.200 -7.389 -5.820 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -1.004 -8.648 -6.059 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -2.678 -8.065 -3.624 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -2.298 -9.613 -4.353 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -0.975 -8.710 -2.151 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -0.184 -9.723 -3.343 1.00 0.00 H new ATOM 877 N SER A 56 -0.224 -4.590 -5.146 1.00 0.00 N ATOM 878 CA SER A 56 -0.666 -3.211 -4.980 1.00 0.00 C ATOM 879 C SER A 56 -2.173 -3.094 -5.189 1.00 0.00 C ATOM 880 O SER A 56 -2.805 -2.150 -4.719 1.00 0.00 O ATOM 881 CB SER A 56 0.068 -2.296 -5.962 1.00 0.00 C ATOM 882 OG SER A 56 -0.396 -2.492 -7.287 1.00 0.00 O ATOM 0 H SER A 56 0.609 -4.699 -5.725 1.00 0.00 H new ATOM 0 HA SER A 56 -0.433 -2.901 -3.961 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.078 -1.255 -5.673 1.00 0.00 H new ATOM 0 HB3 SER A 56 1.139 -2.493 -5.916 1.00 0.00 H new ATOM 0 HG SER A 56 0.088 -1.894 -7.895 1.00 0.00 H new ATOM 888 N ASN A 57 -2.742 -4.063 -5.900 1.00 0.00 N ATOM 889 CA ASN A 57 -4.175 -4.070 -6.173 1.00 0.00 C ATOM 890 C ASN A 57 -4.976 -3.993 -4.877 1.00 0.00 C ATOM 891 O ASN A 57 -6.000 -3.313 -4.807 1.00 0.00 O ATOM 892 CB ASN A 57 -4.561 -5.330 -6.950 1.00 0.00 C ATOM 893 CG ASN A 57 -4.064 -5.300 -8.383 1.00 0.00 C ATOM 894 OD1 ASN A 57 -3.993 -4.240 -9.005 1.00 0.00 O ATOM 895 ND2 ASN A 57 -3.718 -6.467 -8.914 1.00 0.00 N ATOM 0 H ASN A 57 -2.233 -4.853 -6.297 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.409 -3.193 -6.777 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -4.152 -6.205 -6.445 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -5.646 -5.438 -6.947 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -3.377 -6.509 -9.874 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -3.793 -7.321 -8.361 1.00 0.00 H new ATOM 902 N ILE A 58 -4.502 -4.695 -3.852 1.00 0.00 N ATOM 903 CA ILE A 58 -5.173 -4.705 -2.558 1.00 0.00 C ATOM 904 C ILE A 58 -4.604 -3.632 -1.636 1.00 0.00 C ATOM 905 O ILE A 58 -4.648 -3.763 -0.412 1.00 0.00 O ATOM 906 CB ILE A 58 -5.048 -6.077 -1.870 1.00 0.00 C ATOM 907 CG1 ILE A 58 -3.610 -6.308 -1.402 1.00 0.00 C ATOM 908 CG2 ILE A 58 -5.488 -7.185 -2.815 1.00 0.00 C ATOM 909 CD1 ILE A 58 -3.467 -7.461 -0.434 1.00 0.00 C ATOM 0 H ILE A 58 -3.656 -5.264 -3.893 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.226 -4.497 -2.747 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.701 -6.090 -0.997 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.979 -6.494 -2.271 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.240 -5.399 -0.928 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -5.394 -8.149 -2.315 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -6.527 -7.026 -3.104 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.859 -7.175 -3.705 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -2.421 -7.566 -0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.071 -7.269 0.453 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.806 -8.381 -0.911 1.00 0.00 H new ATOM 921 N LEU A 59 -4.072 -2.570 -2.230 1.00 0.00 N ATOM 922 CA LEU A 59 -3.495 -1.472 -1.462 1.00 0.00 C ATOM 923 C LEU A 59 -4.131 -0.141 -1.852 1.00 0.00 C ATOM 924 O LEU A 59 -4.183 0.211 -3.030 1.00 0.00 O ATOM 925 CB LEU A 59 -1.982 -1.410 -1.680 1.00 0.00 C ATOM 926 CG LEU A 59 -1.144 -2.379 -0.846 1.00 0.00 C ATOM 927 CD1 LEU A 59 0.337 -2.070 -0.998 1.00 0.00 C ATOM 928 CD2 LEU A 59 -1.556 -2.316 0.618 1.00 0.00 C ATOM 0 H LEU A 59 -4.028 -2.446 -3.241 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.697 -1.655 -0.407 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.779 -1.600 -2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.646 -0.395 -1.468 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.323 -3.391 -1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.918 -2.770 -0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.623 -2.166 -2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.533 -1.052 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.949 -3.012 1.197 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.407 -1.304 0.995 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.608 -2.586 0.712 1.00 0.00 H new ATOM 940 N GLU A 60 -4.613 0.594 -0.855 1.00 0.00 N ATOM 941 CA GLU A 60 -5.244 1.886 -1.095 1.00 0.00 C ATOM 942 C GLU A 60 -4.531 2.992 -0.321 1.00 0.00 C ATOM 943 O GLU A 60 -3.869 2.750 0.688 1.00 0.00 O ATOM 944 CB GLU A 60 -6.720 1.839 -0.695 1.00 0.00 C ATOM 945 CG GLU A 60 -7.596 1.094 -1.688 1.00 0.00 C ATOM 946 CD GLU A 60 -7.158 1.304 -3.125 1.00 0.00 C ATOM 947 OE1 GLU A 60 -7.202 2.459 -3.596 1.00 0.00 O ATOM 948 OE2 GLU A 60 -6.771 0.312 -3.777 1.00 0.00 O ATOM 0 H GLU A 60 -4.579 0.317 0.126 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.170 2.106 -2.160 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.808 1.364 0.282 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.092 2.858 -0.589 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.575 0.029 -1.458 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.629 1.424 -1.575 1.00 0.00 H new ATOM 955 N PRO A 61 -4.669 4.235 -0.806 1.00 0.00 N ATOM 956 CA PRO A 61 -4.046 5.403 -0.176 1.00 0.00 C ATOM 957 C PRO A 61 -4.685 5.749 1.165 1.00 0.00 C ATOM 958 O PRO A 61 -5.582 6.590 1.238 1.00 0.00 O ATOM 959 CB PRO A 61 -4.289 6.524 -1.190 1.00 0.00 C ATOM 960 CG PRO A 61 -5.502 6.098 -1.942 1.00 0.00 C ATOM 961 CD PRO A 61 -5.444 4.596 -2.004 1.00 0.00 C ATOM 0 HA PRO A 61 -2.993 5.232 0.048 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -4.448 7.481 -0.692 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -3.434 6.648 -1.855 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -6.410 6.433 -1.441 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -5.513 6.530 -2.943 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -6.440 4.154 -1.986 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -4.958 4.250 -2.916 1.00 0.00 H new ATOM 969 N LEU A 62 -4.217 5.097 2.223 1.00 0.00 N ATOM 970 CA LEU A 62 -4.743 5.336 3.563 1.00 0.00 C ATOM 971 C LEU A 62 -4.373 6.733 4.052 1.00 0.00 C ATOM 972 O LEU A 62 -5.235 7.499 4.482 1.00 0.00 O ATOM 973 CB LEU A 62 -4.210 4.284 4.537 1.00 0.00 C ATOM 974 CG LEU A 62 -4.325 4.626 6.023 1.00 0.00 C ATOM 975 CD1 LEU A 62 -5.727 4.331 6.532 1.00 0.00 C ATOM 976 CD2 LEU A 62 -3.290 3.855 6.829 1.00 0.00 C ATOM 0 H LEU A 62 -3.475 4.399 2.180 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.830 5.263 3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.741 3.349 4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.160 4.103 4.306 1.00 0.00 H new ATOM 0 HG LEU A 62 -4.133 5.692 6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.790 4.581 7.591 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.449 4.928 5.975 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.949 3.273 6.395 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.386 4.111 7.884 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.451 2.785 6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.290 4.116 6.482 1.00 0.00 H new ATOM 988 N SER A 63 -3.086 7.057 3.980 1.00 0.00 N ATOM 989 CA SER A 63 -2.601 8.361 4.417 1.00 0.00 C ATOM 990 C SER A 63 -2.680 9.378 3.282 1.00 0.00 C ATOM 991 O SER A 63 -2.146 9.155 2.196 1.00 0.00 O ATOM 992 CB SER A 63 -1.160 8.251 4.919 1.00 0.00 C ATOM 993 OG SER A 63 -1.077 7.395 6.046 1.00 0.00 O ATOM 0 H SER A 63 -2.361 6.435 3.623 1.00 0.00 H new ATOM 0 HA SER A 63 -3.237 8.703 5.233 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.522 7.871 4.122 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.786 9.241 5.182 1.00 0.00 H new ATOM 0 HG SER A 63 -0.184 7.463 6.443 1.00 0.00 H new ATOM 999 N GLY A 64 -3.350 10.496 3.543 1.00 0.00 N ATOM 1000 CA GLY A 64 -3.487 11.531 2.535 1.00 0.00 C ATOM 1001 C GLY A 64 -3.049 12.892 3.038 1.00 0.00 C ATOM 1002 O GLY A 64 -2.990 13.143 4.242 1.00 0.00 O ATOM 0 H GLY A 64 -3.800 10.704 4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.895 11.263 1.660 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -4.527 11.584 2.212 1.00 0.00 H new ATOM 1006 N PRO A 65 -2.730 13.799 2.102 1.00 0.00 N ATOM 1007 CA PRO A 65 -2.288 15.157 2.434 1.00 0.00 C ATOM 1008 C PRO A 65 -3.413 16.007 3.014 1.00 0.00 C ATOM 1009 O PRO A 65 -4.519 16.042 2.475 1.00 0.00 O ATOM 1010 CB PRO A 65 -1.833 15.721 1.086 1.00 0.00 C ATOM 1011 CG PRO A 65 -2.602 14.946 0.072 1.00 0.00 C ATOM 1012 CD PRO A 65 -2.777 13.569 0.649 1.00 0.00 C ATOM 0 HA PRO A 65 -1.509 15.157 3.197 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.043 16.788 1.012 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.759 15.598 0.947 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.567 15.412 -0.125 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.067 14.906 -0.877 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -3.723 13.123 0.343 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.986 12.893 0.323 1.00 0.00 H new ATOM 1020 N SER A 66 -3.124 16.691 4.117 1.00 0.00 N ATOM 1021 CA SER A 66 -4.112 17.539 4.772 1.00 0.00 C ATOM 1022 C SER A 66 -3.845 19.012 4.479 1.00 0.00 C ATOM 1023 O SER A 66 -3.078 19.668 5.183 1.00 0.00 O ATOM 1024 CB SER A 66 -4.100 17.298 6.283 1.00 0.00 C ATOM 1025 OG SER A 66 -4.517 15.979 6.593 1.00 0.00 O ATOM 0 H SER A 66 -2.213 16.674 4.575 1.00 0.00 H new ATOM 0 HA SER A 66 -5.095 17.281 4.377 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.096 17.467 6.673 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.758 18.015 6.774 1.00 0.00 H new ATOM 0 HG SER A 66 -4.499 15.850 7.564 1.00 0.00 H new ATOM 1031 N SER A 67 -4.484 19.526 3.433 1.00 0.00 N ATOM 1032 CA SER A 67 -4.314 20.920 3.042 1.00 0.00 C ATOM 1033 C SER A 67 -4.277 21.827 4.268 1.00 0.00 C ATOM 1034 O SER A 67 -5.258 21.939 5.002 1.00 0.00 O ATOM 1035 CB SER A 67 -5.446 21.352 2.108 1.00 0.00 C ATOM 1036 OG SER A 67 -5.353 22.732 1.799 1.00 0.00 O ATOM 0 H SER A 67 -5.125 18.997 2.841 1.00 0.00 H new ATOM 0 HA SER A 67 -3.364 21.011 2.515 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.407 20.767 1.189 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.408 21.145 2.577 1.00 0.00 H new ATOM 0 HG SER A 67 -6.087 22.983 1.200 1.00 0.00 H new ATOM 1042 N GLY A 68 -3.135 22.474 4.483 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.990 23.363 5.621 1.00 0.00 C ATOM 1044 C GLY A 68 -4.049 24.448 5.648 1.00 0.00 C ATOM 1045 O GLY A 68 -4.645 24.768 4.620 1.00 0.00 O ATOM 0 H GLY A 68 -2.309 22.398 3.890 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.046 22.782 6.541 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -2.003 23.824 5.595 1.00 0.00 H new TER 1049 GLY A 68