USER MOD reduce.3.24.130724 H: found=0, std=0, add=502, rem=0, adj=10 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 Single : A 51 ASN : amide:sc= -0.07 K(o=-0.07,f=-3.6!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 81:sc= 1.25 USER MOD Single : A 58 SER OG : rot 84:sc= 0.981 USER MOD Single : A 63 ASN : amide:sc= 0.118 X(o=0.12,f=-0.038) USER MOD Single : A 73 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.17) USER MOD Single : A 74 ASN : amide:sc= -0.0832 K(o=-0.083,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 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0142) USER MOD Single : A 82 ASN : amide:sc= -1.58 K(o=-1.6,f=-2.3) USER MOD Single : A 85 ASN : amide:sc= -0.304 K(o=-0.3,f=-1.2) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= 1.16 K(o=1.2,f=-9.4!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0.0328 USER MOD Single : A 94 TYR OH : rot 165:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc= -0.289 X(o=-0.29,f=-0.0079) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 1.25 (180deg=1.25) USER MOD Single : A 99 SER OG : rot -51:sc= 1.25 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ -162:sc= 1.3 (180deg=1.25) 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 -0.484 15.496 -5.195 1.00 0.00 N ATOM 2 CA GLY A 47 -0.763 14.186 -4.598 1.00 0.00 C ATOM 3 C GLY A 47 -0.117 13.072 -5.401 1.00 0.00 C ATOM 4 O GLY A 47 -0.174 13.087 -6.632 1.00 0.00 O ATOM 0 HA2 GLY A 47 -0.391 14.163 -3.574 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -1.840 14.027 -4.550 1.00 0.00 H new ATOM 8 N GLU A 48 0.573 12.159 -4.720 1.00 0.00 N ATOM 9 CA GLU A 48 1.248 11.003 -5.293 1.00 0.00 C ATOM 10 C GLU A 48 1.378 9.955 -4.200 1.00 0.00 C ATOM 11 O GLU A 48 0.845 8.866 -4.349 1.00 0.00 O ATOM 12 CB GLU A 48 2.599 11.388 -5.908 1.00 0.00 C ATOM 13 CG GLU A 48 3.444 10.182 -6.358 1.00 0.00 C ATOM 14 CD GLU A 48 3.650 10.085 -7.869 1.00 0.00 C ATOM 15 OE1 GLU A 48 2.748 9.550 -8.558 1.00 0.00 O ATOM 16 OE2 GLU A 48 4.749 10.427 -8.358 1.00 0.00 O ATOM 0 H GLU A 48 0.680 12.210 -3.707 1.00 0.00 H new ATOM 0 HA GLU A 48 0.665 10.591 -6.117 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.425 12.038 -6.766 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.167 11.966 -5.180 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.419 10.236 -5.873 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.964 9.267 -6.009 1.00 0.00 H new ATOM 23 N VAL A 49 2.027 10.276 -3.081 1.00 0.00 N ATOM 24 CA VAL A 49 2.194 9.340 -1.969 1.00 0.00 C ATOM 25 C VAL A 49 0.838 8.768 -1.526 1.00 0.00 C ATOM 26 O VAL A 49 0.691 7.561 -1.381 1.00 0.00 O ATOM 27 CB VAL A 49 2.986 10.019 -0.841 1.00 0.00 C ATOM 28 CG1 VAL A 49 2.298 11.283 -0.321 1.00 0.00 C ATOM 29 CG2 VAL A 49 3.271 9.062 0.319 1.00 0.00 C ATOM 0 H VAL A 49 2.451 11.190 -2.920 1.00 0.00 H new ATOM 0 HA VAL A 49 2.779 8.477 -2.288 1.00 0.00 H new ATOM 0 HB VAL A 49 3.937 10.313 -1.285 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.899 11.723 0.475 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.191 12.000 -1.135 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.313 11.027 0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.833 9.585 1.093 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.329 8.703 0.734 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.854 8.215 -0.043 1.00 0.00 H new ATOM 39 N ARG A 50 -0.187 9.599 -1.329 1.00 0.00 N ATOM 40 CA ARG A 50 -1.494 9.105 -0.913 1.00 0.00 C ATOM 41 C ARG A 50 -2.153 8.292 -2.038 1.00 0.00 C ATOM 42 O ARG A 50 -2.867 7.331 -1.754 1.00 0.00 O ATOM 43 CB ARG A 50 -2.344 10.285 -0.434 1.00 0.00 C ATOM 44 CG ARG A 50 -3.621 9.804 0.250 1.00 0.00 C ATOM 45 CD ARG A 50 -4.282 10.905 1.075 1.00 0.00 C ATOM 46 NE ARG A 50 -5.667 10.539 1.409 1.00 0.00 N ATOM 47 CZ ARG A 50 -6.736 10.889 0.686 1.00 0.00 C ATOM 48 NH1 ARG A 50 -6.715 11.975 -0.083 1.00 0.00 N ATOM 49 NH2 ARG A 50 -7.811 10.118 0.720 1.00 0.00 N ATOM 0 H ARG A 50 -0.135 10.610 -1.451 1.00 0.00 H new ATOM 0 HA ARG A 50 -1.390 8.415 -0.075 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.765 10.896 0.259 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -2.600 10.920 -1.282 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -4.322 9.446 -0.504 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -3.388 8.958 0.896 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -3.714 11.073 1.990 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.272 11.841 0.517 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.822 9.981 2.248 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.876 12.553 -0.126 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.538 12.229 -0.629 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.815 9.273 1.291 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -8.636 10.369 0.175 1.00 0.00 H new ATOM 63 N ASN A 51 -1.893 8.650 -3.297 1.00 0.00 N ATOM 64 CA ASN A 51 -2.442 7.991 -4.476 1.00 0.00 C ATOM 65 C ASN A 51 -1.884 6.571 -4.567 1.00 0.00 C ATOM 66 O ASN A 51 -2.643 5.607 -4.633 1.00 0.00 O ATOM 67 CB ASN A 51 -2.126 8.790 -5.758 1.00 0.00 C ATOM 68 CG ASN A 51 -2.561 10.256 -5.728 1.00 0.00 C ATOM 69 OD1 ASN A 51 -2.281 11.003 -4.786 1.00 0.00 O ATOM 70 ND2 ASN A 51 -3.198 10.729 -6.780 1.00 0.00 N ATOM 0 H ASN A 51 -1.276 9.429 -3.527 1.00 0.00 H new ATOM 0 HA ASN A 51 -3.527 7.944 -4.382 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -1.052 8.749 -5.939 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -2.610 8.300 -6.603 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -3.461 11.714 -6.817 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -3.428 10.110 -7.557 1.00 0.00 H new ATOM 77 N ILE A 52 -0.557 6.428 -4.523 1.00 0.00 N ATOM 78 CA ILE A 52 0.093 5.127 -4.596 1.00 0.00 C ATOM 79 C ILE A 52 -0.258 4.276 -3.385 1.00 0.00 C ATOM 80 O ILE A 52 -0.335 3.061 -3.538 1.00 0.00 O ATOM 81 CB ILE A 52 1.623 5.268 -4.757 1.00 0.00 C ATOM 82 CG1 ILE A 52 2.288 3.922 -5.098 1.00 0.00 C ATOM 83 CG2 ILE A 52 2.309 5.808 -3.499 1.00 0.00 C ATOM 84 CD1 ILE A 52 3.591 4.073 -5.888 1.00 0.00 C ATOM 0 H ILE A 52 0.091 7.211 -4.436 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.282 4.618 -5.484 1.00 0.00 H new ATOM 0 HB ILE A 52 1.751 5.979 -5.574 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.492 3.381 -4.174 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.590 3.315 -5.675 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.382 5.885 -3.674 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.909 6.794 -3.261 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.125 5.131 -2.665 1.00 0.00 H new ATOM 0 HD11 ILE A 52 4.007 3.087 -6.095 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.389 4.586 -6.828 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.305 4.653 -5.304 1.00 0.00 H new ATOM 96 N VAL A 53 -0.457 4.870 -2.199 1.00 0.00 N ATOM 97 CA VAL A 53 -0.782 4.130 -1.001 1.00 0.00 C ATOM 98 C VAL A 53 -2.092 3.410 -1.296 1.00 0.00 C ATOM 99 O VAL A 53 -2.109 2.179 -1.299 1.00 0.00 O ATOM 100 CB VAL A 53 -0.753 5.140 0.170 1.00 0.00 C ATOM 101 CG1 VAL A 53 -1.518 4.755 1.420 1.00 0.00 C ATOM 102 CG2 VAL A 53 0.684 5.400 0.648 1.00 0.00 C ATOM 0 H VAL A 53 -0.394 5.878 -2.058 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.085 3.347 -0.701 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.237 6.009 -0.276 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.419 5.545 2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.571 4.617 1.174 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.115 3.825 1.821 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.670 6.114 1.471 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.130 4.465 0.986 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.273 5.806 -0.174 1.00 0.00 H new ATOM 112 N ASP A 54 -3.137 4.162 -1.628 1.00 0.00 N ATOM 113 CA ASP A 54 -4.474 3.663 -1.966 1.00 0.00 C ATOM 114 C ASP A 54 -4.438 2.450 -2.902 1.00 0.00 C ATOM 115 O ASP A 54 -4.927 1.372 -2.564 1.00 0.00 O ATOM 116 CB ASP A 54 -5.266 4.772 -2.678 1.00 0.00 C ATOM 117 CG ASP A 54 -6.726 4.408 -2.918 1.00 0.00 C ATOM 118 OD1 ASP A 54 -7.502 4.437 -1.939 1.00 0.00 O ATOM 119 OD2 ASP A 54 -7.110 4.254 -4.095 1.00 0.00 O ATOM 0 H ASP A 54 -3.077 5.179 -1.672 1.00 0.00 H new ATOM 0 HA ASP A 54 -4.941 3.363 -1.028 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -5.219 5.683 -2.082 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -4.791 4.992 -3.634 1.00 0.00 H new ATOM 124 N LYS A 55 -3.820 2.616 -4.073 1.00 0.00 N ATOM 125 CA LYS A 55 -3.720 1.587 -5.102 1.00 0.00 C ATOM 126 C LYS A 55 -2.885 0.404 -4.658 1.00 0.00 C ATOM 127 O LYS A 55 -3.243 -0.745 -4.931 1.00 0.00 O ATOM 128 CB LYS A 55 -3.171 2.223 -6.376 1.00 0.00 C ATOM 129 CG LYS A 55 -4.285 3.016 -7.077 1.00 0.00 C ATOM 130 CD LYS A 55 -3.775 3.698 -8.349 1.00 0.00 C ATOM 131 CE LYS A 55 -3.375 2.666 -9.414 1.00 0.00 C ATOM 132 NZ LYS A 55 -2.916 3.305 -10.662 1.00 0.00 N ATOM 0 H LYS A 55 -3.366 3.491 -4.335 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.714 1.184 -5.295 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.337 2.883 -6.135 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.785 1.452 -7.042 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -5.107 2.346 -7.327 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.682 3.767 -6.395 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -4.549 4.354 -8.748 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.917 4.326 -8.108 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.583 2.029 -9.021 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -4.226 2.020 -9.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.656 2.572 -11.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -3.680 3.893 -11.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.088 3.901 -10.462 1.00 0.00 H new ATOM 146 N THR A 56 -1.769 0.655 -3.982 1.00 0.00 N ATOM 147 CA THR A 56 -0.950 -0.445 -3.503 1.00 0.00 C ATOM 148 C THR A 56 -1.783 -1.267 -2.515 1.00 0.00 C ATOM 149 O THR A 56 -1.745 -2.498 -2.570 1.00 0.00 O ATOM 150 CB THR A 56 0.367 0.063 -2.923 1.00 0.00 C ATOM 151 OG1 THR A 56 1.009 0.839 -3.908 1.00 0.00 O ATOM 152 CG2 THR A 56 1.265 -1.121 -2.541 1.00 0.00 C ATOM 0 H THR A 56 -1.420 1.587 -3.759 1.00 0.00 H new ATOM 0 HA THR A 56 -0.661 -1.099 -4.325 1.00 0.00 H new ATOM 0 HB THR A 56 0.176 0.658 -2.030 1.00 0.00 H new ATOM 0 HG1 THR A 56 0.622 1.739 -3.919 1.00 0.00 H new ATOM 0 HG21 THR A 56 2.202 -0.748 -2.128 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.759 -1.736 -1.796 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.472 -1.721 -3.427 1.00 0.00 H new ATOM 160 N ALA A 57 -2.554 -0.605 -1.640 1.00 0.00 N ATOM 161 CA ALA A 57 -3.379 -1.327 -0.691 1.00 0.00 C ATOM 162 C ALA A 57 -4.397 -2.156 -1.458 1.00 0.00 C ATOM 163 O ALA A 57 -4.531 -3.319 -1.126 1.00 0.00 O ATOM 164 CB ALA A 57 -4.069 -0.423 0.319 1.00 0.00 C ATOM 0 H ALA A 57 -2.616 0.411 -1.578 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.724 -1.973 -0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.669 -1.028 0.998 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.319 0.126 0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.714 0.282 -0.205 1.00 0.00 H new ATOM 170 N SER A 58 -5.052 -1.628 -2.490 1.00 0.00 N ATOM 171 CA SER A 58 -6.030 -2.368 -3.279 1.00 0.00 C ATOM 172 C SER A 58 -5.488 -3.762 -3.648 1.00 0.00 C ATOM 173 O SER A 58 -6.033 -4.783 -3.236 1.00 0.00 O ATOM 174 CB SER A 58 -6.373 -1.533 -4.522 1.00 0.00 C ATOM 175 OG SER A 58 -7.525 -2.020 -5.166 1.00 0.00 O ATOM 0 H SER A 58 -4.917 -0.667 -2.803 1.00 0.00 H new ATOM 0 HA SER A 58 -6.939 -2.534 -2.701 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.528 -0.494 -4.232 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.532 -1.549 -5.216 1.00 0.00 H new ATOM 0 HG SER A 58 -8.323 -1.657 -4.728 1.00 0.00 H new ATOM 181 N PHE A 59 -4.349 -3.830 -4.339 1.00 0.00 N ATOM 182 CA PHE A 59 -3.760 -5.102 -4.746 1.00 0.00 C ATOM 183 C PHE A 59 -3.382 -6.001 -3.567 1.00 0.00 C ATOM 184 O PHE A 59 -3.660 -7.203 -3.602 1.00 0.00 O ATOM 185 CB PHE A 59 -2.527 -4.816 -5.593 1.00 0.00 C ATOM 186 CG PHE A 59 -2.029 -6.015 -6.373 1.00 0.00 C ATOM 187 CD1 PHE A 59 -1.103 -6.903 -5.795 1.00 0.00 C ATOM 188 CD2 PHE A 59 -2.520 -6.263 -7.668 1.00 0.00 C ATOM 189 CE1 PHE A 59 -0.684 -8.036 -6.510 1.00 0.00 C ATOM 190 CE2 PHE A 59 -2.094 -7.393 -8.384 1.00 0.00 C ATOM 191 CZ PHE A 59 -1.175 -8.281 -7.803 1.00 0.00 C ATOM 0 H PHE A 59 -3.814 -3.011 -4.629 1.00 0.00 H new ATOM 0 HA PHE A 59 -4.514 -5.646 -5.315 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -2.756 -4.010 -6.290 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.727 -4.459 -4.944 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -0.716 -6.713 -4.805 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -3.228 -5.580 -8.114 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.020 -8.723 -6.064 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -2.472 -7.578 -9.379 1.00 0.00 H new ATOM 0 HZ PHE A 59 -0.846 -9.152 -8.350 1.00 0.00 H new ATOM 201 N VAL A 60 -2.722 -5.447 -2.546 1.00 0.00 N ATOM 202 CA VAL A 60 -2.302 -6.185 -1.354 1.00 0.00 C ATOM 203 C VAL A 60 -3.524 -6.731 -0.601 1.00 0.00 C ATOM 204 O VAL A 60 -3.474 -7.827 -0.056 1.00 0.00 O ATOM 205 CB VAL A 60 -1.321 -5.329 -0.541 1.00 0.00 C ATOM 206 CG1 VAL A 60 -0.900 -6.022 0.754 1.00 0.00 C ATOM 207 CG2 VAL A 60 -0.042 -5.057 -1.352 1.00 0.00 C ATOM 0 H VAL A 60 -2.462 -4.461 -2.525 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.739 -7.081 -1.615 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.842 -4.400 -0.308 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.206 -5.383 1.300 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.780 -6.210 1.369 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.413 -6.968 0.519 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.642 -4.449 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.438 -6.003 -1.603 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.299 -4.526 -2.269 1.00 0.00 H new ATOM 217 N ALA A 61 -4.641 -6.017 -0.626 1.00 0.00 N ATOM 218 CA ALA A 61 -5.879 -6.386 0.017 1.00 0.00 C ATOM 219 C ALA A 61 -6.532 -7.514 -0.779 1.00 0.00 C ATOM 220 O ALA A 61 -7.083 -8.439 -0.185 1.00 0.00 O ATOM 221 CB ALA A 61 -6.768 -5.137 0.069 1.00 0.00 C ATOM 0 H ALA A 61 -4.704 -5.126 -1.119 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.717 -6.747 1.033 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -7.714 -5.384 0.551 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -6.264 -4.355 0.637 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -6.958 -4.783 -0.944 1.00 0.00 H new ATOM 227 N ARG A 62 -6.451 -7.467 -2.117 1.00 0.00 N ATOM 228 CA ARG A 62 -7.051 -8.503 -2.944 1.00 0.00 C ATOM 229 C ARG A 62 -6.275 -9.812 -2.878 1.00 0.00 C ATOM 230 O ARG A 62 -6.858 -10.874 -2.649 1.00 0.00 O ATOM 231 CB ARG A 62 -7.182 -8.032 -4.402 1.00 0.00 C ATOM 232 CG ARG A 62 -8.245 -6.937 -4.534 1.00 0.00 C ATOM 233 CD ARG A 62 -8.777 -6.829 -5.964 1.00 0.00 C ATOM 234 NE ARG A 62 -9.824 -5.802 -6.079 1.00 0.00 N ATOM 235 CZ ARG A 62 -11.085 -5.862 -5.637 1.00 0.00 C ATOM 236 NH1 ARG A 62 -11.563 -6.952 -5.043 1.00 0.00 N ATOM 237 NH2 ARG A 62 -11.870 -4.811 -5.810 1.00 0.00 N ATOM 0 H ARG A 62 -5.979 -6.727 -2.637 1.00 0.00 H new ATOM 0 HA ARG A 62 -8.047 -8.692 -2.544 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.222 -7.655 -4.753 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.445 -8.877 -5.038 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.071 -7.148 -3.854 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -7.820 -5.980 -4.231 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.956 -6.589 -6.640 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -9.177 -7.793 -6.277 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.556 -4.940 -6.553 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -10.964 -7.768 -4.916 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.529 -6.972 -4.715 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.510 -3.976 -6.273 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.835 -4.836 -5.481 1.00 0.00 H new ATOM 251 N ASN A 63 -4.973 -9.747 -3.126 1.00 0.00 N ATOM 252 CA ASN A 63 -4.106 -10.925 -3.138 1.00 0.00 C ATOM 253 C ASN A 63 -3.796 -11.448 -1.740 1.00 0.00 C ATOM 254 O ASN A 63 -3.879 -12.653 -1.512 1.00 0.00 O ATOM 255 CB ASN A 63 -2.786 -10.623 -3.858 1.00 0.00 C ATOM 256 CG ASN A 63 -2.957 -10.362 -5.347 1.00 0.00 C ATOM 257 OD1 ASN A 63 -2.658 -11.207 -6.182 1.00 0.00 O ATOM 258 ND2 ASN A 63 -3.442 -9.189 -5.721 1.00 0.00 N ATOM 0 H ASN A 63 -4.484 -8.874 -3.325 1.00 0.00 H new ATOM 0 HA ASN A 63 -4.659 -11.698 -3.672 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.319 -9.754 -3.395 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -2.105 -11.462 -3.720 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -3.570 -8.982 -6.712 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -3.688 -8.492 -5.019 1.00 0.00 H new ATOM 265 N GLY A 64 -3.469 -10.562 -0.802 1.00 0.00 N ATOM 266 CA GLY A 64 -3.131 -10.894 0.571 1.00 0.00 C ATOM 267 C GLY A 64 -1.874 -10.136 1.017 1.00 0.00 C ATOM 268 O GLY A 64 -1.133 -9.592 0.186 1.00 0.00 O ATOM 0 H GLY A 64 -3.432 -9.560 -0.988 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.965 -10.644 1.227 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.966 -11.968 0.661 1.00 0.00 H new ATOM 272 N PRO A 65 -1.578 -10.141 2.329 1.00 0.00 N ATOM 273 CA PRO A 65 -0.431 -9.449 2.914 1.00 0.00 C ATOM 274 C PRO A 65 0.924 -9.953 2.423 1.00 0.00 C ATOM 275 O PRO A 65 1.932 -9.291 2.675 1.00 0.00 O ATOM 276 CB PRO A 65 -0.575 -9.606 4.430 1.00 0.00 C ATOM 277 CG PRO A 65 -1.446 -10.849 4.582 1.00 0.00 C ATOM 278 CD PRO A 65 -2.372 -10.766 3.373 1.00 0.00 C ATOM 0 HA PRO A 65 -0.441 -8.404 2.604 1.00 0.00 H new ATOM 0 HB2 PRO A 65 0.394 -9.734 4.913 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -1.043 -8.731 4.881 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -0.851 -11.762 4.573 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.003 -10.840 5.519 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.713 -11.756 3.069 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.261 -10.177 3.598 1.00 0.00 H new ATOM 286 N GLU A 66 0.974 -11.091 1.726 1.00 0.00 N ATOM 287 CA GLU A 66 2.208 -11.648 1.195 1.00 0.00 C ATOM 288 C GLU A 66 2.881 -10.638 0.263 1.00 0.00 C ATOM 289 O GLU A 66 4.108 -10.506 0.246 1.00 0.00 O ATOM 290 CB GLU A 66 1.909 -12.978 0.467 1.00 0.00 C ATOM 291 CG GLU A 66 1.087 -12.894 -0.843 1.00 0.00 C ATOM 292 CD GLU A 66 0.992 -14.228 -1.602 1.00 0.00 C ATOM 293 OE1 GLU A 66 1.158 -15.302 -0.983 1.00 0.00 O ATOM 294 OE2 GLU A 66 0.845 -14.210 -2.847 1.00 0.00 O ATOM 0 H GLU A 66 0.149 -11.652 1.516 1.00 0.00 H new ATOM 0 HA GLU A 66 2.897 -11.857 2.013 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.859 -13.461 0.240 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.377 -13.631 1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.081 -12.548 -0.608 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.537 -12.146 -1.496 1.00 0.00 H new ATOM 301 N PHE A 67 2.060 -9.909 -0.496 1.00 0.00 N ATOM 302 CA PHE A 67 2.514 -8.920 -1.447 1.00 0.00 C ATOM 303 C PHE A 67 3.070 -7.698 -0.764 1.00 0.00 C ATOM 304 O PHE A 67 3.960 -7.061 -1.316 1.00 0.00 O ATOM 305 CB PHE A 67 1.386 -8.540 -2.401 1.00 0.00 C ATOM 306 CG PHE A 67 1.391 -9.412 -3.624 1.00 0.00 C ATOM 307 CD1 PHE A 67 2.294 -9.120 -4.661 1.00 0.00 C ATOM 308 CD2 PHE A 67 0.544 -10.526 -3.708 1.00 0.00 C ATOM 309 CE1 PHE A 67 2.326 -9.927 -5.810 1.00 0.00 C ATOM 310 CE2 PHE A 67 0.558 -11.320 -4.867 1.00 0.00 C ATOM 311 CZ PHE A 67 1.445 -11.017 -5.921 1.00 0.00 C ATOM 0 H PHE A 67 1.045 -9.999 -0.458 1.00 0.00 H new ATOM 0 HA PHE A 67 3.325 -9.366 -2.023 1.00 0.00 H new ATOM 0 HB2 PHE A 67 0.428 -8.632 -1.890 1.00 0.00 H new ATOM 0 HB3 PHE A 67 1.492 -7.496 -2.695 1.00 0.00 H new ATOM 0 HD1 PHE A 67 2.962 -8.276 -4.574 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -0.114 -10.772 -2.888 1.00 0.00 H new ATOM 0 HE1 PHE A 67 3.024 -9.711 -6.605 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -0.111 -12.163 -4.951 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.447 -11.623 -6.815 1.00 0.00 H new ATOM 321 N GLU A 68 2.564 -7.372 0.420 1.00 0.00 N ATOM 322 CA GLU A 68 3.031 -6.213 1.146 1.00 0.00 C ATOM 323 C GLU A 68 4.523 -6.342 1.417 1.00 0.00 C ATOM 324 O GLU A 68 5.256 -5.368 1.294 1.00 0.00 O ATOM 325 CB GLU A 68 2.278 -6.125 2.481 1.00 0.00 C ATOM 326 CG GLU A 68 2.412 -4.748 3.123 1.00 0.00 C ATOM 327 CD GLU A 68 1.597 -4.647 4.413 1.00 0.00 C ATOM 328 OE1 GLU A 68 0.354 -4.736 4.331 1.00 0.00 O ATOM 329 OE2 GLU A 68 2.199 -4.392 5.489 1.00 0.00 O ATOM 0 H GLU A 68 1.830 -7.899 0.892 1.00 0.00 H new ATOM 0 HA GLU A 68 2.850 -5.315 0.556 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.224 -6.348 2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.662 -6.882 3.164 1.00 0.00 H new ATOM 0 HG2 GLU A 68 3.461 -4.547 3.338 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.079 -3.984 2.420 1.00 0.00 H new ATOM 336 N ALA A 69 4.950 -7.548 1.798 1.00 0.00 N ATOM 337 CA ALA A 69 6.337 -7.820 2.105 1.00 0.00 C ATOM 338 C ALA A 69 7.165 -7.920 0.829 1.00 0.00 C ATOM 339 O ALA A 69 8.230 -7.314 0.747 1.00 0.00 O ATOM 340 CB ALA A 69 6.426 -9.121 2.908 1.00 0.00 C ATOM 0 H ALA A 69 4.336 -8.356 1.899 1.00 0.00 H new ATOM 0 HA ALA A 69 6.741 -6.999 2.698 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.469 -9.333 3.143 1.00 0.00 H new ATOM 0 HB2 ALA A 69 5.859 -9.017 3.833 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.013 -9.941 2.320 1.00 0.00 H new ATOM 346 N ARG A 70 6.680 -8.672 -0.166 1.00 0.00 N ATOM 347 CA ARG A 70 7.382 -8.863 -1.428 1.00 0.00 C ATOM 348 C ARG A 70 7.643 -7.543 -2.122 1.00 0.00 C ATOM 349 O ARG A 70 8.798 -7.227 -2.374 1.00 0.00 O ATOM 350 CB ARG A 70 6.575 -9.789 -2.326 1.00 0.00 C ATOM 351 CG ARG A 70 6.631 -11.229 -1.812 1.00 0.00 C ATOM 352 CD ARG A 70 5.456 -11.967 -2.426 1.00 0.00 C ATOM 353 NE ARG A 70 5.319 -13.337 -1.919 1.00 0.00 N ATOM 354 CZ ARG A 70 4.394 -14.197 -2.353 1.00 0.00 C ATOM 355 NH1 ARG A 70 3.604 -13.869 -3.369 1.00 0.00 N ATOM 356 NH2 ARG A 70 4.251 -15.372 -1.754 1.00 0.00 N ATOM 0 H ARG A 70 5.788 -9.163 -0.113 1.00 0.00 H new ATOM 0 HA ARG A 70 8.350 -9.318 -1.218 1.00 0.00 H new ATOM 0 HB2 ARG A 70 5.539 -9.452 -2.366 1.00 0.00 H new ATOM 0 HB3 ARG A 70 6.964 -9.746 -3.343 1.00 0.00 H new ATOM 0 HG2 ARG A 70 7.572 -11.702 -2.092 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.574 -11.252 -0.724 1.00 0.00 H new ATOM 0 HD2 ARG A 70 4.539 -11.415 -2.221 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.576 -11.995 -3.509 1.00 0.00 H new ATOM 0 HE ARG A 70 5.966 -13.650 -1.195 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.703 -12.959 -3.819 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.898 -14.527 -3.699 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.847 -15.617 -0.963 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.545 -16.030 -2.084 1.00 0.00 H new ATOM 370 N ILE A 71 6.592 -6.780 -2.434 1.00 0.00 N ATOM 371 CA ILE A 71 6.716 -5.494 -3.113 1.00 0.00 C ATOM 372 C ILE A 71 7.717 -4.632 -2.345 1.00 0.00 C ATOM 373 O ILE A 71 8.612 -4.047 -2.955 1.00 0.00 O ATOM 374 CB ILE A 71 5.339 -4.799 -3.235 1.00 0.00 C ATOM 375 CG1 ILE A 71 4.317 -5.615 -4.057 1.00 0.00 C ATOM 376 CG2 ILE A 71 5.493 -3.419 -3.893 1.00 0.00 C ATOM 377 CD1 ILE A 71 2.871 -5.192 -3.763 1.00 0.00 C ATOM 0 H ILE A 71 5.629 -7.041 -2.221 1.00 0.00 H new ATOM 0 HA ILE A 71 7.081 -5.645 -4.129 1.00 0.00 H new ATOM 0 HB ILE A 71 4.960 -4.707 -2.217 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.523 -5.488 -5.120 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.437 -6.675 -3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 71 4.516 -2.942 -3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 71 6.152 -2.798 -3.286 1.00 0.00 H new ATOM 0 HG23 ILE A 71 5.921 -3.536 -4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 71 2.187 -5.792 -4.363 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.655 -5.344 -2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.742 -4.138 -4.011 1.00 0.00 H new ATOM 389 N ARG A 72 7.581 -4.571 -1.015 1.00 0.00 N ATOM 390 CA ARG A 72 8.467 -3.780 -0.184 1.00 0.00 C ATOM 391 C ARG A 72 9.918 -4.185 -0.371 1.00 0.00 C ATOM 392 O ARG A 72 10.744 -3.305 -0.590 1.00 0.00 O ATOM 393 CB ARG A 72 8.048 -3.881 1.281 1.00 0.00 C ATOM 394 CG ARG A 72 8.777 -2.847 2.139 1.00 0.00 C ATOM 395 CD ARG A 72 8.204 -2.870 3.554 1.00 0.00 C ATOM 396 NE ARG A 72 8.823 -3.873 4.425 1.00 0.00 N ATOM 397 CZ ARG A 72 8.446 -4.091 5.686 1.00 0.00 C ATOM 398 NH1 ARG A 72 7.441 -3.393 6.208 1.00 0.00 N ATOM 399 NH2 ARG A 72 9.076 -4.992 6.426 1.00 0.00 N ATOM 0 H ARG A 72 6.856 -5.068 -0.497 1.00 0.00 H new ATOM 0 HA ARG A 72 8.384 -2.739 -0.496 1.00 0.00 H new ATOM 0 HB2 ARG A 72 6.971 -3.732 1.365 1.00 0.00 H new ATOM 0 HB3 ARG A 72 8.262 -4.882 1.654 1.00 0.00 H new ATOM 0 HG2 ARG A 72 9.845 -3.065 2.163 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.665 -1.853 1.705 1.00 0.00 H new ATOM 0 HD2 ARG A 72 8.329 -1.885 4.003 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.132 -3.061 3.499 1.00 0.00 H new ATOM 0 HE ARG A 72 9.585 -4.436 4.046 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.960 -2.692 5.644 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.152 -3.559 7.172 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.853 -5.522 6.032 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.784 -5.155 7.390 1.00 0.00 H new ATOM 413 N GLN A 73 10.231 -5.478 -0.286 1.00 0.00 N ATOM 414 CA GLN A 73 11.591 -5.972 -0.429 1.00 0.00 C ATOM 415 C GLN A 73 12.130 -5.841 -1.855 1.00 0.00 C ATOM 416 O GLN A 73 13.313 -5.549 -2.029 1.00 0.00 O ATOM 417 CB GLN A 73 11.670 -7.429 0.068 1.00 0.00 C ATOM 418 CG GLN A 73 12.963 -7.696 0.850 1.00 0.00 C ATOM 419 CD GLN A 73 12.973 -6.933 2.177 1.00 0.00 C ATOM 420 OE1 GLN A 73 12.339 -7.347 3.141 1.00 0.00 O ATOM 421 NE2 GLN A 73 13.652 -5.802 2.264 1.00 0.00 N ATOM 0 H GLN A 73 9.542 -6.211 -0.115 1.00 0.00 H new ATOM 0 HA GLN A 73 12.233 -5.344 0.188 1.00 0.00 H new ATOM 0 HB2 GLN A 73 10.810 -7.643 0.703 1.00 0.00 H new ATOM 0 HB3 GLN A 73 11.614 -8.107 -0.784 1.00 0.00 H new ATOM 0 HG2 GLN A 73 13.062 -8.765 1.041 1.00 0.00 H new ATOM 0 HG3 GLN A 73 13.823 -7.398 0.250 1.00 0.00 H new ATOM 0 HE21 GLN A 73 14.179 -5.460 1.460 1.00 0.00 H new ATOM 0 HE22 GLN A 73 13.649 -5.271 3.135 1.00 0.00 H new ATOM 430 N ASN A 74 11.277 -6.019 -2.862 1.00 0.00 N ATOM 431 CA ASN A 74 11.633 -5.942 -4.276 1.00 0.00 C ATOM 432 C ASN A 74 12.008 -4.519 -4.671 1.00 0.00 C ATOM 433 O ASN A 74 12.977 -4.306 -5.403 1.00 0.00 O ATOM 434 CB ASN A 74 10.461 -6.429 -5.153 1.00 0.00 C ATOM 435 CG ASN A 74 10.156 -7.915 -4.973 1.00 0.00 C ATOM 436 OD1 ASN A 74 11.023 -8.692 -4.574 1.00 0.00 O ATOM 437 ND2 ASN A 74 8.922 -8.344 -5.206 1.00 0.00 N ATOM 0 H ASN A 74 10.290 -6.227 -2.711 1.00 0.00 H new ATOM 0 HA ASN A 74 12.497 -6.587 -4.436 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.570 -5.849 -4.913 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.694 -6.236 -6.200 1.00 0.00 H new ATOM 0 HD21 ASN A 74 8.686 -9.325 -5.055 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.210 -7.693 -5.537 1.00 0.00 H new ATOM 444 N GLU A 75 11.276 -3.537 -4.149 1.00 0.00 N ATOM 445 CA GLU A 75 11.454 -2.117 -4.418 1.00 0.00 C ATOM 446 C GLU A 75 12.024 -1.390 -3.196 1.00 0.00 C ATOM 447 O GLU A 75 11.782 -0.198 -3.006 1.00 0.00 O ATOM 448 CB GLU A 75 10.100 -1.542 -4.868 1.00 0.00 C ATOM 449 CG GLU A 75 9.629 -2.118 -6.209 1.00 0.00 C ATOM 450 CD GLU A 75 10.519 -1.634 -7.351 1.00 0.00 C ATOM 451 OE1 GLU A 75 10.238 -0.539 -7.890 1.00 0.00 O ATOM 452 OE2 GLU A 75 11.434 -2.366 -7.781 1.00 0.00 O ATOM 0 H GLU A 75 10.511 -3.720 -3.500 1.00 0.00 H new ATOM 0 HA GLU A 75 12.183 -1.970 -5.215 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.350 -1.749 -4.105 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.180 -0.458 -4.951 1.00 0.00 H new ATOM 0 HG2 GLU A 75 9.644 -3.207 -6.167 1.00 0.00 H new ATOM 0 HG3 GLU A 75 8.597 -1.820 -6.395 1.00 0.00 H new ATOM 459 N ILE A 76 12.771 -2.079 -2.328 1.00 0.00 N ATOM 460 CA ILE A 76 13.354 -1.490 -1.115 1.00 0.00 C ATOM 461 C ILE A 76 14.373 -0.382 -1.420 1.00 0.00 C ATOM 462 O ILE A 76 14.774 0.383 -0.542 1.00 0.00 O ATOM 463 CB ILE A 76 13.946 -2.620 -0.249 1.00 0.00 C ATOM 464 CG1 ILE A 76 14.268 -2.202 1.199 1.00 0.00 C ATOM 465 CG2 ILE A 76 15.186 -3.245 -0.912 1.00 0.00 C ATOM 466 CD1 ILE A 76 13.095 -1.586 1.961 1.00 0.00 C ATOM 0 H ILE A 76 12.991 -3.068 -2.447 1.00 0.00 H new ATOM 0 HA ILE A 76 12.565 -0.990 -0.554 1.00 0.00 H new ATOM 0 HB ILE A 76 13.156 -3.368 -0.183 1.00 0.00 H new ATOM 0 HG12 ILE A 76 14.620 -3.077 1.746 1.00 0.00 H new ATOM 0 HG13 ILE A 76 15.089 -1.485 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 76 15.578 -4.038 -0.275 1.00 0.00 H new ATOM 0 HG22 ILE A 76 14.910 -3.661 -1.881 1.00 0.00 H new ATOM 0 HG23 ILE A 76 15.950 -2.479 -1.050 1.00 0.00 H new ATOM 0 HD11 ILE A 76 13.414 -1.323 2.969 1.00 0.00 H new ATOM 0 HD12 ILE A 76 12.755 -0.690 1.443 1.00 0.00 H new ATOM 0 HD13 ILE A 76 12.278 -2.306 2.015 1.00 0.00 H new ATOM 478 N ASN A 77 14.822 -0.300 -2.669 1.00 0.00 N ATOM 479 CA ASN A 77 15.783 0.679 -3.151 1.00 0.00 C ATOM 480 C ASN A 77 15.053 1.828 -3.861 1.00 0.00 C ATOM 481 O ASN A 77 15.691 2.597 -4.580 1.00 0.00 O ATOM 482 CB ASN A 77 16.795 -0.029 -4.070 1.00 0.00 C ATOM 483 CG ASN A 77 17.436 -1.248 -3.419 1.00 0.00 C ATOM 484 OD1 ASN A 77 17.125 -2.383 -3.772 1.00 0.00 O ATOM 485 ND2 ASN A 77 18.298 -1.066 -2.437 1.00 0.00 N ATOM 0 H ASN A 77 14.512 -0.941 -3.400 1.00 0.00 H new ATOM 0 HA ASN A 77 16.331 1.119 -2.318 1.00 0.00 H new ATOM 0 HB2 ASN A 77 16.292 -0.336 -4.987 1.00 0.00 H new ATOM 0 HB3 ASN A 77 17.575 0.677 -4.355 1.00 0.00 H new ATOM 0 HD21 ASN A 77 18.711 -1.871 -1.965 1.00 0.00 H new ATOM 0 HD22 ASN A 77 18.551 -0.121 -2.149 1.00 0.00 H new ATOM 492 N ASN A 78 13.727 1.956 -3.696 1.00 0.00 N ATOM 493 CA ASN A 78 12.921 2.996 -4.328 1.00 0.00 C ATOM 494 C ASN A 78 12.052 3.714 -3.298 1.00 0.00 C ATOM 495 O ASN A 78 11.239 3.069 -2.631 1.00 0.00 O ATOM 496 CB ASN A 78 12.044 2.403 -5.439 1.00 0.00 C ATOM 497 CG ASN A 78 12.874 2.123 -6.672 1.00 0.00 C ATOM 498 OD1 ASN A 78 13.532 1.093 -6.771 1.00 0.00 O ATOM 499 ND2 ASN A 78 12.895 3.040 -7.623 1.00 0.00 N ATOM 0 H ASN A 78 13.182 1.326 -3.108 1.00 0.00 H new ATOM 0 HA ASN A 78 13.601 3.723 -4.772 1.00 0.00 H new ATOM 0 HB2 ASN A 78 11.577 1.482 -5.090 1.00 0.00 H new ATOM 0 HB3 ASN A 78 11.239 3.095 -5.684 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.465 2.897 -8.457 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.341 3.891 -7.523 1.00 0.00 H new ATOM 506 N PRO A 79 12.149 5.052 -3.208 1.00 0.00 N ATOM 507 CA PRO A 79 11.379 5.857 -2.266 1.00 0.00 C ATOM 508 C PRO A 79 9.885 5.825 -2.584 1.00 0.00 C ATOM 509 O PRO A 79 9.040 6.000 -1.704 1.00 0.00 O ATOM 510 CB PRO A 79 11.964 7.262 -2.362 1.00 0.00 C ATOM 511 CG PRO A 79 12.538 7.310 -3.775 1.00 0.00 C ATOM 512 CD PRO A 79 13.053 5.902 -3.961 1.00 0.00 C ATOM 0 HA PRO A 79 11.453 5.470 -1.249 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.201 8.026 -2.212 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.735 7.429 -1.609 1.00 0.00 H new ATOM 0 HG2 PRO A 79 11.779 7.566 -4.514 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.334 8.049 -3.866 1.00 0.00 H new ATOM 0 HD2 PRO A 79 13.064 5.625 -5.015 1.00 0.00 H new ATOM 0 HD3 PRO A 79 14.076 5.807 -3.596 1.00 0.00 H new ATOM 520 N LYS A 80 9.561 5.547 -3.845 1.00 0.00 N ATOM 521 CA LYS A 80 8.214 5.444 -4.373 1.00 0.00 C ATOM 522 C LYS A 80 7.380 4.462 -3.547 1.00 0.00 C ATOM 523 O LYS A 80 6.211 4.738 -3.292 1.00 0.00 O ATOM 524 CB LYS A 80 8.335 5.002 -5.849 1.00 0.00 C ATOM 525 CG LYS A 80 8.004 6.131 -6.828 1.00 0.00 C ATOM 526 CD LYS A 80 6.490 6.363 -6.928 1.00 0.00 C ATOM 527 CE LYS A 80 6.127 7.447 -7.950 1.00 0.00 C ATOM 528 NZ LYS A 80 6.404 7.034 -9.342 1.00 0.00 N ATOM 0 H LYS A 80 10.271 5.380 -4.558 1.00 0.00 H new ATOM 0 HA LYS A 80 7.697 6.402 -4.316 1.00 0.00 H new ATOM 0 HB2 LYS A 80 9.349 4.648 -6.037 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.665 4.161 -6.029 1.00 0.00 H new ATOM 0 HG2 LYS A 80 8.493 7.050 -6.504 1.00 0.00 H new ATOM 0 HG3 LYS A 80 8.402 5.888 -7.813 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.000 5.429 -7.205 1.00 0.00 H new ATOM 0 HD3 LYS A 80 6.104 6.648 -5.949 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.070 7.694 -7.852 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.688 8.354 -7.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 6.078 7.775 -9.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.427 6.890 -9.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.902 6.147 -9.547 1.00 0.00 H new ATOM 542 N PHE A 81 7.990 3.365 -3.095 1.00 0.00 N ATOM 543 CA PHE A 81 7.394 2.285 -2.314 1.00 0.00 C ATOM 544 C PHE A 81 7.737 2.337 -0.830 1.00 0.00 C ATOM 545 O PHE A 81 7.241 1.505 -0.071 1.00 0.00 O ATOM 546 CB PHE A 81 7.897 0.976 -2.917 1.00 0.00 C ATOM 547 CG PHE A 81 7.461 0.738 -4.353 1.00 0.00 C ATOM 548 CD1 PHE A 81 8.151 1.343 -5.423 1.00 0.00 C ATOM 549 CD2 PHE A 81 6.363 -0.094 -4.626 1.00 0.00 C ATOM 550 CE1 PHE A 81 7.723 1.153 -6.747 1.00 0.00 C ATOM 551 CE2 PHE A 81 5.968 -0.330 -5.954 1.00 0.00 C ATOM 552 CZ PHE A 81 6.630 0.313 -7.015 1.00 0.00 C ATOM 0 H PHE A 81 8.979 3.199 -3.278 1.00 0.00 H new ATOM 0 HA PHE A 81 6.309 2.379 -2.363 1.00 0.00 H new ATOM 0 HB2 PHE A 81 8.986 0.965 -2.874 1.00 0.00 H new ATOM 0 HB3 PHE A 81 7.546 0.148 -2.301 1.00 0.00 H new ATOM 0 HD1 PHE A 81 9.016 1.958 -5.223 1.00 0.00 H new ATOM 0 HD2 PHE A 81 5.821 -0.554 -3.813 1.00 0.00 H new ATOM 0 HE1 PHE A 81 8.233 1.652 -7.558 1.00 0.00 H new ATOM 0 HE2 PHE A 81 5.153 -1.008 -6.160 1.00 0.00 H new ATOM 0 HZ PHE A 81 6.299 0.161 -8.032 1.00 0.00 H new ATOM 562 N ASN A 82 8.521 3.325 -0.388 1.00 0.00 N ATOM 563 CA ASN A 82 8.924 3.454 1.008 1.00 0.00 C ATOM 564 C ASN A 82 7.757 3.425 1.994 1.00 0.00 C ATOM 565 O ASN A 82 7.971 2.992 3.126 1.00 0.00 O ATOM 566 CB ASN A 82 9.755 4.721 1.236 1.00 0.00 C ATOM 567 CG ASN A 82 11.252 4.565 1.028 1.00 0.00 C ATOM 568 OD1 ASN A 82 11.751 3.568 0.512 1.00 0.00 O ATOM 569 ND2 ASN A 82 12.008 5.589 1.374 1.00 0.00 N ATOM 0 H ASN A 82 8.893 4.057 -0.993 1.00 0.00 H new ATOM 0 HA ASN A 82 9.534 2.573 1.208 1.00 0.00 H new ATOM 0 HB2 ASN A 82 9.391 5.499 0.565 1.00 0.00 H new ATOM 0 HB3 ASN A 82 9.581 5.071 2.254 1.00 0.00 H new ATOM 0 HD21 ASN A 82 13.015 5.557 1.214 1.00 0.00 H new ATOM 0 HD22 ASN A 82 11.586 6.413 1.802 1.00 0.00 H new ATOM 576 N PHE A 83 6.547 3.837 1.591 1.00 0.00 N ATOM 577 CA PHE A 83 5.356 3.855 2.449 1.00 0.00 C ATOM 578 C PHE A 83 5.044 2.476 3.048 1.00 0.00 C ATOM 579 O PHE A 83 4.391 2.380 4.089 1.00 0.00 O ATOM 580 CB PHE A 83 4.150 4.433 1.686 1.00 0.00 C ATOM 581 CG PHE A 83 3.707 3.604 0.492 1.00 0.00 C ATOM 582 CD1 PHE A 83 2.903 2.464 0.681 1.00 0.00 C ATOM 583 CD2 PHE A 83 4.133 3.935 -0.809 1.00 0.00 C ATOM 584 CE1 PHE A 83 2.598 1.629 -0.406 1.00 0.00 C ATOM 585 CE2 PHE A 83 3.856 3.084 -1.882 1.00 0.00 C ATOM 586 CZ PHE A 83 3.112 1.922 -1.678 1.00 0.00 C ATOM 0 H PHE A 83 6.366 4.172 0.645 1.00 0.00 H new ATOM 0 HA PHE A 83 5.570 4.510 3.294 1.00 0.00 H new ATOM 0 HB2 PHE A 83 3.312 4.531 2.376 1.00 0.00 H new ATOM 0 HB3 PHE A 83 4.400 5.437 1.343 1.00 0.00 H new ATOM 0 HD1 PHE A 83 2.520 2.231 1.664 1.00 0.00 H new ATOM 0 HD2 PHE A 83 4.677 4.852 -0.978 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.969 0.763 -0.263 1.00 0.00 H new ATOM 0 HE2 PHE A 83 4.218 3.326 -2.870 1.00 0.00 H new ATOM 0 HZ PHE A 83 2.931 1.246 -2.501 1.00 0.00 H new ATOM 596 N LEU A 84 5.503 1.398 2.404 1.00 0.00 N ATOM 597 CA LEU A 84 5.299 0.029 2.852 1.00 0.00 C ATOM 598 C LEU A 84 6.115 -0.286 4.113 1.00 0.00 C ATOM 599 O LEU A 84 5.868 -1.297 4.775 1.00 0.00 O ATOM 600 CB LEU A 84 5.709 -0.919 1.711 1.00 0.00 C ATOM 601 CG LEU A 84 4.717 -0.978 0.544 1.00 0.00 C ATOM 602 CD1 LEU A 84 5.294 -1.829 -0.587 1.00 0.00 C ATOM 603 CD2 LEU A 84 3.378 -1.573 0.987 1.00 0.00 C ATOM 0 H LEU A 84 6.038 1.461 1.538 1.00 0.00 H new ATOM 0 HA LEU A 84 4.248 -0.105 3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.681 -0.608 1.329 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.833 -1.923 2.117 1.00 0.00 H new ATOM 0 HG LEU A 84 4.549 0.041 0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.584 -1.867 -1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 84 6.229 -1.389 -0.933 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.481 -2.839 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.694 -1.602 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.535 -2.585 1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 84 2.949 -0.956 1.777 1.00 0.00 H new ATOM 615 N ASN A 85 7.112 0.534 4.440 1.00 0.00 N ATOM 616 CA ASN A 85 7.974 0.370 5.608 1.00 0.00 C ATOM 617 C ASN A 85 7.498 1.280 6.737 1.00 0.00 C ATOM 618 O ASN A 85 7.019 2.382 6.475 1.00 0.00 O ATOM 619 CB ASN A 85 9.423 0.784 5.318 1.00 0.00 C ATOM 620 CG ASN A 85 10.083 0.089 4.140 1.00 0.00 C ATOM 621 OD1 ASN A 85 10.751 -0.935 4.292 1.00 0.00 O ATOM 622 ND2 ASN A 85 9.898 0.649 2.965 1.00 0.00 N ATOM 0 H ASN A 85 7.349 1.355 3.883 1.00 0.00 H new ATOM 0 HA ASN A 85 7.928 -0.685 5.876 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.446 1.859 5.141 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.021 0.595 6.209 1.00 0.00 H new ATOM 0 HD21 ASN A 85 10.316 0.235 2.131 1.00 0.00 H new ATOM 0 HD22 ASN A 85 9.337 1.497 2.887 1.00 0.00 H new ATOM 629 N PRO A 86 7.742 0.901 8.001 1.00 0.00 N ATOM 630 CA PRO A 86 7.349 1.687 9.165 1.00 0.00 C ATOM 631 C PRO A 86 8.057 3.045 9.259 1.00 0.00 C ATOM 632 O PRO A 86 7.583 3.903 10.002 1.00 0.00 O ATOM 633 CB PRO A 86 7.699 0.815 10.378 1.00 0.00 C ATOM 634 CG PRO A 86 8.778 -0.121 9.844 1.00 0.00 C ATOM 635 CD PRO A 86 8.308 -0.367 8.422 1.00 0.00 C ATOM 0 HA PRO A 86 6.289 1.933 9.106 1.00 0.00 H new ATOM 0 HB2 PRO A 86 8.065 1.415 11.211 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.831 0.263 10.739 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.767 0.337 9.873 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.838 -1.045 10.419 1.00 0.00 H new ATOM 0 HD2 PRO A 86 9.134 -0.666 7.777 1.00 0.00 H new ATOM 0 HD3 PRO A 86 7.567 -1.165 8.382 1.00 0.00 H new ATOM 643 N ASN A 87 9.177 3.232 8.547 1.00 0.00 N ATOM 644 CA ASN A 87 9.964 4.466 8.537 1.00 0.00 C ATOM 645 C ASN A 87 9.222 5.624 7.866 1.00 0.00 C ATOM 646 O ASN A 87 9.631 6.772 8.034 1.00 0.00 O ATOM 647 CB ASN A 87 11.278 4.273 7.747 1.00 0.00 C ATOM 648 CG ASN A 87 12.281 3.323 8.380 1.00 0.00 C ATOM 649 OD1 ASN A 87 13.148 3.729 9.144 1.00 0.00 O ATOM 650 ND2 ASN A 87 12.186 2.025 8.136 1.00 0.00 N ATOM 0 H ASN A 87 9.569 2.507 7.946 1.00 0.00 H new ATOM 0 HA ASN A 87 10.155 4.701 9.584 1.00 0.00 H new ATOM 0 HB2 ASN A 87 11.033 3.906 6.750 1.00 0.00 H new ATOM 0 HB3 ASN A 87 11.753 5.246 7.620 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.831 1.374 8.583 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.467 1.677 7.501 1.00 0.00 H new ATOM 657 N ASP A 88 8.193 5.356 7.058 1.00 0.00 N ATOM 658 CA ASP A 88 7.453 6.411 6.367 1.00 0.00 C ATOM 659 C ASP A 88 6.270 6.890 7.208 1.00 0.00 C ATOM 660 O ASP A 88 5.701 6.115 7.981 1.00 0.00 O ATOM 661 CB ASP A 88 7.022 5.929 4.975 1.00 0.00 C ATOM 662 CG ASP A 88 7.936 6.477 3.872 1.00 0.00 C ATOM 663 OD1 ASP A 88 9.165 6.608 4.098 1.00 0.00 O ATOM 664 OD2 ASP A 88 7.421 6.801 2.777 1.00 0.00 O ATOM 0 H ASP A 88 7.854 4.413 6.867 1.00 0.00 H new ATOM 0 HA ASP A 88 8.107 7.272 6.229 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.034 4.839 4.948 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.995 6.241 4.784 1.00 0.00 H new ATOM 669 N PRO A 89 5.848 8.155 7.052 1.00 0.00 N ATOM 670 CA PRO A 89 4.750 8.728 7.814 1.00 0.00 C ATOM 671 C PRO A 89 3.384 8.228 7.350 1.00 0.00 C ATOM 672 O PRO A 89 2.472 8.139 8.172 1.00 0.00 O ATOM 673 CB PRO A 89 4.890 10.242 7.650 1.00 0.00 C ATOM 674 CG PRO A 89 5.646 10.423 6.338 1.00 0.00 C ATOM 675 CD PRO A 89 6.437 9.137 6.161 1.00 0.00 C ATOM 0 HA PRO A 89 4.804 8.428 8.860 1.00 0.00 H new ATOM 0 HB2 PRO A 89 3.915 10.728 7.615 1.00 0.00 H new ATOM 0 HB3 PRO A 89 5.436 10.682 8.485 1.00 0.00 H new ATOM 0 HG2 PRO A 89 4.960 10.583 5.506 1.00 0.00 H new ATOM 0 HG3 PRO A 89 6.305 11.290 6.378 1.00 0.00 H new ATOM 0 HD2 PRO A 89 6.393 8.796 5.127 1.00 0.00 H new ATOM 0 HD3 PRO A 89 7.489 9.294 6.400 1.00 0.00 H new ATOM 683 N TYR A 90 3.226 7.884 6.069 1.00 0.00 N ATOM 684 CA TYR A 90 1.967 7.393 5.504 1.00 0.00 C ATOM 685 C TYR A 90 1.741 5.912 5.798 1.00 0.00 C ATOM 686 O TYR A 90 0.667 5.408 5.482 1.00 0.00 O ATOM 687 CB TYR A 90 1.931 7.627 3.983 1.00 0.00 C ATOM 688 CG TYR A 90 1.663 9.064 3.588 1.00 0.00 C ATOM 689 CD1 TYR A 90 2.695 10.012 3.675 1.00 0.00 C ATOM 690 CD2 TYR A 90 0.381 9.463 3.160 1.00 0.00 C ATOM 691 CE1 TYR A 90 2.442 11.361 3.392 1.00 0.00 C ATOM 692 CE2 TYR A 90 0.129 10.809 2.837 1.00 0.00 C ATOM 693 CZ TYR A 90 1.156 11.772 2.972 1.00 0.00 C ATOM 694 OH TYR A 90 0.897 13.082 2.697 1.00 0.00 O ATOM 0 H TYR A 90 3.981 7.940 5.385 1.00 0.00 H new ATOM 0 HA TYR A 90 1.165 7.956 5.982 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.884 7.315 3.555 1.00 0.00 H new ATOM 0 HB3 TYR A 90 1.161 6.991 3.546 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.689 9.700 3.961 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.411 8.733 3.080 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.233 12.090 3.495 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.848 11.107 2.486 1.00 0.00 H new ATOM 0 HH TYR A 90 -0.038 13.180 2.422 1.00 0.00 H new ATOM 704 N HIS A 91 2.710 5.219 6.399 1.00 0.00 N ATOM 705 CA HIS A 91 2.594 3.803 6.710 1.00 0.00 C ATOM 706 C HIS A 91 1.338 3.499 7.532 1.00 0.00 C ATOM 707 O HIS A 91 0.542 2.654 7.131 1.00 0.00 O ATOM 708 CB HIS A 91 3.863 3.354 7.425 1.00 0.00 C ATOM 709 CG HIS A 91 3.878 1.871 7.678 1.00 0.00 C ATOM 710 ND1 HIS A 91 4.265 0.927 6.762 1.00 0.00 N ATOM 711 CD2 HIS A 91 3.444 1.210 8.796 1.00 0.00 C ATOM 712 CE1 HIS A 91 4.140 -0.276 7.344 1.00 0.00 C ATOM 713 NE2 HIS A 91 3.676 -0.154 8.600 1.00 0.00 N ATOM 0 H HIS A 91 3.599 5.631 6.683 1.00 0.00 H new ATOM 0 HA HIS A 91 2.486 3.240 5.783 1.00 0.00 H new ATOM 0 HB2 HIS A 91 4.732 3.628 6.826 1.00 0.00 H new ATOM 0 HB3 HIS A 91 3.950 3.884 8.374 1.00 0.00 H new ATOM 0 HD1 HIS A 91 4.589 1.106 5.812 1.00 0.00 H new ATOM 0 HD2 HIS A 91 3.002 1.662 9.672 1.00 0.00 H new ATOM 0 HE1 HIS A 91 4.380 -1.215 6.868 1.00 0.00 H new ATOM 721 N ALA A 92 1.119 4.204 8.648 1.00 0.00 N ATOM 722 CA ALA A 92 -0.052 3.978 9.491 1.00 0.00 C ATOM 723 C ALA A 92 -1.372 4.148 8.725 1.00 0.00 C ATOM 724 O ALA A 92 -2.337 3.449 9.035 1.00 0.00 O ATOM 725 CB ALA A 92 0.007 4.905 10.700 1.00 0.00 C ATOM 0 H ALA A 92 1.742 4.937 8.986 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.029 2.941 9.827 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -0.867 4.737 11.330 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.912 4.700 11.272 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.018 5.942 10.363 1.00 0.00 H new ATOM 731 N TYR A 93 -1.415 5.051 7.740 1.00 0.00 N ATOM 732 CA TYR A 93 -2.582 5.313 6.908 1.00 0.00 C ATOM 733 C TYR A 93 -2.727 4.192 5.869 1.00 0.00 C ATOM 734 O TYR A 93 -3.845 3.753 5.603 1.00 0.00 O ATOM 735 CB TYR A 93 -2.446 6.701 6.268 1.00 0.00 C ATOM 736 CG TYR A 93 -3.414 6.969 5.136 1.00 0.00 C ATOM 737 CD1 TYR A 93 -4.770 7.208 5.407 1.00 0.00 C ATOM 738 CD2 TYR A 93 -2.962 6.922 3.806 1.00 0.00 C ATOM 739 CE1 TYR A 93 -5.661 7.444 4.352 1.00 0.00 C ATOM 740 CE2 TYR A 93 -3.850 7.091 2.729 1.00 0.00 C ATOM 741 CZ TYR A 93 -5.204 7.411 3.022 1.00 0.00 C ATOM 742 OH TYR A 93 -6.106 7.714 2.055 1.00 0.00 O ATOM 0 H TYR A 93 -0.614 5.633 7.497 1.00 0.00 H new ATOM 0 HA TYR A 93 -3.493 5.319 7.507 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -2.590 7.458 7.039 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.429 6.816 5.894 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -5.126 7.210 6.427 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -1.914 6.753 3.608 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.700 7.652 4.560 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -3.513 6.981 1.709 1.00 0.00 H new ATOM 0 HH TYR A 93 -5.675 7.659 1.177 1.00 0.00 H new ATOM 752 N TYR A 94 -1.617 3.699 5.299 1.00 0.00 N ATOM 753 CA TYR A 94 -1.626 2.611 4.321 1.00 0.00 C ATOM 754 C TYR A 94 -2.312 1.395 4.962 1.00 0.00 C ATOM 755 O TYR A 94 -3.084 0.696 4.302 1.00 0.00 O ATOM 756 CB TYR A 94 -0.188 2.279 3.855 1.00 0.00 C ATOM 757 CG TYR A 94 -0.074 1.017 3.012 1.00 0.00 C ATOM 758 CD1 TYR A 94 0.066 -0.218 3.657 1.00 0.00 C ATOM 759 CD2 TYR A 94 -0.164 1.040 1.610 1.00 0.00 C ATOM 760 CE1 TYR A 94 0.066 -1.419 2.933 1.00 0.00 C ATOM 761 CE2 TYR A 94 -0.216 -0.157 0.879 1.00 0.00 C ATOM 762 CZ TYR A 94 -0.100 -1.394 1.540 1.00 0.00 C ATOM 763 OH TYR A 94 -0.159 -2.557 0.847 1.00 0.00 O ATOM 0 H TYR A 94 -0.683 4.050 5.509 1.00 0.00 H new ATOM 0 HA TYR A 94 -2.180 2.909 3.431 1.00 0.00 H new ATOM 0 HB2 TYR A 94 0.198 3.121 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 94 0.450 2.173 4.733 1.00 0.00 H new ATOM 0 HD1 TYR A 94 0.176 -0.246 4.731 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.193 1.986 1.091 1.00 0.00 H new ATOM 0 HE1 TYR A 94 0.193 -2.361 3.446 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -0.345 -0.129 -0.193 1.00 0.00 H new ATOM 0 HH TYR A 94 -0.511 -2.385 -0.051 1.00 0.00 H new ATOM 773 N ARG A 95 -2.056 1.160 6.258 1.00 0.00 N ATOM 774 CA ARG A 95 -2.657 0.050 7.002 1.00 0.00 C ATOM 775 C ARG A 95 -4.186 0.155 6.940 1.00 0.00 C ATOM 776 O ARG A 95 -4.856 -0.856 6.728 1.00 0.00 O ATOM 777 CB ARG A 95 -2.208 0.020 8.477 1.00 0.00 C ATOM 778 CG ARG A 95 -0.709 -0.121 8.784 1.00 0.00 C ATOM 779 CD ARG A 95 -0.073 -1.328 8.100 1.00 0.00 C ATOM 780 NE ARG A 95 1.213 -1.668 8.708 1.00 0.00 N ATOM 781 CZ ARG A 95 1.425 -2.380 9.817 1.00 0.00 C ATOM 782 NH1 ARG A 95 0.430 -3.008 10.436 1.00 0.00 N ATOM 783 NH2 ARG A 95 2.658 -2.416 10.302 1.00 0.00 N ATOM 0 H ARG A 95 -1.426 1.736 6.817 1.00 0.00 H new ATOM 0 HA ARG A 95 -2.318 -0.874 6.534 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -2.558 0.938 8.949 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -2.725 -0.806 8.964 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -0.192 0.784 8.467 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.571 -0.206 9.862 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.746 -2.183 8.167 1.00 0.00 H new ATOM 0 HD3 ARG A 95 0.068 -1.115 7.040 1.00 0.00 H new ATOM 0 HE ARG A 95 2.044 -1.321 8.229 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -0.518 -2.951 10.065 1.00 0.00 H new ATOM 0 HH12 ARG A 95 0.615 -3.547 11.282 1.00 0.00 H new ATOM 0 HH21 ARG A 95 3.407 -1.910 9.829 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.858 -2.950 11.148 1.00 0.00 H new ATOM 797 N HIS A 96 -4.742 1.363 7.108 1.00 0.00 N ATOM 798 CA HIS A 96 -6.185 1.573 7.053 1.00 0.00 C ATOM 799 C HIS A 96 -6.705 1.131 5.702 1.00 0.00 C ATOM 800 O HIS A 96 -7.648 0.343 5.655 1.00 0.00 O ATOM 801 CB HIS A 96 -6.573 3.048 7.285 1.00 0.00 C ATOM 802 CG HIS A 96 -8.069 3.278 7.305 1.00 0.00 C ATOM 803 ND1 HIS A 96 -8.847 3.383 8.431 1.00 0.00 N ATOM 804 CD2 HIS A 96 -8.906 3.403 6.223 1.00 0.00 C ATOM 805 CE1 HIS A 96 -10.114 3.567 8.045 1.00 0.00 C ATOM 806 NE2 HIS A 96 -10.209 3.591 6.706 1.00 0.00 N ATOM 0 H HIS A 96 -4.205 2.212 7.284 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.632 0.983 7.853 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -6.148 3.384 8.231 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.129 3.661 6.501 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.613 3.363 5.184 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -10.949 3.681 8.720 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -11.056 3.720 6.153 1.00 0.00 H new ATOM 814 N LYS A 97 -6.107 1.630 4.616 1.00 0.00 N ATOM 815 CA LYS A 97 -6.529 1.293 3.267 1.00 0.00 C ATOM 816 C LYS A 97 -6.540 -0.214 3.056 1.00 0.00 C ATOM 817 O LYS A 97 -7.494 -0.697 2.459 1.00 0.00 O ATOM 818 CB LYS A 97 -5.610 1.924 2.238 1.00 0.00 C ATOM 819 CG LYS A 97 -5.488 3.455 2.290 1.00 0.00 C ATOM 820 CD LYS A 97 -6.842 4.165 2.277 1.00 0.00 C ATOM 821 CE LYS A 97 -7.608 3.873 0.989 1.00 0.00 C ATOM 822 NZ LYS A 97 -8.828 4.693 0.877 1.00 0.00 N ATOM 0 H LYS A 97 -5.319 2.277 4.655 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.539 1.682 3.140 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -4.615 1.496 2.358 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.961 1.641 1.245 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.944 3.740 3.190 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.898 3.796 1.439 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.432 3.843 3.135 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.693 5.240 2.378 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -6.963 4.064 0.132 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.876 2.817 0.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.319 4.465 -0.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.456 4.493 1.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.571 5.701 0.881 1.00 0.00 H new ATOM 836 N VAL A 98 -5.520 -0.950 3.516 1.00 0.00 N ATOM 837 CA VAL A 98 -5.481 -2.401 3.349 1.00 0.00 C ATOM 838 C VAL A 98 -6.773 -2.977 3.909 1.00 0.00 C ATOM 839 O VAL A 98 -7.482 -3.694 3.204 1.00 0.00 O ATOM 840 CB VAL A 98 -4.244 -3.014 4.037 1.00 0.00 C ATOM 841 CG1 VAL A 98 -4.308 -4.556 4.022 1.00 0.00 C ATOM 842 CG2 VAL A 98 -2.917 -2.499 3.440 1.00 0.00 C ATOM 0 H VAL A 98 -4.714 -0.561 4.005 1.00 0.00 H new ATOM 0 HA VAL A 98 -5.397 -2.648 2.291 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.264 -2.684 5.076 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -3.424 -4.962 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -5.201 -4.888 4.551 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -4.344 -4.909 2.991 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -2.079 -2.963 3.961 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.871 -2.754 2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -2.862 -1.417 3.556 1.00 0.00 H new ATOM 852 N SER A 99 -7.104 -2.617 5.152 1.00 0.00 N ATOM 853 CA SER A 99 -8.314 -3.116 5.771 1.00 0.00 C ATOM 854 C SER A 99 -9.539 -2.724 4.942 1.00 0.00 C ATOM 855 O SER A 99 -10.386 -3.557 4.667 1.00 0.00 O ATOM 856 CB SER A 99 -8.417 -2.640 7.231 1.00 0.00 C ATOM 857 OG SER A 99 -8.821 -1.290 7.407 1.00 0.00 O ATOM 0 H SER A 99 -6.552 -1.989 5.736 1.00 0.00 H new ATOM 0 HA SER A 99 -8.276 -4.205 5.796 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.123 -3.284 7.756 1.00 0.00 H new ATOM 0 HB3 SER A 99 -7.447 -2.776 7.708 1.00 0.00 H new ATOM 0 HG SER A 99 -8.266 -0.707 6.848 1.00 0.00 H new ATOM 863 N GLU A 100 -9.611 -1.468 4.511 1.00 0.00 N ATOM 864 CA GLU A 100 -10.680 -0.859 3.737 1.00 0.00 C ATOM 865 C GLU A 100 -10.998 -1.648 2.474 1.00 0.00 C ATOM 866 O GLU A 100 -12.160 -1.990 2.230 1.00 0.00 O ATOM 867 CB GLU A 100 -10.266 0.581 3.393 1.00 0.00 C ATOM 868 CG GLU A 100 -11.332 1.608 3.781 1.00 0.00 C ATOM 869 CD GLU A 100 -11.100 2.987 3.161 1.00 0.00 C ATOM 870 OE1 GLU A 100 -9.938 3.424 3.013 1.00 0.00 O ATOM 871 OE2 GLU A 100 -12.097 3.651 2.789 1.00 0.00 O ATOM 0 H GLU A 100 -8.865 -0.802 4.711 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.592 -0.859 4.334 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.334 0.819 3.905 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.070 0.653 2.323 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -12.310 1.239 3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.355 1.705 4.866 1.00 0.00 H new ATOM 878 N PHE A 101 -9.970 -1.912 1.667 1.00 0.00 N ATOM 879 CA PHE A 101 -10.105 -2.653 0.436 1.00 0.00 C ATOM 880 C PHE A 101 -10.446 -4.113 0.737 1.00 0.00 C ATOM 881 O PHE A 101 -11.168 -4.743 -0.031 1.00 0.00 O ATOM 882 CB PHE A 101 -8.823 -2.483 -0.393 1.00 0.00 C ATOM 883 CG PHE A 101 -8.744 -1.199 -1.211 1.00 0.00 C ATOM 884 CD1 PHE A 101 -9.283 -1.172 -2.509 1.00 0.00 C ATOM 885 CD2 PHE A 101 -8.047 -0.068 -0.741 1.00 0.00 C ATOM 886 CE1 PHE A 101 -9.096 -0.044 -3.329 1.00 0.00 C ATOM 887 CE2 PHE A 101 -7.888 1.068 -1.555 1.00 0.00 C ATOM 888 CZ PHE A 101 -8.408 1.084 -2.857 1.00 0.00 C ATOM 0 H PHE A 101 -9.015 -1.610 1.861 1.00 0.00 H new ATOM 0 HA PHE A 101 -10.931 -2.266 -0.161 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -7.967 -2.519 0.280 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.732 -3.332 -1.070 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -9.842 -2.019 -2.878 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.630 -0.074 0.255 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -9.487 -0.047 -4.336 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -7.363 1.932 -1.175 1.00 0.00 H new ATOM 0 HZ PHE A 101 -8.281 1.952 -3.487 1.00 0.00 H new ATOM 898 N LYS A 102 -9.975 -4.661 1.858 1.00 0.00 N ATOM 899 CA LYS A 102 -10.278 -6.053 2.217 1.00 0.00 C ATOM 900 C LYS A 102 -11.731 -6.214 2.644 1.00 0.00 C ATOM 901 O LYS A 102 -12.382 -7.188 2.273 1.00 0.00 O ATOM 902 CB LYS A 102 -9.379 -6.476 3.369 1.00 0.00 C ATOM 903 CG LYS A 102 -8.011 -6.915 2.890 1.00 0.00 C ATOM 904 CD LYS A 102 -7.071 -6.994 4.078 1.00 0.00 C ATOM 905 CE LYS A 102 -7.070 -8.395 4.695 1.00 0.00 C ATOM 906 NZ LYS A 102 -7.449 -8.374 6.120 1.00 0.00 N ATOM 0 H LYS A 102 -9.386 -4.169 2.530 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.105 -6.676 1.340 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.269 -5.646 4.067 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -9.851 -7.292 3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -8.078 -7.886 2.399 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -7.627 -6.210 2.153 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -6.061 -6.732 3.763 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -7.370 -6.264 4.830 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -7.762 -9.033 4.146 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -6.079 -8.836 4.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -7.435 -9.343 6.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -6.774 -7.786 6.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -8.405 -7.978 6.219 1.00 0.00 H new ATOM 920 N GLU A 103 -12.238 -5.278 3.444 1.00 0.00 N ATOM 921 CA GLU A 103 -13.611 -5.285 3.940 1.00 0.00 C ATOM 922 C GLU A 103 -14.591 -4.972 2.804 1.00 0.00 C ATOM 923 O GLU A 103 -15.794 -5.140 2.965 1.00 0.00 O ATOM 924 CB GLU A 103 -13.787 -4.229 5.043 1.00 0.00 C ATOM 925 CG GLU A 103 -12.744 -4.263 6.179 1.00 0.00 C ATOM 926 CD GLU A 103 -13.274 -4.475 7.591 1.00 0.00 C ATOM 927 OE1 GLU A 103 -13.561 -5.639 7.940 1.00 0.00 O ATOM 928 OE2 GLU A 103 -13.215 -3.505 8.384 1.00 0.00 O ATOM 0 H GLU A 103 -11.695 -4.479 3.771 1.00 0.00 H new ATOM 0 HA GLU A 103 -13.818 -6.277 4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -13.762 -3.242 4.582 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -14.778 -4.351 5.481 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -12.030 -5.057 5.961 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.191 -3.324 6.161 1.00 0.00 H new ATOM 935 N GLY A 104 -14.081 -4.483 1.672 1.00 0.00 N ATOM 936 CA GLY A 104 -14.851 -4.132 0.488 1.00 0.00 C ATOM 937 C GLY A 104 -15.648 -2.847 0.696 1.00 0.00 C ATOM 938 O GLY A 104 -16.748 -2.708 0.154 1.00 0.00 O ATOM 0 H GLY A 104 -13.082 -4.316 1.555 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -14.178 -4.010 -0.361 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -15.532 -4.947 0.241 1.00 0.00 H new ATOM 942 N LYS A 105 -15.137 -1.914 1.509 1.00 0.00 N ATOM 943 CA LYS A 105 -15.807 -0.642 1.800 1.00 0.00 C ATOM 944 C LYS A 105 -15.106 0.566 1.184 1.00 0.00 C ATOM 945 O LYS A 105 -15.699 1.644 1.158 1.00 0.00 O ATOM 946 CB LYS A 105 -15.959 -0.481 3.326 1.00 0.00 C ATOM 947 CG LYS A 105 -14.662 0.020 3.981 1.00 0.00 C ATOM 948 CD LYS A 105 -14.691 0.147 5.501 1.00 0.00 C ATOM 949 CE LYS A 105 -14.338 -1.179 6.178 1.00 0.00 C ATOM 950 NZ LYS A 105 -14.201 -1.048 7.641 1.00 0.00 N ATOM 0 H LYS A 105 -14.242 -2.022 1.986 1.00 0.00 H new ATOM 0 HA LYS A 105 -16.791 -0.676 1.333 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -16.767 0.219 3.539 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -16.242 -1.437 3.766 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -13.854 -0.658 3.707 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -14.417 0.995 3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.987 0.917 5.817 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -15.682 0.469 5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -15.110 -1.915 5.953 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -13.405 -1.559 5.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -13.677 -1.865 8.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -13.685 -0.173 7.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -15.145 -1.013 8.076 1.00 0.00 H new ATOM 964 N ALA A 106 -13.854 0.401 0.754 1.00 0.00 N ATOM 965 CA ALA A 106 -13.072 1.479 0.176 1.00 0.00 C ATOM 966 C ALA A 106 -13.714 2.056 -1.075 1.00 0.00 C ATOM 967 O ALA A 106 -14.507 1.392 -1.743 1.00 0.00 O ATOM 968 CB ALA A 106 -11.680 0.981 -0.205 1.00 0.00 C ATOM 0 H ALA A 106 -13.358 -0.489 0.800 1.00 0.00 H new ATOM 0 HA ALA A 106 -13.016 2.257 0.937 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -11.106 1.801 -0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -11.170 0.610 0.684 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -11.769 0.176 -0.935 1.00 0.00 H new ATOM 974 N GLN A 107 -13.279 3.259 -1.426 1.00 0.00 N ATOM 975 CA GLN A 107 -13.730 3.992 -2.587 1.00 0.00 C ATOM 976 C GLN A 107 -12.537 4.013 -3.528 1.00 0.00 C ATOM 977 O GLN A 107 -11.718 4.937 -3.526 1.00 0.00 O ATOM 978 CB GLN A 107 -14.252 5.367 -2.166 1.00 0.00 C ATOM 979 CG GLN A 107 -15.461 5.189 -1.242 1.00 0.00 C ATOM 980 CD GLN A 107 -16.188 6.510 -1.045 1.00 0.00 C ATOM 981 OE1 GLN A 107 -15.844 7.316 -0.185 1.00 0.00 O ATOM 982 NE2 GLN A 107 -17.175 6.814 -1.867 1.00 0.00 N ATOM 0 H GLN A 107 -12.577 3.764 -0.886 1.00 0.00 H new ATOM 0 HA GLN A 107 -14.577 3.538 -3.102 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -13.468 5.925 -1.654 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -14.534 5.946 -3.045 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -16.144 4.453 -1.666 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -15.133 4.801 -0.277 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -17.465 6.149 -2.583 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -17.647 7.714 -1.786 1.00 0.00 H new ATOM 991 N GLU A 108 -12.381 2.907 -4.245 1.00 0.00 N ATOM 992 CA GLU A 108 -11.318 2.683 -5.201 1.00 0.00 C ATOM 993 C GLU A 108 -11.423 3.668 -6.378 1.00 0.00 C ATOM 994 O GLU A 108 -12.508 4.203 -6.630 1.00 0.00 O ATOM 995 CB GLU A 108 -11.374 1.214 -5.639 1.00 0.00 C ATOM 996 CG GLU A 108 -12.498 0.845 -6.612 1.00 0.00 C ATOM 997 CD GLU A 108 -12.414 -0.638 -6.957 1.00 0.00 C ATOM 998 OE1 GLU A 108 -11.326 -1.122 -7.349 1.00 0.00 O ATOM 999 OE2 GLU A 108 -13.412 -1.371 -6.774 1.00 0.00 O ATOM 0 H GLU A 108 -13.019 2.115 -4.169 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.344 2.872 -4.749 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -10.421 0.957 -6.102 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -11.473 0.594 -4.748 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.467 1.070 -6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -12.418 1.444 -7.519 1.00 0.00 H new ATOM 1006 N PRO A 109 -10.323 3.920 -7.103 1.00 0.00 N ATOM 1007 CA PRO A 109 -10.313 4.828 -8.242 1.00 0.00 C ATOM 1008 C PRO A 109 -11.043 4.212 -9.444 1.00 0.00 C ATOM 1009 O PRO A 109 -11.593 3.109 -9.367 1.00 0.00 O ATOM 1010 CB PRO A 109 -8.835 5.112 -8.510 1.00 0.00 C ATOM 1011 CG PRO A 109 -8.153 3.827 -8.056 1.00 0.00 C ATOM 1012 CD PRO A 109 -9.002 3.353 -6.887 1.00 0.00 C ATOM 0 HA PRO A 109 -10.849 5.757 -8.047 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -8.648 5.318 -9.564 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -8.482 5.977 -7.949 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -8.125 3.086 -8.855 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -7.122 4.008 -7.753 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -9.045 2.264 -6.850 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -8.583 3.688 -5.938 1.00 0.00 H new ATOM 1020 N SER A 110 -11.072 4.931 -10.564 1.00 0.00 N ATOM 1021 CA SER A 110 -11.735 4.499 -11.783 1.00 0.00 C ATOM 1022 C SER A 110 -10.989 5.084 -12.967 1.00 0.00 C ATOM 1023 O SER A 110 -10.590 6.268 -12.893 1.00 0.00 O ATOM 1024 CB SER A 110 -13.191 4.980 -11.698 1.00 0.00 C ATOM 1025 OG SER A 110 -14.053 4.236 -12.538 1.00 0.00 O ATOM 0 H SER A 110 -10.627 5.845 -10.647 1.00 0.00 H new ATOM 0 HA SER A 110 -11.735 3.416 -11.906 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.537 4.903 -10.667 1.00 0.00 H new ATOM 0 HB3 SER A 110 -13.240 6.034 -11.973 1.00 0.00 H new ATOM 0 HG SER A 110 -14.968 4.575 -12.450 1.00 0.00 H new TER 1031 SER A 110