USER MOD reduce.3.24.130724 H: found=0, std=0, add=502, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 501 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 93 TYR OH : rot 180:sc= 0.0742 USER MOD Set 1.2: A 97 LYS NZ :NH3+ 149:sc= 0.0551 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0.0155 K(o=0.016,f=-2.2!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 86:sc= 1.11 USER MOD Single : A 58 SER OG : rot 82:sc= 0.326 USER MOD Single : A 63 ASN : amide:sc= 0.917 K(o=0.92,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.264 X(o=-0.26,f=-0.0074) USER MOD Single : A 74 ASN : amide:sc= -0.0145 K(o=-0.015,f=-0.9) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= 0.627 K(o=0.63,f=-2.2!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -0.0183 K(o=-0.018,f=-0.92) USER MOD Single : A 85 ASN : amide:sc= -0.297 X(o=-0.3,f=-0.3) USER MOD Single : A 87 ASN : amide:sc= -0.0873 X(o=-0.087,f=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -0.854 K(o=-0.85,f=-3) USER MOD Single : A 94 TYR OH : rot 30:sc= -0.687 USER MOD Single : A 96 HIS : no HD1:sc= -0.0425 X(o=-0.042,f=-0.33) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -178:sc= -0.0256 (180deg=-0.0319) USER MOD Single : A 105 LYS NZ :NH3+ -126:sc= 0.065 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 47 -2.657 13.898 -3.717 1.00 0.00 N ATOM 2 CA GLY A 47 -1.217 13.899 -3.455 1.00 0.00 C ATOM 3 C GLY A 47 -0.691 12.494 -3.606 1.00 0.00 C ATOM 4 O GLY A 47 -0.938 11.670 -2.731 1.00 0.00 O ATOM 0 HA2 GLY A 47 -0.708 14.568 -4.149 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -1.017 14.270 -2.450 1.00 0.00 H new ATOM 8 N GLU A 48 0.042 12.255 -4.694 1.00 0.00 N ATOM 9 CA GLU A 48 0.681 11.022 -5.148 1.00 0.00 C ATOM 10 C GLU A 48 0.826 9.902 -4.139 1.00 0.00 C ATOM 11 O GLU A 48 0.357 8.802 -4.404 1.00 0.00 O ATOM 12 CB GLU A 48 2.070 11.360 -5.686 1.00 0.00 C ATOM 13 CG GLU A 48 2.793 10.141 -6.282 1.00 0.00 C ATOM 14 CD GLU A 48 2.310 9.758 -7.697 1.00 0.00 C ATOM 15 OE1 GLU A 48 1.294 10.328 -8.176 1.00 0.00 O ATOM 16 OE2 GLU A 48 2.875 8.831 -8.312 1.00 0.00 O ATOM 0 H GLU A 48 0.222 13.011 -5.355 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.003 10.630 -5.901 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.980 12.132 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.675 11.777 -4.881 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.863 10.347 -6.317 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.654 9.288 -5.618 1.00 0.00 H new ATOM 23 N VAL A 49 1.546 10.141 -3.047 1.00 0.00 N ATOM 24 CA VAL A 49 1.774 9.148 -2.012 1.00 0.00 C ATOM 25 C VAL A 49 0.452 8.490 -1.612 1.00 0.00 C ATOM 26 O VAL A 49 0.380 7.273 -1.533 1.00 0.00 O ATOM 27 CB VAL A 49 2.605 9.750 -0.880 1.00 0.00 C ATOM 28 CG1 VAL A 49 2.062 11.091 -0.398 1.00 0.00 C ATOM 29 CG2 VAL A 49 2.804 8.748 0.257 1.00 0.00 C ATOM 0 H VAL A 49 1.990 11.039 -2.857 1.00 0.00 H new ATOM 0 HA VAL A 49 2.382 8.322 -2.381 1.00 0.00 H new ATOM 0 HB VAL A 49 3.592 9.968 -1.289 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.692 11.471 0.406 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.061 11.802 -1.225 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.044 10.961 -0.031 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.399 9.207 1.046 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.834 8.455 0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.321 7.866 -0.121 1.00 0.00 H new ATOM 39 N ARG A 50 -0.613 9.256 -1.381 1.00 0.00 N ATOM 40 CA ARG A 50 -1.908 8.665 -1.036 1.00 0.00 C ATOM 41 C ARG A 50 -2.401 7.796 -2.196 1.00 0.00 C ATOM 42 O ARG A 50 -2.917 6.710 -1.943 1.00 0.00 O ATOM 43 CB ARG A 50 -2.987 9.708 -0.761 1.00 0.00 C ATOM 44 CG ARG A 50 -2.862 10.430 0.584 1.00 0.00 C ATOM 45 CD ARG A 50 -4.215 11.104 0.825 1.00 0.00 C ATOM 46 NE ARG A 50 -4.317 11.887 2.064 1.00 0.00 N ATOM 47 CZ ARG A 50 -3.918 13.155 2.209 1.00 0.00 C ATOM 48 NH1 ARG A 50 -3.105 13.713 1.315 1.00 0.00 N ATOM 49 NH2 ARG A 50 -4.350 13.847 3.248 1.00 0.00 N ATOM 0 H ARG A 50 -0.608 10.275 -1.425 1.00 0.00 H new ATOM 0 HA ARG A 50 -1.746 8.085 -0.128 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.965 10.451 -1.558 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.961 9.221 -0.806 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.627 9.728 1.384 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.058 11.166 0.559 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.430 11.760 -0.018 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.988 10.335 0.836 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.724 11.427 2.878 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -2.782 13.173 0.512 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -2.805 14.681 1.433 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -4.978 13.413 3.924 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.055 14.815 3.374 1.00 0.00 H new ATOM 63 N ASN A 51 -2.245 8.270 -3.439 1.00 0.00 N ATOM 64 CA ASN A 51 -2.686 7.565 -4.642 1.00 0.00 C ATOM 65 C ASN A 51 -2.016 6.194 -4.724 1.00 0.00 C ATOM 66 O ASN A 51 -2.694 5.176 -4.839 1.00 0.00 O ATOM 67 CB ASN A 51 -2.420 8.362 -5.942 1.00 0.00 C ATOM 68 CG ASN A 51 -3.054 9.752 -6.016 1.00 0.00 C ATOM 69 OD1 ASN A 51 -2.907 10.581 -5.119 1.00 0.00 O ATOM 70 ND2 ASN A 51 -3.710 10.074 -7.118 1.00 0.00 N ATOM 0 H ASN A 51 -1.802 9.167 -3.636 1.00 0.00 H new ATOM 0 HA ASN A 51 -3.766 7.447 -4.558 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -1.342 8.469 -6.066 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -2.781 7.774 -6.786 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -4.096 11.012 -7.226 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -3.830 9.384 -7.860 1.00 0.00 H new ATOM 77 N ILE A 52 -0.681 6.149 -4.681 1.00 0.00 N ATOM 78 CA ILE A 52 0.071 4.899 -4.743 1.00 0.00 C ATOM 79 C ILE A 52 -0.211 4.038 -3.514 1.00 0.00 C ATOM 80 O ILE A 52 -0.196 2.817 -3.643 1.00 0.00 O ATOM 81 CB ILE A 52 1.587 5.160 -4.909 1.00 0.00 C ATOM 82 CG1 ILE A 52 2.384 3.865 -5.157 1.00 0.00 C ATOM 83 CG2 ILE A 52 2.180 5.840 -3.676 1.00 0.00 C ATOM 84 CD1 ILE A 52 3.738 4.110 -5.836 1.00 0.00 C ATOM 0 H ILE A 52 -0.094 6.980 -4.602 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.262 4.350 -5.624 1.00 0.00 H new ATOM 0 HB ILE A 52 1.673 5.811 -5.779 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.548 3.359 -4.206 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.790 3.193 -5.777 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.246 6.007 -3.830 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.683 6.796 -3.513 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.035 5.203 -2.804 1.00 0.00 H new ATOM 0 HD11 ILE A 52 4.249 3.158 -5.982 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.579 4.589 -6.802 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.349 4.757 -5.207 1.00 0.00 H new ATOM 96 N VAL A 53 -0.460 4.640 -2.344 1.00 0.00 N ATOM 97 CA VAL A 53 -0.725 3.920 -1.116 1.00 0.00 C ATOM 98 C VAL A 53 -2.005 3.133 -1.316 1.00 0.00 C ATOM 99 O VAL A 53 -1.985 1.920 -1.158 1.00 0.00 O ATOM 100 CB VAL A 53 -0.774 4.903 0.076 1.00 0.00 C ATOM 101 CG1 VAL A 53 -1.618 4.414 1.258 1.00 0.00 C ATOM 102 CG2 VAL A 53 0.641 5.260 0.561 1.00 0.00 C ATOM 0 H VAL A 53 -0.481 5.654 -2.234 1.00 0.00 H new ATOM 0 HA VAL A 53 0.071 3.215 -0.876 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.268 5.793 -0.313 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.600 5.161 2.052 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.646 4.257 0.931 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.209 3.476 1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.574 5.953 1.400 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.156 4.354 0.879 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.197 5.727 -0.252 1.00 0.00 H new ATOM 112 N ASP A 54 -3.099 3.799 -1.676 1.00 0.00 N ATOM 113 CA ASP A 54 -4.379 3.139 -1.881 1.00 0.00 C ATOM 114 C ASP A 54 -4.327 2.114 -3.008 1.00 0.00 C ATOM 115 O ASP A 54 -4.797 0.991 -2.825 1.00 0.00 O ATOM 116 CB ASP A 54 -5.508 4.162 -1.985 1.00 0.00 C ATOM 117 CG ASP A 54 -5.766 4.810 -3.341 1.00 0.00 C ATOM 118 OD1 ASP A 54 -6.353 4.172 -4.239 1.00 0.00 O ATOM 119 OD2 ASP A 54 -5.591 6.046 -3.416 1.00 0.00 O ATOM 0 H ASP A 54 -3.120 4.807 -1.832 1.00 0.00 H new ATOM 0 HA ASP A 54 -4.610 2.542 -0.999 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -6.430 3.675 -1.667 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -5.304 4.958 -1.268 1.00 0.00 H new ATOM 124 N LYS A 55 -3.674 2.426 -4.127 1.00 0.00 N ATOM 125 CA LYS A 55 -3.569 1.490 -5.239 1.00 0.00 C ATOM 126 C LYS A 55 -2.753 0.269 -4.827 1.00 0.00 C ATOM 127 O LYS A 55 -3.142 -0.863 -5.130 1.00 0.00 O ATOM 128 CB LYS A 55 -2.951 2.208 -6.433 1.00 0.00 C ATOM 129 CG LYS A 55 -4.025 3.052 -7.129 1.00 0.00 C ATOM 130 CD LYS A 55 -3.436 3.967 -8.206 1.00 0.00 C ATOM 131 CE LYS A 55 -2.752 3.143 -9.303 1.00 0.00 C ATOM 132 NZ LYS A 55 -2.197 3.997 -10.364 1.00 0.00 N ATOM 0 H LYS A 55 -3.211 3.321 -4.285 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.559 1.133 -5.524 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.129 2.844 -6.104 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.533 1.483 -7.131 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -4.766 2.393 -7.581 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.547 3.657 -6.387 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -4.226 4.578 -8.643 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.716 4.650 -7.756 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.954 2.545 -8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -3.471 2.447 -9.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.743 3.402 -11.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.962 4.549 -10.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -1.493 4.644 -9.956 1.00 0.00 H new ATOM 146 N THR A 56 -1.620 0.467 -4.156 1.00 0.00 N ATOM 147 CA THR A 56 -0.791 -0.638 -3.692 1.00 0.00 C ATOM 148 C THR A 56 -1.599 -1.445 -2.663 1.00 0.00 C ATOM 149 O THR A 56 -1.643 -2.673 -2.750 1.00 0.00 O ATOM 150 CB THR A 56 0.549 -0.100 -3.165 1.00 0.00 C ATOM 151 OG1 THR A 56 1.196 0.567 -4.226 1.00 0.00 O ATOM 152 CG2 THR A 56 1.476 -1.222 -2.687 1.00 0.00 C ATOM 0 H THR A 56 -1.255 1.390 -3.921 1.00 0.00 H new ATOM 0 HA THR A 56 -0.531 -1.319 -4.502 1.00 0.00 H new ATOM 0 HB THR A 56 0.342 0.557 -2.321 1.00 0.00 H new ATOM 0 HG1 THR A 56 0.884 1.495 -4.268 1.00 0.00 H new ATOM 0 HG21 THR A 56 2.410 -0.793 -2.324 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.993 -1.774 -1.881 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.686 -1.898 -3.516 1.00 0.00 H new ATOM 160 N ALA A 57 -2.293 -0.766 -1.743 1.00 0.00 N ATOM 161 CA ALA A 57 -3.101 -1.383 -0.703 1.00 0.00 C ATOM 162 C ALA A 57 -4.191 -2.258 -1.308 1.00 0.00 C ATOM 163 O ALA A 57 -4.410 -3.344 -0.795 1.00 0.00 O ATOM 164 CB ALA A 57 -3.695 -0.327 0.232 1.00 0.00 C ATOM 0 H ALA A 57 -2.304 0.253 -1.706 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.450 -2.024 -0.108 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.294 -0.817 1.000 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.889 0.235 0.704 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.325 0.353 -0.341 1.00 0.00 H new ATOM 170 N SER A 58 -4.824 -1.833 -2.403 1.00 0.00 N ATOM 171 CA SER A 58 -5.864 -2.565 -3.110 1.00 0.00 C ATOM 172 C SER A 58 -5.314 -3.939 -3.504 1.00 0.00 C ATOM 173 O SER A 58 -5.880 -4.978 -3.174 1.00 0.00 O ATOM 174 CB SER A 58 -6.255 -1.763 -4.365 1.00 0.00 C ATOM 175 OG SER A 58 -7.314 -2.363 -5.077 1.00 0.00 O ATOM 0 H SER A 58 -4.614 -0.933 -2.835 1.00 0.00 H new ATOM 0 HA SER A 58 -6.744 -2.701 -2.481 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.543 -0.753 -4.073 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.388 -1.670 -5.019 1.00 0.00 H new ATOM 0 HG SER A 58 -8.167 -2.125 -4.657 1.00 0.00 H new ATOM 181 N PHE A 59 -4.163 -3.964 -4.177 1.00 0.00 N ATOM 182 CA PHE A 59 -3.547 -5.207 -4.614 1.00 0.00 C ATOM 183 C PHE A 59 -3.190 -6.098 -3.427 1.00 0.00 C ATOM 184 O PHE A 59 -3.400 -7.307 -3.499 1.00 0.00 O ATOM 185 CB PHE A 59 -2.340 -4.875 -5.480 1.00 0.00 C ATOM 186 CG PHE A 59 -1.810 -6.050 -6.271 1.00 0.00 C ATOM 187 CD1 PHE A 59 -2.366 -6.345 -7.530 1.00 0.00 C ATOM 188 CD2 PHE A 59 -0.782 -6.859 -5.753 1.00 0.00 C ATOM 189 CE1 PHE A 59 -1.879 -7.427 -8.281 1.00 0.00 C ATOM 190 CE2 PHE A 59 -0.311 -7.951 -6.502 1.00 0.00 C ATOM 191 CZ PHE A 59 -0.850 -8.233 -7.769 1.00 0.00 C ATOM 0 H PHE A 59 -3.638 -3.127 -4.431 1.00 0.00 H new ATOM 0 HA PHE A 59 -4.255 -5.781 -5.212 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -2.610 -4.077 -6.171 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.544 -4.490 -4.843 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.169 -5.737 -7.920 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.357 -6.642 -4.784 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -2.297 -7.639 -9.254 1.00 0.00 H new ATOM 0 HE2 PHE A 59 0.471 -8.578 -6.101 1.00 0.00 H new ATOM 0 HZ PHE A 59 -0.475 -9.065 -8.346 1.00 0.00 H new ATOM 201 N VAL A 60 -2.656 -5.531 -2.344 1.00 0.00 N ATOM 202 CA VAL A 60 -2.301 -6.288 -1.144 1.00 0.00 C ATOM 203 C VAL A 60 -3.583 -6.776 -0.452 1.00 0.00 C ATOM 204 O VAL A 60 -3.594 -7.822 0.181 1.00 0.00 O ATOM 205 CB VAL A 60 -1.411 -5.407 -0.249 1.00 0.00 C ATOM 206 CG1 VAL A 60 -1.095 -6.024 1.116 1.00 0.00 C ATOM 207 CG2 VAL A 60 -0.072 -5.176 -0.969 1.00 0.00 C ATOM 0 H VAL A 60 -2.458 -4.533 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.725 -7.180 -1.388 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.968 -4.487 -0.073 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.464 -5.342 1.686 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.023 -6.200 1.660 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.572 -6.970 0.975 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.572 -4.553 -0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.415 -6.135 -1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.252 -4.677 -1.921 1.00 0.00 H new ATOM 217 N ALA A 61 -4.685 -6.047 -0.561 1.00 0.00 N ATOM 218 CA ALA A 61 -5.952 -6.421 0.023 1.00 0.00 C ATOM 219 C ALA A 61 -6.503 -7.612 -0.764 1.00 0.00 C ATOM 220 O ALA A 61 -7.020 -8.547 -0.159 1.00 0.00 O ATOM 221 CB ALA A 61 -6.885 -5.205 -0.027 1.00 0.00 C ATOM 0 H ALA A 61 -4.717 -5.163 -1.069 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.852 -6.721 1.066 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -7.848 -5.467 0.410 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -6.443 -4.384 0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -7.028 -4.898 -1.063 1.00 0.00 H new ATOM 227 N ARG A 62 -6.372 -7.605 -2.099 1.00 0.00 N ATOM 228 CA ARG A 62 -6.870 -8.703 -2.924 1.00 0.00 C ATOM 229 C ARG A 62 -5.989 -9.946 -2.815 1.00 0.00 C ATOM 230 O ARG A 62 -6.464 -11.047 -2.549 1.00 0.00 O ATOM 231 CB ARG A 62 -6.983 -8.270 -4.405 1.00 0.00 C ATOM 232 CG ARG A 62 -8.047 -7.183 -4.618 1.00 0.00 C ATOM 233 CD ARG A 62 -8.536 -7.104 -6.073 1.00 0.00 C ATOM 234 NE ARG A 62 -9.649 -6.148 -6.186 1.00 0.00 N ATOM 235 CZ ARG A 62 -10.073 -5.489 -7.269 1.00 0.00 C ATOM 236 NH1 ARG A 62 -9.634 -5.781 -8.488 1.00 0.00 N ATOM 237 NH2 ARG A 62 -10.955 -4.517 -7.114 1.00 0.00 N ATOM 0 H ARG A 62 -5.927 -6.852 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.860 -8.958 -2.547 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.016 -7.900 -4.747 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.227 -9.138 -5.017 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -8.897 -7.380 -3.964 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -7.636 -6.217 -4.325 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.717 -6.797 -6.723 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.858 -8.089 -6.410 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.164 -5.964 -5.325 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.952 -6.528 -8.619 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -9.979 -5.258 -9.293 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.298 -4.283 -6.182 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.293 -4.000 -7.926 1.00 0.00 H new ATOM 251 N ASN A 63 -4.689 -9.782 -3.040 1.00 0.00 N ATOM 252 CA ASN A 63 -3.727 -10.884 -3.023 1.00 0.00 C ATOM 253 C ASN A 63 -3.283 -11.335 -1.633 1.00 0.00 C ATOM 254 O ASN A 63 -2.783 -12.451 -1.509 1.00 0.00 O ATOM 255 CB ASN A 63 -2.513 -10.557 -3.901 1.00 0.00 C ATOM 256 CG ASN A 63 -2.902 -10.336 -5.356 1.00 0.00 C ATOM 257 OD1 ASN A 63 -2.916 -11.264 -6.158 1.00 0.00 O ATOM 258 ND2 ASN A 63 -3.291 -9.126 -5.710 1.00 0.00 N ATOM 0 H ASN A 63 -4.268 -8.875 -3.241 1.00 0.00 H new ATOM 0 HA ASN A 63 -4.266 -11.736 -3.437 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.019 -9.664 -3.518 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.791 -11.371 -3.839 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -3.610 -8.951 -6.663 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -3.273 -8.365 -5.031 1.00 0.00 H new ATOM 265 N GLY A 64 -3.461 -10.522 -0.596 1.00 0.00 N ATOM 266 CA GLY A 64 -3.096 -10.831 0.781 1.00 0.00 C ATOM 267 C GLY A 64 -1.894 -10.024 1.279 1.00 0.00 C ATOM 268 O GLY A 64 -1.161 -9.431 0.478 1.00 0.00 O ATOM 0 H GLY A 64 -3.879 -9.597 -0.696 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.950 -10.637 1.429 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.870 -11.894 0.861 1.00 0.00 H new ATOM 272 N PRO A 65 -1.660 -9.995 2.609 1.00 0.00 N ATOM 273 CA PRO A 65 -0.557 -9.259 3.222 1.00 0.00 C ATOM 274 C PRO A 65 0.800 -9.786 2.772 1.00 0.00 C ATOM 275 O PRO A 65 1.788 -9.071 2.918 1.00 0.00 O ATOM 276 CB PRO A 65 -0.749 -9.345 4.736 1.00 0.00 C ATOM 277 CG PRO A 65 -1.605 -10.592 4.916 1.00 0.00 C ATOM 278 CD PRO A 65 -2.440 -10.670 3.633 1.00 0.00 C ATOM 0 HA PRO A 65 -0.568 -8.216 2.905 1.00 0.00 H new ATOM 0 HB2 PRO A 65 0.204 -9.434 5.257 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -1.245 -8.457 5.129 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -0.989 -11.482 5.044 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.239 -10.514 5.799 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.635 -11.706 3.356 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.409 -10.188 3.767 1.00 0.00 H new ATOM 286 N GLU A 66 0.871 -10.972 2.156 1.00 0.00 N ATOM 287 CA GLU A 66 2.129 -11.510 1.671 1.00 0.00 C ATOM 288 C GLU A 66 2.732 -10.523 0.662 1.00 0.00 C ATOM 289 O GLU A 66 3.954 -10.362 0.579 1.00 0.00 O ATOM 290 CB GLU A 66 1.943 -12.925 1.091 1.00 0.00 C ATOM 291 CG GLU A 66 1.098 -13.081 -0.192 1.00 0.00 C ATOM 292 CD GLU A 66 1.845 -13.922 -1.236 1.00 0.00 C ATOM 293 OE1 GLU A 66 2.346 -15.021 -0.901 1.00 0.00 O ATOM 294 OE2 GLU A 66 2.020 -13.490 -2.395 1.00 0.00 O ATOM 0 H GLU A 66 0.064 -11.572 1.985 1.00 0.00 H new ATOM 0 HA GLU A 66 2.831 -11.622 2.497 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.933 -13.336 0.890 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.491 -13.546 1.865 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.146 -13.554 0.049 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.870 -12.098 -0.605 1.00 0.00 H new ATOM 301 N PHE A 67 1.886 -9.802 -0.084 1.00 0.00 N ATOM 302 CA PHE A 67 2.342 -8.830 -1.056 1.00 0.00 C ATOM 303 C PHE A 67 2.881 -7.568 -0.408 1.00 0.00 C ATOM 304 O PHE A 67 3.659 -6.853 -1.037 1.00 0.00 O ATOM 305 CB PHE A 67 1.266 -8.517 -2.092 1.00 0.00 C ATOM 306 CG PHE A 67 1.414 -9.423 -3.277 1.00 0.00 C ATOM 307 CD1 PHE A 67 2.356 -9.094 -4.265 1.00 0.00 C ATOM 308 CD2 PHE A 67 0.698 -10.625 -3.340 1.00 0.00 C ATOM 309 CE1 PHE A 67 2.559 -9.953 -5.354 1.00 0.00 C ATOM 310 CE2 PHE A 67 0.874 -11.467 -4.448 1.00 0.00 C ATOM 311 CZ PHE A 67 1.808 -11.135 -5.444 1.00 0.00 C ATOM 0 H PHE A 67 0.871 -9.884 -0.023 1.00 0.00 H new ATOM 0 HA PHE A 67 3.178 -9.290 -1.583 1.00 0.00 H new ATOM 0 HB2 PHE A 67 0.277 -8.642 -1.650 1.00 0.00 H new ATOM 0 HB3 PHE A 67 1.345 -7.477 -2.407 1.00 0.00 H new ATOM 0 HD1 PHE A 67 2.924 -8.179 -4.186 1.00 0.00 H new ATOM 0 HD2 PHE A 67 0.019 -10.900 -2.546 1.00 0.00 H new ATOM 0 HE1 PHE A 67 3.285 -9.708 -6.115 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.291 -12.372 -4.536 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.949 -11.796 -6.287 1.00 0.00 H new ATOM 321 N GLU A 68 2.477 -7.261 0.825 1.00 0.00 N ATOM 322 CA GLU A 68 2.968 -6.085 1.523 1.00 0.00 C ATOM 323 C GLU A 68 4.470 -6.263 1.746 1.00 0.00 C ATOM 324 O GLU A 68 5.205 -5.281 1.831 1.00 0.00 O ATOM 325 CB GLU A 68 2.224 -5.936 2.868 1.00 0.00 C ATOM 326 CG GLU A 68 2.464 -4.592 3.571 1.00 0.00 C ATOM 327 CD GLU A 68 1.555 -4.340 4.791 1.00 0.00 C ATOM 328 OE1 GLU A 68 0.480 -4.971 4.924 1.00 0.00 O ATOM 329 OE2 GLU A 68 1.894 -3.472 5.628 1.00 0.00 O ATOM 0 H GLU A 68 1.808 -7.817 1.358 1.00 0.00 H new ATOM 0 HA GLU A 68 2.791 -5.182 0.939 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.155 -6.058 2.695 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.533 -6.742 3.533 1.00 0.00 H new ATOM 0 HG2 GLU A 68 3.504 -4.545 3.892 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.316 -3.787 2.851 1.00 0.00 H new ATOM 336 N ALA A 69 4.924 -7.515 1.876 1.00 0.00 N ATOM 337 CA ALA A 69 6.319 -7.855 2.060 1.00 0.00 C ATOM 338 C ALA A 69 6.989 -7.996 0.693 1.00 0.00 C ATOM 339 O ALA A 69 8.091 -7.482 0.522 1.00 0.00 O ATOM 340 CB ALA A 69 6.429 -9.165 2.839 1.00 0.00 C ATOM 0 H ALA A 69 4.310 -8.329 1.854 1.00 0.00 H new ATOM 0 HA ALA A 69 6.819 -7.067 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.480 -9.419 2.977 1.00 0.00 H new ATOM 0 HB2 ALA A 69 5.953 -9.050 3.813 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.933 -9.961 2.284 1.00 0.00 H new ATOM 346 N ARG A 70 6.346 -8.656 -0.288 1.00 0.00 N ATOM 347 CA ARG A 70 6.923 -8.824 -1.621 1.00 0.00 C ATOM 348 C ARG A 70 7.245 -7.483 -2.245 1.00 0.00 C ATOM 349 O ARG A 70 8.398 -7.214 -2.558 1.00 0.00 O ATOM 350 CB ARG A 70 5.984 -9.568 -2.559 1.00 0.00 C ATOM 351 CG ARG A 70 5.951 -11.062 -2.268 1.00 0.00 C ATOM 352 CD ARG A 70 4.723 -11.614 -2.979 1.00 0.00 C ATOM 353 NE ARG A 70 4.688 -13.082 -3.072 1.00 0.00 N ATOM 354 CZ ARG A 70 5.550 -13.876 -3.718 1.00 0.00 C ATOM 355 NH1 ARG A 70 6.568 -13.365 -4.406 1.00 0.00 N ATOM 356 NH2 ARG A 70 5.389 -15.193 -3.697 1.00 0.00 N ATOM 0 H ARG A 70 5.425 -9.080 -0.175 1.00 0.00 H new ATOM 0 HA ARG A 70 7.834 -9.408 -1.488 1.00 0.00 H new ATOM 0 HB2 ARG A 70 4.978 -9.158 -2.465 1.00 0.00 H new ATOM 0 HB3 ARG A 70 6.299 -9.407 -3.590 1.00 0.00 H new ATOM 0 HG2 ARG A 70 6.858 -11.547 -2.628 1.00 0.00 H new ATOM 0 HG3 ARG A 70 5.894 -11.247 -1.195 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.830 -11.273 -2.455 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.681 -11.196 -3.985 1.00 0.00 H new ATOM 0 HE ARG A 70 3.919 -13.547 -2.589 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.700 -12.354 -4.446 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.216 -13.984 -4.893 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.606 -15.603 -3.187 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.048 -15.795 -4.190 1.00 0.00 H new ATOM 370 N ILE A 71 6.222 -6.651 -2.432 1.00 0.00 N ATOM 371 CA ILE A 71 6.345 -5.340 -3.045 1.00 0.00 C ATOM 372 C ILE A 71 7.428 -4.542 -2.327 1.00 0.00 C ATOM 373 O ILE A 71 8.279 -3.966 -3.002 1.00 0.00 O ATOM 374 CB ILE A 71 4.974 -4.628 -3.080 1.00 0.00 C ATOM 375 CG1 ILE A 71 3.937 -5.448 -3.880 1.00 0.00 C ATOM 376 CG2 ILE A 71 5.096 -3.244 -3.733 1.00 0.00 C ATOM 377 CD1 ILE A 71 2.492 -5.013 -3.628 1.00 0.00 C ATOM 0 H ILE A 71 5.267 -6.879 -2.154 1.00 0.00 H new ATOM 0 HA ILE A 71 6.658 -5.437 -4.085 1.00 0.00 H new ATOM 0 HB ILE A 71 4.642 -4.527 -2.047 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.156 -5.357 -4.944 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.041 -6.502 -3.622 1.00 0.00 H new ATOM 0 HG21 ILE A 71 4.119 -2.761 -3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 71 5.795 -2.633 -3.162 1.00 0.00 H new ATOM 0 HG23 ILE A 71 5.461 -3.354 -4.754 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.817 -5.630 -4.221 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.256 -5.130 -2.570 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.372 -3.968 -3.913 1.00 0.00 H new ATOM 389 N ARG A 72 7.416 -4.534 -0.991 1.00 0.00 N ATOM 390 CA ARG A 72 8.399 -3.801 -0.212 1.00 0.00 C ATOM 391 C ARG A 72 9.804 -4.294 -0.495 1.00 0.00 C ATOM 392 O ARG A 72 10.657 -3.463 -0.771 1.00 0.00 O ATOM 393 CB ARG A 72 8.057 -3.879 1.277 1.00 0.00 C ATOM 394 CG ARG A 72 8.881 -2.880 2.096 1.00 0.00 C ATOM 395 CD ARG A 72 8.322 -2.764 3.511 1.00 0.00 C ATOM 396 NE ARG A 72 8.874 -3.745 4.448 1.00 0.00 N ATOM 397 CZ ARG A 72 8.408 -3.928 5.685 1.00 0.00 C ATOM 398 NH1 ARG A 72 7.422 -3.164 6.153 1.00 0.00 N ATOM 399 NH2 ARG A 72 8.917 -4.879 6.453 1.00 0.00 N ATOM 0 H ARG A 72 6.727 -5.034 -0.429 1.00 0.00 H new ATOM 0 HA ARG A 72 8.367 -2.753 -0.510 1.00 0.00 H new ATOM 0 HB2 ARG A 72 6.995 -3.678 1.418 1.00 0.00 H new ATOM 0 HB3 ARG A 72 8.242 -4.890 1.641 1.00 0.00 H new ATOM 0 HG2 ARG A 72 9.922 -3.202 2.134 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.867 -1.904 1.611 1.00 0.00 H new ATOM 0 HD2 ARG A 72 8.522 -1.762 3.889 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.239 -2.880 3.474 1.00 0.00 H new ATOM 0 HE ARG A 72 9.658 -4.320 4.138 1.00 0.00 H new ATOM 0 HH11 ARG A 72 7.019 -2.434 5.565 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.070 -3.309 7.099 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.667 -5.473 6.099 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.559 -5.017 7.398 1.00 0.00 H new ATOM 413 N GLN A 73 10.054 -5.603 -0.429 1.00 0.00 N ATOM 414 CA GLN A 73 11.367 -6.184 -0.666 1.00 0.00 C ATOM 415 C GLN A 73 11.831 -6.008 -2.115 1.00 0.00 C ATOM 416 O GLN A 73 13.028 -5.851 -2.358 1.00 0.00 O ATOM 417 CB GLN A 73 11.340 -7.675 -0.292 1.00 0.00 C ATOM 418 CG GLN A 73 12.686 -8.204 0.215 1.00 0.00 C ATOM 419 CD GLN A 73 12.966 -7.768 1.651 1.00 0.00 C ATOM 420 OE1 GLN A 73 12.671 -8.492 2.595 1.00 0.00 O ATOM 421 NE2 GLN A 73 13.539 -6.597 1.864 1.00 0.00 N ATOM 0 H GLN A 73 9.338 -6.294 -0.206 1.00 0.00 H new ATOM 0 HA GLN A 73 12.084 -5.654 -0.039 1.00 0.00 H new ATOM 0 HB2 GLN A 73 10.583 -7.835 0.476 1.00 0.00 H new ATOM 0 HB3 GLN A 73 11.036 -8.254 -1.164 1.00 0.00 H new ATOM 0 HG2 GLN A 73 12.693 -9.293 0.159 1.00 0.00 H new ATOM 0 HG3 GLN A 73 13.485 -7.846 -0.435 1.00 0.00 H new ATOM 0 HE21 GLN A 73 13.783 -5.998 1.076 1.00 0.00 H new ATOM 0 HE22 GLN A 73 13.738 -6.292 2.817 1.00 0.00 H new ATOM 430 N ASN A 74 10.893 -6.032 -3.061 1.00 0.00 N ATOM 431 CA ASN A 74 11.167 -5.890 -4.481 1.00 0.00 C ATOM 432 C ASN A 74 11.589 -4.458 -4.793 1.00 0.00 C ATOM 433 O ASN A 74 12.580 -4.249 -5.484 1.00 0.00 O ATOM 434 CB ASN A 74 9.935 -6.287 -5.321 1.00 0.00 C ATOM 435 CG ASN A 74 9.663 -7.790 -5.312 1.00 0.00 C ATOM 436 OD1 ASN A 74 10.583 -8.595 -5.232 1.00 0.00 O ATOM 437 ND2 ASN A 74 8.411 -8.220 -5.390 1.00 0.00 N ATOM 0 H ASN A 74 9.902 -6.154 -2.852 1.00 0.00 H new ATOM 0 HA ASN A 74 11.984 -6.562 -4.744 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.059 -5.763 -4.940 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.082 -5.956 -6.349 1.00 0.00 H new ATOM 0 HD21 ASN A 74 8.214 -9.221 -5.383 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.645 -7.550 -5.457 1.00 0.00 H new ATOM 444 N GLU A 75 10.844 -3.468 -4.297 1.00 0.00 N ATOM 445 CA GLU A 75 11.090 -2.040 -4.505 1.00 0.00 C ATOM 446 C GLU A 75 11.824 -1.453 -3.279 1.00 0.00 C ATOM 447 O GLU A 75 11.687 -0.271 -2.958 1.00 0.00 O ATOM 448 CB GLU A 75 9.737 -1.349 -4.765 1.00 0.00 C ATOM 449 CG GLU A 75 9.021 -1.792 -6.066 1.00 0.00 C ATOM 450 CD GLU A 75 9.387 -0.951 -7.307 1.00 0.00 C ATOM 451 OE1 GLU A 75 10.447 -0.285 -7.343 1.00 0.00 O ATOM 452 OE2 GLU A 75 8.582 -0.980 -8.277 1.00 0.00 O ATOM 0 H GLU A 75 10.023 -3.646 -3.718 1.00 0.00 H new ATOM 0 HA GLU A 75 11.733 -1.874 -5.369 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.077 -1.543 -3.919 1.00 0.00 H new ATOM 0 HB3 GLU A 75 9.897 -0.271 -4.804 1.00 0.00 H new ATOM 0 HG2 GLU A 75 9.264 -2.836 -6.264 1.00 0.00 H new ATOM 0 HG3 GLU A 75 7.943 -1.740 -5.910 1.00 0.00 H new ATOM 459 N ILE A 76 12.596 -2.264 -2.546 1.00 0.00 N ATOM 460 CA ILE A 76 13.313 -1.839 -1.338 1.00 0.00 C ATOM 461 C ILE A 76 14.378 -0.763 -1.563 1.00 0.00 C ATOM 462 O ILE A 76 14.816 -0.123 -0.604 1.00 0.00 O ATOM 463 CB ILE A 76 13.851 -3.086 -0.605 1.00 0.00 C ATOM 464 CG1 ILE A 76 14.015 -2.875 0.913 1.00 0.00 C ATOM 465 CG2 ILE A 76 15.135 -3.620 -1.254 1.00 0.00 C ATOM 466 CD1 ILE A 76 12.681 -2.786 1.660 1.00 0.00 C ATOM 0 H ILE A 76 12.742 -3.246 -2.778 1.00 0.00 H new ATOM 0 HA ILE A 76 12.594 -1.329 -0.697 1.00 0.00 H new ATOM 0 HB ILE A 76 13.086 -3.854 -0.717 1.00 0.00 H new ATOM 0 HG12 ILE A 76 14.600 -3.697 1.326 1.00 0.00 H new ATOM 0 HG13 ILE A 76 14.582 -1.961 1.086 1.00 0.00 H new ATOM 0 HG21 ILE A 76 15.481 -4.498 -0.708 1.00 0.00 H new ATOM 0 HG22 ILE A 76 14.933 -3.893 -2.290 1.00 0.00 H new ATOM 0 HG23 ILE A 76 15.905 -2.849 -1.226 1.00 0.00 H new ATOM 0 HD11 ILE A 76 12.869 -2.637 2.723 1.00 0.00 H new ATOM 0 HD12 ILE A 76 12.103 -1.947 1.273 1.00 0.00 H new ATOM 0 HD13 ILE A 76 12.121 -3.710 1.516 1.00 0.00 H new ATOM 478 N ASN A 77 14.838 -0.580 -2.798 1.00 0.00 N ATOM 479 CA ASN A 77 15.835 0.423 -3.150 1.00 0.00 C ATOM 480 C ASN A 77 15.135 1.586 -3.860 1.00 0.00 C ATOM 481 O ASN A 77 15.810 2.404 -4.481 1.00 0.00 O ATOM 482 CB ASN A 77 16.944 -0.174 -4.030 1.00 0.00 C ATOM 483 CG ASN A 77 17.628 -1.387 -3.423 1.00 0.00 C ATOM 484 OD1 ASN A 77 17.379 -2.515 -3.839 1.00 0.00 O ATOM 485 ND2 ASN A 77 18.532 -1.193 -2.485 1.00 0.00 N ATOM 0 H ASN A 77 14.522 -1.134 -3.594 1.00 0.00 H new ATOM 0 HA ASN A 77 16.315 0.786 -2.241 1.00 0.00 H new ATOM 0 HB2 ASN A 77 16.518 -0.454 -4.993 1.00 0.00 H new ATOM 0 HB3 ASN A 77 17.693 0.594 -4.224 1.00 0.00 H new ATOM 0 HD21 ASN A 77 19.038 -1.987 -2.092 1.00 0.00 H new ATOM 0 HD22 ASN A 77 18.726 -0.249 -2.151 1.00 0.00 H new ATOM 492 N ASN A 78 13.799 1.663 -3.821 1.00 0.00 N ATOM 493 CA ASN A 78 13.024 2.710 -4.468 1.00 0.00 C ATOM 494 C ASN A 78 12.247 3.500 -3.414 1.00 0.00 C ATOM 495 O ASN A 78 11.398 2.932 -2.723 1.00 0.00 O ATOM 496 CB ASN A 78 12.060 2.102 -5.501 1.00 0.00 C ATOM 497 CG ASN A 78 12.242 2.619 -6.920 1.00 0.00 C ATOM 498 OD1 ASN A 78 13.120 3.408 -7.245 1.00 0.00 O ATOM 499 ND2 ASN A 78 11.386 2.207 -7.831 1.00 0.00 N ATOM 0 H ASN A 78 13.222 0.982 -3.327 1.00 0.00 H new ATOM 0 HA ASN A 78 13.703 3.385 -4.989 1.00 0.00 H new ATOM 0 HB2 ASN A 78 12.187 1.019 -5.504 1.00 0.00 H new ATOM 0 HB3 ASN A 78 11.036 2.302 -5.184 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.460 2.545 -8.791 1.00 0.00 H new ATOM 0 HD22 ASN A 78 10.648 1.550 -7.577 1.00 0.00 H new ATOM 506 N PRO A 79 12.466 4.817 -3.314 1.00 0.00 N ATOM 507 CA PRO A 79 11.796 5.667 -2.343 1.00 0.00 C ATOM 508 C PRO A 79 10.303 5.779 -2.637 1.00 0.00 C ATOM 509 O PRO A 79 9.524 6.050 -1.728 1.00 0.00 O ATOM 510 CB PRO A 79 12.521 7.009 -2.411 1.00 0.00 C ATOM 511 CG PRO A 79 13.081 7.027 -3.826 1.00 0.00 C ATOM 512 CD PRO A 79 13.417 5.575 -4.096 1.00 0.00 C ATOM 0 HA PRO A 79 11.844 5.257 -1.334 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.842 7.843 -2.235 1.00 0.00 H new ATOM 0 HB3 PRO A 79 13.311 7.079 -1.664 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.352 7.409 -4.541 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.963 7.663 -3.900 1.00 0.00 H new ATOM 0 HD2 PRO A 79 13.330 5.341 -5.157 1.00 0.00 H new ATOM 0 HD3 PRO A 79 14.441 5.346 -3.802 1.00 0.00 H new ATOM 520 N LYS A 80 9.859 5.528 -3.874 1.00 0.00 N ATOM 521 CA LYS A 80 8.444 5.592 -4.225 1.00 0.00 C ATOM 522 C LYS A 80 7.581 4.622 -3.420 1.00 0.00 C ATOM 523 O LYS A 80 6.377 4.855 -3.342 1.00 0.00 O ATOM 524 CB LYS A 80 8.263 5.300 -5.727 1.00 0.00 C ATOM 525 CG LYS A 80 7.926 6.583 -6.502 1.00 0.00 C ATOM 526 CD LYS A 80 6.984 6.331 -7.685 1.00 0.00 C ATOM 527 CE LYS A 80 7.680 5.590 -8.822 1.00 0.00 C ATOM 528 NZ LYS A 80 6.799 5.382 -9.986 1.00 0.00 N ATOM 0 H LYS A 80 10.469 5.277 -4.652 1.00 0.00 H new ATOM 0 HA LYS A 80 8.110 6.601 -3.984 1.00 0.00 H new ATOM 0 HB2 LYS A 80 9.175 4.858 -6.128 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.467 4.568 -5.865 1.00 0.00 H new ATOM 0 HG2 LYS A 80 7.466 7.302 -5.824 1.00 0.00 H new ATOM 0 HG3 LYS A 80 8.848 7.034 -6.867 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.125 5.752 -7.347 1.00 0.00 H new ATOM 0 HD3 LYS A 80 6.602 7.283 -8.053 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.560 6.153 -9.133 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.032 4.624 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.320 4.875 -10.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 5.971 4.821 -9.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.483 6.303 -10.351 1.00 0.00 H new ATOM 542 N PHE A 81 8.182 3.591 -2.823 1.00 0.00 N ATOM 543 CA PHE A 81 7.532 2.551 -2.038 1.00 0.00 C ATOM 544 C PHE A 81 7.862 2.632 -0.558 1.00 0.00 C ATOM 545 O PHE A 81 7.446 1.763 0.205 1.00 0.00 O ATOM 546 CB PHE A 81 7.961 1.211 -2.611 1.00 0.00 C ATOM 547 CG PHE A 81 7.367 0.976 -3.984 1.00 0.00 C ATOM 548 CD1 PHE A 81 7.959 1.555 -5.122 1.00 0.00 C ATOM 549 CD2 PHE A 81 6.172 0.245 -4.112 1.00 0.00 C ATOM 550 CE1 PHE A 81 7.381 1.382 -6.387 1.00 0.00 C ATOM 551 CE2 PHE A 81 5.604 0.048 -5.381 1.00 0.00 C ATOM 552 CZ PHE A 81 6.222 0.596 -6.517 1.00 0.00 C ATOM 0 H PHE A 81 9.191 3.456 -2.880 1.00 0.00 H new ATOM 0 HA PHE A 81 6.452 2.682 -2.105 1.00 0.00 H new ATOM 0 HB2 PHE A 81 9.049 1.173 -2.673 1.00 0.00 H new ATOM 0 HB3 PHE A 81 7.652 0.411 -1.938 1.00 0.00 H new ATOM 0 HD1 PHE A 81 8.864 2.136 -5.020 1.00 0.00 H new ATOM 0 HD2 PHE A 81 5.692 -0.164 -3.235 1.00 0.00 H new ATOM 0 HE1 PHE A 81 7.822 1.849 -7.255 1.00 0.00 H new ATOM 0 HE2 PHE A 81 4.694 -0.524 -5.483 1.00 0.00 H new ATOM 0 HZ PHE A 81 5.805 0.413 -7.496 1.00 0.00 H new ATOM 562 N ASN A 82 8.572 3.677 -0.138 1.00 0.00 N ATOM 563 CA ASN A 82 8.944 3.881 1.254 1.00 0.00 C ATOM 564 C ASN A 82 7.732 3.774 2.175 1.00 0.00 C ATOM 565 O ASN A 82 7.880 3.291 3.289 1.00 0.00 O ATOM 566 CB ASN A 82 9.568 5.267 1.410 1.00 0.00 C ATOM 567 CG ASN A 82 11.087 5.290 1.439 1.00 0.00 C ATOM 568 OD1 ASN A 82 11.773 4.317 1.138 1.00 0.00 O ATOM 569 ND2 ASN A 82 11.652 6.425 1.799 1.00 0.00 N ATOM 0 H ASN A 82 8.907 4.411 -0.763 1.00 0.00 H new ATOM 0 HA ASN A 82 9.658 3.106 1.533 1.00 0.00 H new ATOM 0 HB2 ASN A 82 9.226 5.897 0.589 1.00 0.00 H new ATOM 0 HB3 ASN A 82 9.196 5.715 2.331 1.00 0.00 H new ATOM 0 HD21 ASN A 82 12.669 6.501 1.830 1.00 0.00 H new ATOM 0 HD22 ASN A 82 11.073 7.227 2.047 1.00 0.00 H new ATOM 576 N PHE A 83 6.531 4.151 1.708 1.00 0.00 N ATOM 577 CA PHE A 83 5.292 4.092 2.478 1.00 0.00 C ATOM 578 C PHE A 83 5.025 2.685 3.051 1.00 0.00 C ATOM 579 O PHE A 83 4.329 2.546 4.059 1.00 0.00 O ATOM 580 CB PHE A 83 4.119 4.595 1.612 1.00 0.00 C ATOM 581 CG PHE A 83 3.773 3.736 0.401 1.00 0.00 C ATOM 582 CD1 PHE A 83 2.992 2.574 0.568 1.00 0.00 C ATOM 583 CD2 PHE A 83 4.207 4.082 -0.897 1.00 0.00 C ATOM 584 CE1 PHE A 83 2.696 1.753 -0.532 1.00 0.00 C ATOM 585 CE2 PHE A 83 3.941 3.235 -1.980 1.00 0.00 C ATOM 586 CZ PHE A 83 3.193 2.067 -1.803 1.00 0.00 C ATOM 0 H PHE A 83 6.398 4.512 0.763 1.00 0.00 H new ATOM 0 HA PHE A 83 5.394 4.749 3.342 1.00 0.00 H new ATOM 0 HB2 PHE A 83 3.234 4.674 2.243 1.00 0.00 H new ATOM 0 HB3 PHE A 83 4.354 5.601 1.265 1.00 0.00 H new ATOM 0 HD1 PHE A 83 2.619 2.314 1.548 1.00 0.00 H new ATOM 0 HD2 PHE A 83 4.747 5.004 -1.055 1.00 0.00 H new ATOM 0 HE1 PHE A 83 2.082 0.875 -0.397 1.00 0.00 H new ATOM 0 HE2 PHE A 83 4.317 3.486 -2.961 1.00 0.00 H new ATOM 0 HZ PHE A 83 3.000 1.412 -2.640 1.00 0.00 H new ATOM 596 N LEU A 84 5.561 1.632 2.427 1.00 0.00 N ATOM 597 CA LEU A 84 5.400 0.251 2.876 1.00 0.00 C ATOM 598 C LEU A 84 6.226 -0.044 4.130 1.00 0.00 C ATOM 599 O LEU A 84 6.029 -1.081 4.774 1.00 0.00 O ATOM 600 CB LEU A 84 5.818 -0.717 1.758 1.00 0.00 C ATOM 601 CG LEU A 84 4.852 -0.748 0.568 1.00 0.00 C ATOM 602 CD1 LEU A 84 5.431 -1.628 -0.536 1.00 0.00 C ATOM 603 CD2 LEU A 84 3.482 -1.304 0.971 1.00 0.00 C ATOM 0 H LEU A 84 6.127 1.719 1.583 1.00 0.00 H new ATOM 0 HA LEU A 84 4.347 0.111 3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.809 -0.438 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.900 -1.722 2.173 1.00 0.00 H new ATOM 0 HG LEU A 84 4.723 0.276 0.216 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.744 -1.650 -1.382 1.00 0.00 H new ATOM 0 HD12 LEU A 84 6.390 -1.223 -0.858 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.573 -2.640 -0.158 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.823 -1.311 0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.598 -2.320 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.049 -0.676 1.750 1.00 0.00 H new ATOM 615 N ASN A 85 7.204 0.807 4.445 1.00 0.00 N ATOM 616 CA ASN A 85 8.080 0.701 5.604 1.00 0.00 C ATOM 617 C ASN A 85 7.517 1.625 6.689 1.00 0.00 C ATOM 618 O ASN A 85 6.974 2.684 6.372 1.00 0.00 O ATOM 619 CB ASN A 85 9.520 1.139 5.288 1.00 0.00 C ATOM 620 CG ASN A 85 10.240 0.285 4.254 1.00 0.00 C ATOM 621 OD1 ASN A 85 11.029 -0.596 4.598 1.00 0.00 O ATOM 622 ND2 ASN A 85 9.962 0.507 2.978 1.00 0.00 N ATOM 0 H ASN A 85 7.413 1.624 3.871 1.00 0.00 H new ATOM 0 HA ASN A 85 8.115 -0.341 5.922 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.501 2.170 4.936 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.098 1.128 6.212 1.00 0.00 H new ATOM 0 HD21 ASN A 85 10.405 -0.058 2.254 1.00 0.00 H new ATOM 0 HD22 ASN A 85 9.305 1.243 2.720 1.00 0.00 H new ATOM 629 N PRO A 86 7.688 1.287 7.975 1.00 0.00 N ATOM 630 CA PRO A 86 7.181 2.081 9.089 1.00 0.00 C ATOM 631 C PRO A 86 7.854 3.443 9.255 1.00 0.00 C ATOM 632 O PRO A 86 7.324 4.287 9.976 1.00 0.00 O ATOM 633 CB PRO A 86 7.384 1.210 10.328 1.00 0.00 C ATOM 634 CG PRO A 86 8.552 0.314 9.933 1.00 0.00 C ATOM 635 CD PRO A 86 8.320 0.073 8.453 1.00 0.00 C ATOM 0 HA PRO A 86 6.136 2.334 8.912 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.616 1.809 11.209 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.492 0.629 10.563 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.511 0.799 10.116 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.553 -0.618 10.497 1.00 0.00 H new ATOM 0 HD2 PRO A 86 9.258 -0.117 7.931 1.00 0.00 H new ATOM 0 HD3 PRO A 86 7.683 -0.796 8.289 1.00 0.00 H new ATOM 643 N ASN A 87 8.997 3.669 8.607 1.00 0.00 N ATOM 644 CA ASN A 87 9.750 4.918 8.683 1.00 0.00 C ATOM 645 C ASN A 87 9.034 6.074 7.972 1.00 0.00 C ATOM 646 O ASN A 87 9.495 7.213 8.079 1.00 0.00 O ATOM 647 CB ASN A 87 11.159 4.726 8.082 1.00 0.00 C ATOM 648 CG ASN A 87 11.973 3.633 8.767 1.00 0.00 C ATOM 649 OD1 ASN A 87 12.666 3.865 9.753 1.00 0.00 O ATOM 650 ND2 ASN A 87 11.921 2.403 8.280 1.00 0.00 N ATOM 0 H ASN A 87 9.433 2.973 8.002 1.00 0.00 H new ATOM 0 HA ASN A 87 9.831 5.182 9.738 1.00 0.00 H new ATOM 0 HB2 ASN A 87 11.063 4.486 7.023 1.00 0.00 H new ATOM 0 HB3 ASN A 87 11.704 5.668 8.147 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.455 1.656 8.724 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.347 2.203 7.461 1.00 0.00 H new ATOM 657 N ASP A 88 7.933 5.832 7.249 1.00 0.00 N ATOM 658 CA ASP A 88 7.199 6.868 6.520 1.00 0.00 C ATOM 659 C ASP A 88 5.926 7.332 7.247 1.00 0.00 C ATOM 660 O ASP A 88 5.272 6.555 7.952 1.00 0.00 O ATOM 661 CB ASP A 88 6.873 6.371 5.100 1.00 0.00 C ATOM 662 CG ASP A 88 7.764 7.031 4.050 1.00 0.00 C ATOM 663 OD1 ASP A 88 8.990 7.132 4.282 1.00 0.00 O ATOM 664 OD2 ASP A 88 7.237 7.449 2.992 1.00 0.00 O ATOM 0 H ASP A 88 7.525 4.902 7.154 1.00 0.00 H new ATOM 0 HA ASP A 88 7.846 7.743 6.462 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.999 5.289 5.056 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.828 6.580 4.873 1.00 0.00 H new ATOM 669 N PRO A 89 5.513 8.594 7.033 1.00 0.00 N ATOM 670 CA PRO A 89 4.333 9.178 7.654 1.00 0.00 C ATOM 671 C PRO A 89 3.045 8.601 7.072 1.00 0.00 C ATOM 672 O PRO A 89 2.028 8.561 7.759 1.00 0.00 O ATOM 673 CB PRO A 89 4.439 10.680 7.405 1.00 0.00 C ATOM 674 CG PRO A 89 5.343 10.819 6.188 1.00 0.00 C ATOM 675 CD PRO A 89 6.200 9.568 6.209 1.00 0.00 C ATOM 0 HA PRO A 89 4.293 8.953 8.720 1.00 0.00 H new ATOM 0 HB2 PRO A 89 3.459 11.119 7.220 1.00 0.00 H new ATOM 0 HB3 PRO A 89 4.860 11.194 8.269 1.00 0.00 H new ATOM 0 HG2 PRO A 89 4.763 10.888 5.268 1.00 0.00 H new ATOM 0 HG3 PRO A 89 5.954 11.720 6.248 1.00 0.00 H new ATOM 0 HD2 PRO A 89 6.346 9.184 5.199 1.00 0.00 H new ATOM 0 HD3 PRO A 89 7.189 9.785 6.613 1.00 0.00 H new ATOM 683 N TYR A 90 3.068 8.101 5.836 1.00 0.00 N ATOM 684 CA TYR A 90 1.889 7.517 5.200 1.00 0.00 C ATOM 685 C TYR A 90 1.754 6.034 5.524 1.00 0.00 C ATOM 686 O TYR A 90 0.776 5.422 5.108 1.00 0.00 O ATOM 687 CB TYR A 90 1.909 7.770 3.694 1.00 0.00 C ATOM 688 CG TYR A 90 1.558 9.204 3.373 1.00 0.00 C ATOM 689 CD1 TYR A 90 2.556 10.189 3.424 1.00 0.00 C ATOM 690 CD2 TYR A 90 0.229 9.568 3.084 1.00 0.00 C ATOM 691 CE1 TYR A 90 2.251 11.534 3.181 1.00 0.00 C ATOM 692 CE2 TYR A 90 -0.092 10.916 2.853 1.00 0.00 C ATOM 693 CZ TYR A 90 0.919 11.904 2.898 1.00 0.00 C ATOM 694 OH TYR A 90 0.578 13.207 2.723 1.00 0.00 O ATOM 0 H TYR A 90 3.903 8.090 5.250 1.00 0.00 H new ATOM 0 HA TYR A 90 1.006 8.009 5.608 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.897 7.538 3.297 1.00 0.00 H new ATOM 0 HB3 TYR A 90 1.203 7.102 3.201 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.573 9.906 3.654 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.542 8.813 3.040 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.029 12.282 3.210 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -1.113 11.198 2.641 1.00 0.00 H new ATOM 0 HH TYR A 90 -0.382 13.272 2.535 1.00 0.00 H new ATOM 704 N HIS A 91 2.693 5.459 6.279 1.00 0.00 N ATOM 705 CA HIS A 91 2.623 4.053 6.644 1.00 0.00 C ATOM 706 C HIS A 91 1.319 3.768 7.400 1.00 0.00 C ATOM 707 O HIS A 91 0.550 2.908 6.986 1.00 0.00 O ATOM 708 CB HIS A 91 3.859 3.672 7.455 1.00 0.00 C ATOM 709 CG HIS A 91 3.928 2.188 7.679 1.00 0.00 C ATOM 710 ND1 HIS A 91 4.323 1.273 6.734 1.00 0.00 N ATOM 711 CD2 HIS A 91 3.602 1.508 8.821 1.00 0.00 C ATOM 712 CE1 HIS A 91 4.273 0.055 7.301 1.00 0.00 C ATOM 713 NE2 HIS A 91 3.820 0.151 8.565 1.00 0.00 N ATOM 0 H HIS A 91 3.508 5.950 6.646 1.00 0.00 H new ATOM 0 HA HIS A 91 2.614 3.436 5.746 1.00 0.00 H new ATOM 0 HB2 HIS A 91 4.756 4.005 6.933 1.00 0.00 H new ATOM 0 HB3 HIS A 91 3.839 4.187 8.416 1.00 0.00 H new ATOM 0 HD1 HIS A 91 4.604 1.480 5.775 1.00 0.00 H new ATOM 0 HD2 HIS A 91 3.244 1.938 9.745 1.00 0.00 H new ATOM 0 HE1 HIS A 91 4.555 -0.866 6.813 1.00 0.00 H new ATOM 721 N ALA A 92 1.018 4.517 8.470 1.00 0.00 N ATOM 722 CA ALA A 92 -0.210 4.318 9.241 1.00 0.00 C ATOM 723 C ALA A 92 -1.460 4.403 8.352 1.00 0.00 C ATOM 724 O ALA A 92 -2.415 3.653 8.557 1.00 0.00 O ATOM 725 CB ALA A 92 -0.277 5.342 10.375 1.00 0.00 C ATOM 0 H ALA A 92 1.613 5.268 8.820 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.189 3.314 9.665 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.192 5.192 10.947 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.585 5.217 11.030 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -0.272 6.349 9.957 1.00 0.00 H new ATOM 731 N TYR A 93 -1.445 5.304 7.368 1.00 0.00 N ATOM 732 CA TYR A 93 -2.537 5.493 6.429 1.00 0.00 C ATOM 733 C TYR A 93 -2.674 4.261 5.530 1.00 0.00 C ATOM 734 O TYR A 93 -3.781 3.779 5.302 1.00 0.00 O ATOM 735 CB TYR A 93 -2.263 6.769 5.625 1.00 0.00 C ATOM 736 CG TYR A 93 -3.286 7.099 4.572 1.00 0.00 C ATOM 737 CD1 TYR A 93 -4.541 7.578 4.962 1.00 0.00 C ATOM 738 CD2 TYR A 93 -2.987 6.916 3.213 1.00 0.00 C ATOM 739 CE1 TYR A 93 -5.516 7.858 3.999 1.00 0.00 C ATOM 740 CE2 TYR A 93 -3.950 7.206 2.229 1.00 0.00 C ATOM 741 CZ TYR A 93 -5.223 7.673 2.632 1.00 0.00 C ATOM 742 OH TYR A 93 -6.192 7.924 1.717 1.00 0.00 O ATOM 0 H TYR A 93 -0.657 5.931 7.204 1.00 0.00 H new ATOM 0 HA TYR A 93 -3.485 5.608 6.954 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -2.196 7.608 6.318 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.289 6.674 5.145 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -4.758 7.732 6.009 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -2.013 6.551 2.921 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.490 8.215 4.301 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -3.721 7.074 1.182 1.00 0.00 H new ATOM 0 HH TYR A 93 -5.844 7.753 0.817 1.00 0.00 H new ATOM 752 N TYR A 94 -1.556 3.737 5.017 1.00 0.00 N ATOM 753 CA TYR A 94 -1.544 2.563 4.156 1.00 0.00 C ATOM 754 C TYR A 94 -2.163 1.369 4.875 1.00 0.00 C ATOM 755 O TYR A 94 -2.942 0.632 4.266 1.00 0.00 O ATOM 756 CB TYR A 94 -0.110 2.251 3.698 1.00 0.00 C ATOM 757 CG TYR A 94 -0.002 0.987 2.868 1.00 0.00 C ATOM 758 CD1 TYR A 94 0.112 -0.261 3.504 1.00 0.00 C ATOM 759 CD2 TYR A 94 -0.043 1.040 1.466 1.00 0.00 C ATOM 760 CE1 TYR A 94 0.228 -1.443 2.765 1.00 0.00 C ATOM 761 CE2 TYR A 94 -0.018 -0.143 0.717 1.00 0.00 C ATOM 762 CZ TYR A 94 0.129 -1.385 1.362 1.00 0.00 C ATOM 763 OH TYR A 94 0.167 -2.519 0.626 1.00 0.00 O ATOM 0 H TYR A 94 -0.629 4.124 5.193 1.00 0.00 H new ATOM 0 HA TYR A 94 -2.144 2.771 3.270 1.00 0.00 H new ATOM 0 HB2 TYR A 94 0.268 3.092 3.116 1.00 0.00 H new ATOM 0 HB3 TYR A 94 0.531 2.156 4.575 1.00 0.00 H new ATOM 0 HD1 TYR A 94 0.110 -0.308 4.583 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.094 1.995 0.964 1.00 0.00 H new ATOM 0 HE1 TYR A 94 0.391 -2.387 3.264 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -0.112 -0.102 -0.358 1.00 0.00 H new ATOM 0 HH TYR A 94 -0.204 -3.261 1.148 1.00 0.00 H new ATOM 773 N ARG A 95 -1.851 1.190 6.164 1.00 0.00 N ATOM 774 CA ARG A 95 -2.393 0.074 6.950 1.00 0.00 C ATOM 775 C ARG A 95 -3.912 0.076 6.866 1.00 0.00 C ATOM 776 O ARG A 95 -4.522 -0.960 6.603 1.00 0.00 O ATOM 777 CB ARG A 95 -1.954 0.135 8.425 1.00 0.00 C ATOM 778 CG ARG A 95 -0.450 -0.032 8.684 1.00 0.00 C ATOM 779 CD ARG A 95 0.076 -1.420 8.298 1.00 0.00 C ATOM 780 NE ARG A 95 -0.477 -2.449 9.187 1.00 0.00 N ATOM 781 CZ ARG A 95 -0.400 -3.770 9.013 1.00 0.00 C ATOM 782 NH1 ARG A 95 0.330 -4.310 8.040 1.00 0.00 N ATOM 783 NH2 ARG A 95 -1.069 -4.557 9.848 1.00 0.00 N ATOM 0 H ARG A 95 -1.226 1.804 6.686 1.00 0.00 H new ATOM 0 HA ARG A 95 -1.996 -0.849 6.527 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -2.270 1.093 8.839 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -2.486 -0.641 8.975 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.096 0.726 8.122 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.247 0.146 9.740 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.192 -1.642 7.265 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.165 -1.431 8.354 1.00 0.00 H new ATOM 0 HE ARG A 95 -0.968 -2.122 10.019 1.00 0.00 H new ATOM 0 HH11 ARG A 95 0.851 -3.710 7.401 1.00 0.00 H new ATOM 0 HH12 ARG A 95 0.368 -5.324 7.934 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -1.624 -4.148 10.600 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -1.028 -5.570 9.738 1.00 0.00 H new ATOM 797 N HIS A 96 -4.508 1.246 7.095 1.00 0.00 N ATOM 798 CA HIS A 96 -5.942 1.421 7.036 1.00 0.00 C ATOM 799 C HIS A 96 -6.436 1.093 5.632 1.00 0.00 C ATOM 800 O HIS A 96 -7.382 0.324 5.508 1.00 0.00 O ATOM 801 CB HIS A 96 -6.284 2.857 7.460 1.00 0.00 C ATOM 802 CG HIS A 96 -7.699 3.295 7.183 1.00 0.00 C ATOM 803 ND1 HIS A 96 -8.811 3.000 7.931 1.00 0.00 N ATOM 804 CD2 HIS A 96 -8.095 4.101 6.151 1.00 0.00 C ATOM 805 CE1 HIS A 96 -9.854 3.622 7.358 1.00 0.00 C ATOM 806 NE2 HIS A 96 -9.469 4.328 6.277 1.00 0.00 N ATOM 0 H HIS A 96 -3.998 2.098 7.327 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.447 0.741 7.722 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -6.094 2.957 8.529 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -5.604 3.540 6.950 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -7.457 4.494 5.373 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -10.871 3.564 7.717 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -10.056 4.907 5.677 1.00 0.00 H new ATOM 814 N LYS A 97 -5.806 1.627 4.573 1.00 0.00 N ATOM 815 CA LYS A 97 -6.253 1.345 3.210 1.00 0.00 C ATOM 816 C LYS A 97 -6.350 -0.157 2.975 1.00 0.00 C ATOM 817 O LYS A 97 -7.372 -0.593 2.465 1.00 0.00 O ATOM 818 CB LYS A 97 -5.371 2.008 2.140 1.00 0.00 C ATOM 819 CG LYS A 97 -5.305 3.540 2.206 1.00 0.00 C ATOM 820 CD LYS A 97 -6.655 4.262 2.305 1.00 0.00 C ATOM 821 CE LYS A 97 -7.467 4.145 1.011 1.00 0.00 C ATOM 822 NZ LYS A 97 -8.007 5.444 0.562 1.00 0.00 N ATOM 0 H LYS A 97 -4.998 2.247 4.637 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.245 1.785 3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -4.359 1.612 2.230 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.741 1.718 1.156 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.699 3.822 3.067 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.785 3.901 1.319 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.229 3.844 3.132 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.487 5.315 2.533 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -6.836 3.727 0.227 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.290 3.447 1.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.070 5.454 -0.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.954 5.585 0.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -7.378 6.209 0.878 1.00 0.00 H new ATOM 836 N VAL A 98 -5.341 -0.946 3.343 1.00 0.00 N ATOM 837 CA VAL A 98 -5.390 -2.392 3.132 1.00 0.00 C ATOM 838 C VAL A 98 -6.646 -2.970 3.781 1.00 0.00 C ATOM 839 O VAL A 98 -7.427 -3.643 3.108 1.00 0.00 O ATOM 840 CB VAL A 98 -4.117 -3.043 3.686 1.00 0.00 C ATOM 841 CG1 VAL A 98 -4.178 -4.570 3.553 1.00 0.00 C ATOM 842 CG2 VAL A 98 -2.869 -2.568 2.930 1.00 0.00 C ATOM 0 H VAL A 98 -4.485 -0.611 3.786 1.00 0.00 H new ATOM 0 HA VAL A 98 -5.437 -2.605 2.064 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.054 -2.752 4.734 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -3.263 -5.007 3.953 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -5.035 -4.950 4.109 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -4.279 -4.840 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -1.985 -3.049 3.349 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.960 -2.830 1.876 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -2.774 -1.487 3.028 1.00 0.00 H new ATOM 852 N SER A 99 -6.842 -2.695 5.072 1.00 0.00 N ATOM 853 CA SER A 99 -7.988 -3.180 5.823 1.00 0.00 C ATOM 854 C SER A 99 -9.299 -2.849 5.108 1.00 0.00 C ATOM 855 O SER A 99 -10.164 -3.708 4.968 1.00 0.00 O ATOM 856 CB SER A 99 -7.967 -2.536 7.217 1.00 0.00 C ATOM 857 OG SER A 99 -8.876 -3.151 8.117 1.00 0.00 O ATOM 0 H SER A 99 -6.202 -2.125 5.624 1.00 0.00 H new ATOM 0 HA SER A 99 -7.926 -4.265 5.909 1.00 0.00 H new ATOM 0 HB2 SER A 99 -6.959 -2.598 7.626 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.210 -1.477 7.128 1.00 0.00 H new ATOM 0 HG SER A 99 -8.824 -2.707 8.989 1.00 0.00 H new ATOM 863 N GLU A 100 -9.434 -1.616 4.648 1.00 0.00 N ATOM 864 CA GLU A 100 -10.598 -1.074 3.974 1.00 0.00 C ATOM 865 C GLU A 100 -10.876 -1.720 2.630 1.00 0.00 C ATOM 866 O GLU A 100 -12.037 -2.030 2.337 1.00 0.00 O ATOM 867 CB GLU A 100 -10.381 0.437 3.823 1.00 0.00 C ATOM 868 CG GLU A 100 -11.287 1.225 4.776 1.00 0.00 C ATOM 869 CD GLU A 100 -11.219 0.679 6.207 1.00 0.00 C ATOM 870 OE1 GLU A 100 -10.129 0.640 6.806 1.00 0.00 O ATOM 871 OE2 GLU A 100 -12.252 0.214 6.745 1.00 0.00 O ATOM 0 H GLU A 100 -8.688 -0.927 4.742 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.480 -1.289 4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.338 0.679 4.025 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.584 0.735 2.794 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.993 2.274 4.773 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.316 1.181 4.419 1.00 0.00 H new ATOM 878 N PHE A 101 -9.848 -1.899 1.795 1.00 0.00 N ATOM 879 CA PHE A 101 -10.060 -2.529 0.510 1.00 0.00 C ATOM 880 C PHE A 101 -10.448 -3.984 0.754 1.00 0.00 C ATOM 881 O PHE A 101 -11.284 -4.507 0.021 1.00 0.00 O ATOM 882 CB PHE A 101 -8.838 -2.401 -0.408 1.00 0.00 C ATOM 883 CG PHE A 101 -8.748 -1.103 -1.195 1.00 0.00 C ATOM 884 CD1 PHE A 101 -8.347 0.088 -0.569 1.00 0.00 C ATOM 885 CD2 PHE A 101 -8.992 -1.093 -2.579 1.00 0.00 C ATOM 886 CE1 PHE A 101 -8.158 1.263 -1.309 1.00 0.00 C ATOM 887 CE2 PHE A 101 -8.785 0.081 -3.325 1.00 0.00 C ATOM 888 CZ PHE A 101 -8.356 1.259 -2.694 1.00 0.00 C ATOM 0 H PHE A 101 -8.886 -1.620 1.988 1.00 0.00 H new ATOM 0 HA PHE A 101 -10.867 -2.020 -0.017 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -7.937 -2.502 0.198 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.844 -3.233 -1.112 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -8.182 0.099 0.498 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -9.339 -1.989 -3.071 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.859 2.173 -0.810 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -8.957 0.076 -4.391 1.00 0.00 H new ATOM 0 HZ PHE A 101 -8.180 2.154 -3.272 1.00 0.00 H new ATOM 898 N LYS A 102 -9.896 -4.620 1.798 1.00 0.00 N ATOM 899 CA LYS A 102 -10.204 -6.006 2.147 1.00 0.00 C ATOM 900 C LYS A 102 -11.665 -6.123 2.547 1.00 0.00 C ATOM 901 O LYS A 102 -12.347 -7.037 2.091 1.00 0.00 O ATOM 902 CB LYS A 102 -9.318 -6.450 3.306 1.00 0.00 C ATOM 903 CG LYS A 102 -7.941 -6.890 2.846 1.00 0.00 C ATOM 904 CD LYS A 102 -7.050 -7.151 4.052 1.00 0.00 C ATOM 905 CE LYS A 102 -6.947 -8.614 4.477 1.00 0.00 C ATOM 906 NZ LYS A 102 -8.246 -9.308 4.585 1.00 0.00 N ATOM 0 H LYS A 102 -9.221 -4.181 2.424 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.017 -6.644 1.283 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.216 -5.630 4.016 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -9.801 -7.272 3.835 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -8.022 -7.793 2.241 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -7.496 -6.121 2.214 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -6.049 -6.782 3.831 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -7.425 -6.570 4.894 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -6.323 -9.146 3.759 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -6.439 -8.666 5.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -8.092 -10.284 4.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -8.851 -8.807 5.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -8.710 -9.322 3.655 1.00 0.00 H new ATOM 920 N GLU A 103 -12.159 -5.200 3.376 1.00 0.00 N ATOM 921 CA GLU A 103 -13.557 -5.207 3.808 1.00 0.00 C ATOM 922 C GLU A 103 -14.490 -4.891 2.629 1.00 0.00 C ATOM 923 O GLU A 103 -15.704 -5.029 2.749 1.00 0.00 O ATOM 924 CB GLU A 103 -13.803 -4.168 4.912 1.00 0.00 C ATOM 925 CG GLU A 103 -12.887 -4.297 6.137 1.00 0.00 C ATOM 926 CD GLU A 103 -13.581 -4.229 7.492 1.00 0.00 C ATOM 927 OE1 GLU A 103 -13.768 -3.109 8.021 1.00 0.00 O ATOM 928 OE2 GLU A 103 -13.809 -5.302 8.093 1.00 0.00 O ATOM 0 H GLU A 103 -11.607 -4.434 3.763 1.00 0.00 H new ATOM 0 HA GLU A 103 -13.768 -6.204 4.194 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -13.679 -3.172 4.487 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -14.839 -4.248 5.241 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -12.353 -5.245 6.070 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.139 -3.506 6.093 1.00 0.00 H new ATOM 935 N GLY A 104 -13.927 -4.450 1.501 1.00 0.00 N ATOM 936 CA GLY A 104 -14.637 -4.098 0.287 1.00 0.00 C ATOM 937 C GLY A 104 -15.517 -2.888 0.542 1.00 0.00 C ATOM 938 O GLY A 104 -16.658 -2.864 0.076 1.00 0.00 O ATOM 0 H GLY A 104 -12.918 -4.326 1.414 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -13.927 -3.882 -0.511 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -15.246 -4.939 -0.047 1.00 0.00 H new ATOM 942 N LYS A 105 -15.025 -1.891 1.291 1.00 0.00 N ATOM 943 CA LYS A 105 -15.826 -0.711 1.607 1.00 0.00 C ATOM 944 C LYS A 105 -15.230 0.634 1.234 1.00 0.00 C ATOM 945 O LYS A 105 -16.015 1.579 1.141 1.00 0.00 O ATOM 946 CB LYS A 105 -16.173 -0.743 3.103 1.00 0.00 C ATOM 947 CG LYS A 105 -15.001 -0.309 3.997 1.00 0.00 C ATOM 948 CD LYS A 105 -15.420 -0.149 5.449 1.00 0.00 C ATOM 949 CE LYS A 105 -15.683 -1.499 6.128 1.00 0.00 C ATOM 950 NZ LYS A 105 -16.236 -1.335 7.485 1.00 0.00 N ATOM 0 H LYS A 105 -14.084 -1.882 1.684 1.00 0.00 H new ATOM 0 HA LYS A 105 -16.710 -0.782 0.974 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -17.026 -0.089 3.287 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -16.479 -1.752 3.378 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -14.201 -1.047 3.930 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -14.596 0.634 3.631 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -14.641 0.384 5.994 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -16.320 0.463 5.500 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -16.377 -2.081 5.521 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.753 -2.066 6.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.651 -1.862 8.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -16.239 -0.327 7.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -17.209 -1.701 7.510 1.00 0.00 H new ATOM 964 N ALA A 106 -13.909 0.784 1.102 1.00 0.00 N ATOM 965 CA ALA A 106 -13.367 2.099 0.771 1.00 0.00 C ATOM 966 C ALA A 106 -13.708 2.500 -0.664 1.00 0.00 C ATOM 967 O ALA A 106 -14.064 1.653 -1.486 1.00 0.00 O ATOM 968 CB ALA A 106 -11.851 2.153 0.969 1.00 0.00 C ATOM 0 H ALA A 106 -13.220 0.041 1.215 1.00 0.00 H new ATOM 0 HA ALA A 106 -13.833 2.807 1.456 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -11.486 3.147 0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -11.612 1.936 2.010 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -11.373 1.414 0.326 1.00 0.00 H new ATOM 974 N GLN A 107 -13.561 3.797 -0.946 1.00 0.00 N ATOM 975 CA GLN A 107 -13.798 4.391 -2.250 1.00 0.00 C ATOM 976 C GLN A 107 -12.588 4.044 -3.114 1.00 0.00 C ATOM 977 O GLN A 107 -11.652 4.832 -3.229 1.00 0.00 O ATOM 978 CB GLN A 107 -13.968 5.912 -2.127 1.00 0.00 C ATOM 979 CG GLN A 107 -15.216 6.293 -1.324 1.00 0.00 C ATOM 980 CD GLN A 107 -15.573 7.749 -1.574 1.00 0.00 C ATOM 981 OE1 GLN A 107 -15.127 8.652 -0.862 1.00 0.00 O ATOM 982 NE2 GLN A 107 -16.343 8.001 -2.617 1.00 0.00 N ATOM 0 H GLN A 107 -13.264 4.478 -0.247 1.00 0.00 H new ATOM 0 HA GLN A 107 -14.715 4.007 -2.697 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -13.086 6.337 -1.647 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -14.031 6.350 -3.123 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -16.051 5.652 -1.608 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -15.037 6.132 -0.261 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -16.697 7.233 -3.187 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -16.584 8.964 -2.852 1.00 0.00 H new ATOM 991 N GLU A 108 -12.557 2.835 -3.652 1.00 0.00 N ATOM 992 CA GLU A 108 -11.491 2.332 -4.490 1.00 0.00 C ATOM 993 C GLU A 108 -11.411 3.121 -5.806 1.00 0.00 C ATOM 994 O GLU A 108 -12.417 3.699 -6.237 1.00 0.00 O ATOM 995 CB GLU A 108 -11.768 0.842 -4.747 1.00 0.00 C ATOM 996 CG GLU A 108 -13.086 0.578 -5.501 1.00 0.00 C ATOM 997 CD GLU A 108 -13.195 -0.877 -5.949 1.00 0.00 C ATOM 998 OE1 GLU A 108 -12.232 -1.376 -6.584 1.00 0.00 O ATOM 999 OE2 GLU A 108 -14.215 -1.523 -5.638 1.00 0.00 O ATOM 0 H GLU A 108 -13.304 2.155 -3.509 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.527 2.452 -3.995 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -10.942 0.421 -5.320 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -11.794 0.316 -3.792 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.930 0.825 -4.857 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -13.146 1.233 -6.371 1.00 0.00 H new ATOM 1006 N PRO A 109 -10.243 3.183 -6.466 1.00 0.00 N ATOM 1007 CA PRO A 109 -10.103 3.871 -7.737 1.00 0.00 C ATOM 1008 C PRO A 109 -10.744 2.992 -8.817 1.00 0.00 C ATOM 1009 O PRO A 109 -11.260 1.905 -8.535 1.00 0.00 O ATOM 1010 CB PRO A 109 -8.602 4.056 -7.950 1.00 0.00 C ATOM 1011 CG PRO A 109 -8.021 2.832 -7.255 1.00 0.00 C ATOM 1012 CD PRO A 109 -8.983 2.571 -6.092 1.00 0.00 C ATOM 0 HA PRO A 109 -10.595 4.843 -7.770 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -8.342 4.084 -9.008 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -8.240 4.984 -7.508 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -7.970 1.977 -7.930 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -7.008 3.019 -6.900 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -9.105 1.502 -5.920 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -8.601 3.001 -5.166 1.00 0.00 H new ATOM 1020 N SER A 110 -10.754 3.480 -10.046 1.00 0.00 N ATOM 1021 CA SER A 110 -11.321 2.807 -11.203 1.00 0.00 C ATOM 1022 C SER A 110 -10.374 3.048 -12.356 1.00 0.00 C ATOM 1023 O SER A 110 -10.306 2.182 -13.252 1.00 0.00 O ATOM 1024 CB SER A 110 -12.733 3.345 -11.469 1.00 0.00 C ATOM 1025 OG SER A 110 -13.544 2.372 -12.098 1.00 0.00 O ATOM 0 H SER A 110 -10.353 4.390 -10.274 1.00 0.00 H new ATOM 0 HA SER A 110 -11.427 1.733 -11.048 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.191 3.650 -10.528 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.673 4.233 -12.098 1.00 0.00 H new ATOM 0 HG SER A 110 -14.438 2.742 -12.253 1.00 0.00 H new TER 1031 SER A 110