USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 943 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 111 THR OG1 : rot -19:sc= 0.0122 USER MOD Set 1.2: A 134 THR OG1 : rot 157:sc= 1.73 USER MOD Set 2.1: A 105 ASN : amide:sc=-0.00157 X(o=0.11,f=-0.057) USER MOD Set 2.2: A 109 THR OG1 : rot 180:sc= 0.108 USER MOD Set 3.1: A 63 THR OG1 : rot 31:sc= 1.03 USER MOD Set 3.2: A 65 THR OG1 : rot 180:sc= 0.0277 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc=-0.00057 K(o=-0.00057,f=-4.2!) USER MOD Single : A 17 GLN : amide:sc= 0.756 K(o=0.76,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0.0166 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.0694 K(o=-0.069,f=-0.76) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 79:sc= 1.2 USER MOD Single : A 90 SER OG : rot 148:sc= 1.19 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.0701 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot -135:sc= 0.831 USER MOD Single : A 114 LYS NZ :NH3+ 177:sc= -0.67 (180deg=-0.718) USER MOD Single : A 115 SER OG : rot -140:sc=-0.00744 USER MOD Single : A 133 HIS : no HE2:sc= 1.04 K(o=1,f=-3.3!) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.184 K(o=-0.18,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -12.020 9.455 7.267 1.00 0.00 N ATOM 32 CA GLY A 4 -12.527 9.608 5.913 1.00 0.00 C ATOM 33 C GLY A 4 -12.173 11.016 5.412 1.00 0.00 C ATOM 34 O GLY A 4 -11.415 11.735 6.061 1.00 0.00 O ATOM 0 HA2 GLY A 4 -12.091 8.853 5.259 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.607 9.461 5.895 1.00 0.00 H new ATOM 38 N GLU A 5 -12.718 11.399 4.254 1.00 0.00 N ATOM 39 CA GLU A 5 -12.576 12.670 3.547 1.00 0.00 C ATOM 40 C GLU A 5 -11.202 12.890 2.862 1.00 0.00 C ATOM 41 O GLU A 5 -10.169 12.696 3.496 1.00 0.00 O ATOM 42 CB GLU A 5 -12.990 13.764 4.527 1.00 0.00 C ATOM 43 CG GLU A 5 -13.356 15.088 3.870 1.00 0.00 C ATOM 44 CD GLU A 5 -14.236 15.926 4.790 1.00 0.00 C ATOM 45 OE1 GLU A 5 -15.469 15.716 4.753 1.00 0.00 O ATOM 46 OE2 GLU A 5 -13.713 16.825 5.497 1.00 0.00 O ATOM 0 H GLU A 5 -13.328 10.763 3.740 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.233 12.684 2.678 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -13.843 13.412 5.107 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.174 13.934 5.230 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.449 15.640 3.625 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -13.878 14.901 2.932 1.00 0.00 H new ATOM 53 N PRO A 6 -11.164 13.310 1.575 1.00 0.00 N ATOM 54 CA PRO A 6 -9.933 13.533 0.810 1.00 0.00 C ATOM 55 C PRO A 6 -9.021 14.572 1.447 1.00 0.00 C ATOM 56 O PRO A 6 -9.377 15.757 1.504 1.00 0.00 O ATOM 57 CB PRO A 6 -10.359 13.925 -0.611 1.00 0.00 C ATOM 58 CG PRO A 6 -11.780 14.441 -0.434 1.00 0.00 C ATOM 59 CD PRO A 6 -12.302 13.584 0.714 1.00 0.00 C ATOM 0 HA PRO A 6 -9.333 12.623 0.794 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -9.704 14.690 -1.028 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -10.325 13.072 -1.289 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -11.798 15.503 -0.189 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -12.374 14.313 -1.339 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -13.086 14.106 1.262 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -12.737 12.657 0.340 1.00 0.00 H new ATOM 67 N LEU A 7 -7.854 14.133 1.924 1.00 0.00 N ATOM 68 CA LEU A 7 -6.857 14.971 2.547 1.00 0.00 C ATOM 69 C LEU A 7 -5.837 15.229 1.459 1.00 0.00 C ATOM 70 O LEU A 7 -5.098 14.334 1.051 1.00 0.00 O ATOM 71 CB LEU A 7 -6.240 14.321 3.800 1.00 0.00 C ATOM 72 CG LEU A 7 -5.581 15.313 4.787 1.00 0.00 C ATOM 73 CD1 LEU A 7 -4.640 16.337 4.136 1.00 0.00 C ATOM 74 CD2 LEU A 7 -6.637 16.075 5.603 1.00 0.00 C ATOM 0 H LEU A 7 -7.579 13.152 1.880 1.00 0.00 H new ATOM 0 HA LEU A 7 -7.286 15.900 2.923 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.019 13.769 4.327 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.492 13.594 3.484 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.973 14.679 5.432 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.225 16.990 4.904 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.830 15.815 3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.196 16.935 3.414 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.141 16.764 6.287 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.283 16.636 4.928 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.237 15.366 6.174 1.00 0.00 H new ATOM 86 N VAL A 8 -5.913 16.409 0.870 1.00 0.00 N ATOM 87 CA VAL A 8 -4.997 16.843 -0.164 1.00 0.00 C ATOM 88 C VAL A 8 -3.816 17.398 0.624 1.00 0.00 C ATOM 89 O VAL A 8 -3.965 18.414 1.304 1.00 0.00 O ATOM 90 CB VAL A 8 -5.657 17.856 -1.122 1.00 0.00 C ATOM 91 CG1 VAL A 8 -4.671 18.292 -2.216 1.00 0.00 C ATOM 92 CG2 VAL A 8 -6.883 17.230 -1.811 1.00 0.00 C ATOM 0 H VAL A 8 -6.625 17.102 1.102 1.00 0.00 H new ATOM 0 HA VAL A 8 -4.681 16.046 -0.838 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.959 18.718 -0.526 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -5.157 19.006 -2.880 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -3.800 18.759 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -4.355 17.420 -2.789 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.335 17.960 -2.483 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -6.572 16.355 -2.382 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.611 16.931 -1.057 1.00 0.00 H new ATOM 102 N GLY A 9 -2.683 16.704 0.562 1.00 0.00 N ATOM 103 CA GLY A 9 -1.441 17.044 1.234 1.00 0.00 C ATOM 104 C GLY A 9 -0.869 18.395 0.817 1.00 0.00 C ATOM 105 O GLY A 9 -1.486 19.178 0.082 1.00 0.00 O ATOM 0 H GLY A 9 -2.607 15.847 0.013 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -1.610 17.048 2.311 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -0.703 16.268 1.030 1.00 0.00 H new ATOM 109 N GLY A 10 0.308 18.687 1.355 1.00 0.00 N ATOM 110 CA GLY A 10 1.036 19.913 1.137 1.00 0.00 C ATOM 111 C GLY A 10 1.918 19.877 -0.104 1.00 0.00 C ATOM 112 O GLY A 10 1.534 19.411 -1.178 1.00 0.00 O ATOM 0 H GLY A 10 0.795 18.044 1.980 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.328 20.737 1.047 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.656 20.119 2.009 1.00 0.00 H new ATOM 116 N ASP A 11 3.105 20.435 0.086 1.00 0.00 N ATOM 117 CA ASP A 11 4.228 20.628 -0.836 1.00 0.00 C ATOM 118 C ASP A 11 5.557 20.376 -0.092 1.00 0.00 C ATOM 119 O ASP A 11 6.627 20.793 -0.539 1.00 0.00 O ATOM 120 CB ASP A 11 4.098 22.059 -1.323 1.00 0.00 C ATOM 121 CG ASP A 11 4.899 22.496 -2.559 1.00 0.00 C ATOM 122 OD1 ASP A 11 4.544 22.134 -3.705 1.00 0.00 O ATOM 123 OD2 ASP A 11 5.773 23.384 -2.425 1.00 0.00 O ATOM 0 H ASP A 11 3.337 20.812 1.005 1.00 0.00 H new ATOM 0 HA ASP A 11 4.218 19.937 -1.679 1.00 0.00 H new ATOM 0 HB2 ASP A 11 3.044 22.242 -1.531 1.00 0.00 H new ATOM 0 HB3 ASP A 11 4.379 22.715 -0.499 1.00 0.00 H new ATOM 128 N THR A 12 5.459 19.770 1.098 1.00 0.00 N ATOM 129 CA THR A 12 6.536 19.413 2.020 1.00 0.00 C ATOM 130 C THR A 12 6.216 18.108 2.779 1.00 0.00 C ATOM 131 O THR A 12 5.056 17.694 2.852 1.00 0.00 O ATOM 132 CB THR A 12 6.764 20.566 3.025 1.00 0.00 C ATOM 133 OG1 THR A 12 5.557 20.934 3.679 1.00 0.00 O ATOM 134 CG2 THR A 12 7.359 21.819 2.378 1.00 0.00 C ATOM 0 H THR A 12 4.549 19.496 1.468 1.00 0.00 H new ATOM 0 HA THR A 12 7.443 19.249 1.438 1.00 0.00 H new ATOM 0 HB THR A 12 7.481 20.175 3.747 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.735 21.664 4.309 1.00 0.00 H new ATOM 0 HG21 THR A 12 7.494 22.591 3.136 1.00 0.00 H new ATOM 0 HG22 THR A 12 8.323 21.575 1.932 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.684 22.185 1.605 1.00 0.00 H new ATOM 142 N ASP A 13 7.245 17.564 3.439 1.00 0.00 N ATOM 143 CA ASP A 13 7.279 16.332 4.238 1.00 0.00 C ATOM 144 C ASP A 13 6.218 16.213 5.318 1.00 0.00 C ATOM 145 O ASP A 13 6.070 17.089 6.176 1.00 0.00 O ATOM 146 CB ASP A 13 8.623 16.176 4.953 1.00 0.00 C ATOM 147 CG ASP A 13 8.755 14.832 5.692 1.00 0.00 C ATOM 148 OD1 ASP A 13 8.751 13.788 4.996 1.00 0.00 O ATOM 149 OD2 ASP A 13 8.946 14.784 6.933 1.00 0.00 O ATOM 0 H ASP A 13 8.159 18.016 3.427 1.00 0.00 H new ATOM 0 HA ASP A 13 7.095 15.558 3.493 1.00 0.00 H new ATOM 0 HB2 ASP A 13 9.429 16.265 4.225 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.746 16.991 5.666 1.00 0.00 H new ATOM 154 N ASP A 14 5.518 15.085 5.283 1.00 0.00 N ATOM 155 CA ASP A 14 4.464 14.706 6.228 1.00 0.00 C ATOM 156 C ASP A 14 4.102 13.240 6.012 1.00 0.00 C ATOM 157 O ASP A 14 4.635 12.581 5.117 1.00 0.00 O ATOM 158 CB ASP A 14 3.181 15.558 6.106 1.00 0.00 C ATOM 159 CG ASP A 14 2.438 15.775 7.436 1.00 0.00 C ATOM 160 OD1 ASP A 14 2.604 14.984 8.402 1.00 0.00 O ATOM 161 OD2 ASP A 14 1.662 16.748 7.550 1.00 0.00 O ATOM 0 H ASP A 14 5.673 14.376 4.566 1.00 0.00 H new ATOM 0 HA ASP A 14 4.866 14.880 7.226 1.00 0.00 H new ATOM 0 HB2 ASP A 14 3.442 16.529 5.686 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.505 15.077 5.399 1.00 0.00 H new ATOM 166 N GLN A 15 3.210 12.744 6.863 1.00 0.00 N ATOM 167 CA GLN A 15 2.673 11.395 6.870 1.00 0.00 C ATOM 168 C GLN A 15 1.157 11.534 6.894 1.00 0.00 C ATOM 169 O GLN A 15 0.600 12.102 7.840 1.00 0.00 O ATOM 170 CB GLN A 15 3.233 10.536 8.017 1.00 0.00 C ATOM 171 CG GLN A 15 2.795 9.062 7.898 1.00 0.00 C ATOM 172 CD GLN A 15 1.589 8.747 8.782 1.00 0.00 C ATOM 173 OE1 GLN A 15 0.435 8.936 8.411 1.00 0.00 O ATOM 174 NE2 GLN A 15 1.823 8.323 10.015 1.00 0.00 N ATOM 0 H GLN A 15 2.820 13.314 7.614 1.00 0.00 H new ATOM 0 HA GLN A 15 2.982 10.850 5.978 1.00 0.00 H new ATOM 0 HB2 GLN A 15 4.322 10.593 8.015 1.00 0.00 H new ATOM 0 HB3 GLN A 15 2.895 10.939 8.971 1.00 0.00 H new ATOM 0 HG2 GLN A 15 2.550 8.840 6.859 1.00 0.00 H new ATOM 0 HG3 GLN A 15 3.626 8.414 8.175 1.00 0.00 H new ATOM 0 HE21 GLN A 15 2.781 8.165 10.327 1.00 0.00 H new ATOM 0 HE22 GLN A 15 1.045 8.155 10.653 1.00 0.00 H new ATOM 183 N LEU A 16 0.490 11.079 5.836 1.00 0.00 N ATOM 184 CA LEU A 16 -0.960 11.142 5.695 1.00 0.00 C ATOM 185 C LEU A 16 -1.555 9.798 6.099 1.00 0.00 C ATOM 186 O LEU A 16 -1.304 8.804 5.423 1.00 0.00 O ATOM 187 CB LEU A 16 -1.351 11.506 4.258 1.00 0.00 C ATOM 188 CG LEU A 16 -0.777 12.857 3.775 1.00 0.00 C ATOM 189 CD1 LEU A 16 0.198 12.623 2.618 1.00 0.00 C ATOM 190 CD2 LEU A 16 -1.911 13.783 3.328 1.00 0.00 C ATOM 0 H LEU A 16 0.954 10.647 5.037 1.00 0.00 H new ATOM 0 HA LEU A 16 -1.355 11.921 6.347 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.009 10.717 3.588 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -2.438 11.537 4.185 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.244 13.330 4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.600 13.579 2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.015 11.984 2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.325 12.139 1.793 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.494 14.732 2.990 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -2.461 13.316 2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.586 13.961 4.165 1.00 0.00 H new ATOM 202 N GLN A 17 -2.371 9.754 7.151 1.00 0.00 N ATOM 203 CA GLN A 17 -3.010 8.531 7.629 1.00 0.00 C ATOM 204 C GLN A 17 -4.454 8.410 7.135 1.00 0.00 C ATOM 205 O GLN A 17 -5.210 9.383 7.183 1.00 0.00 O ATOM 206 CB GLN A 17 -2.904 8.409 9.153 1.00 0.00 C ATOM 207 CG GLN A 17 -3.653 9.515 9.887 1.00 0.00 C ATOM 208 CD GLN A 17 -4.941 9.061 10.574 1.00 0.00 C ATOM 209 OE1 GLN A 17 -4.943 8.773 11.773 1.00 0.00 O ATOM 210 NE2 GLN A 17 -6.054 8.985 9.862 1.00 0.00 N ATOM 0 H GLN A 17 -2.609 10.579 7.702 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.468 7.688 7.201 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.298 7.441 9.464 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -1.854 8.433 9.443 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.991 9.950 10.636 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.894 10.306 9.177 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -6.043 9.225 8.871 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.923 8.686 10.305 1.00 0.00 H new ATOM 219 N GLY A 18 -4.883 7.195 6.798 1.00 0.00 N ATOM 220 CA GLY A 18 -6.231 6.887 6.322 1.00 0.00 C ATOM 221 C GLY A 18 -7.089 6.139 7.346 1.00 0.00 C ATOM 222 O GLY A 18 -8.277 5.921 7.128 1.00 0.00 O ATOM 0 H GLY A 18 -4.283 6.372 6.850 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -6.732 7.816 6.051 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -6.158 6.287 5.415 1.00 0.00 H new ATOM 226 N GLY A 19 -6.509 5.721 8.477 1.00 0.00 N ATOM 227 CA GLY A 19 -7.204 5.012 9.545 1.00 0.00 C ATOM 228 C GLY A 19 -7.914 3.732 9.088 1.00 0.00 C ATOM 229 O GLY A 19 -7.288 2.663 9.061 1.00 0.00 O ATOM 0 H GLY A 19 -5.520 5.872 8.675 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.486 4.758 10.325 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -7.938 5.682 9.993 1.00 0.00 H new ATOM 233 N SER A 20 -9.221 3.806 8.809 1.00 0.00 N ATOM 234 CA SER A 20 -10.032 2.677 8.383 1.00 0.00 C ATOM 235 C SER A 20 -11.289 3.104 7.602 1.00 0.00 C ATOM 236 O SER A 20 -11.687 4.271 7.629 1.00 0.00 O ATOM 237 CB SER A 20 -10.436 1.901 9.647 1.00 0.00 C ATOM 238 OG SER A 20 -11.259 2.670 10.515 1.00 0.00 O ATOM 0 H SER A 20 -9.749 4.676 8.877 1.00 0.00 H new ATOM 0 HA SER A 20 -9.447 2.061 7.700 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.965 0.993 9.359 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.538 1.591 10.182 1.00 0.00 H new ATOM 0 HG SER A 20 -11.492 2.136 11.303 1.00 0.00 H new ATOM 244 N GLY A 21 -11.997 2.139 7.005 1.00 0.00 N ATOM 245 CA GLY A 21 -13.232 2.317 6.263 1.00 0.00 C ATOM 246 C GLY A 21 -13.045 2.792 4.831 1.00 0.00 C ATOM 247 O GLY A 21 -12.546 2.019 4.015 1.00 0.00 O ATOM 0 H GLY A 21 -11.701 1.163 7.033 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -13.773 1.371 6.251 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.858 3.036 6.792 1.00 0.00 H new ATOM 251 N ALA A 22 -13.622 3.946 4.461 1.00 0.00 N ATOM 252 CA ALA A 22 -13.458 4.476 3.114 1.00 0.00 C ATOM 253 C ALA A 22 -12.844 5.862 3.257 1.00 0.00 C ATOM 254 O ALA A 22 -13.558 6.864 3.311 1.00 0.00 O ATOM 255 CB ALA A 22 -14.802 4.482 2.373 1.00 0.00 C ATOM 0 H ALA A 22 -14.200 4.520 5.075 1.00 0.00 H new ATOM 0 HA ALA A 22 -12.798 3.855 2.509 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.662 4.881 1.368 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -15.187 3.464 2.309 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.513 5.105 2.915 1.00 0.00 H new ATOM 261 N ASP A 23 -11.520 5.921 3.189 1.00 0.00 N ATOM 262 CA ASP A 23 -10.739 7.146 3.313 1.00 0.00 C ATOM 263 C ASP A 23 -9.983 7.359 1.996 1.00 0.00 C ATOM 264 O ASP A 23 -10.109 6.552 1.063 1.00 0.00 O ATOM 265 CB ASP A 23 -9.890 7.095 4.609 1.00 0.00 C ATOM 266 CG ASP A 23 -9.527 8.485 5.164 1.00 0.00 C ATOM 267 OD1 ASP A 23 -9.583 9.457 4.382 1.00 0.00 O ATOM 268 OD2 ASP A 23 -9.365 8.653 6.398 1.00 0.00 O ATOM 0 H ASP A 23 -10.942 5.093 3.042 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.352 8.038 3.444 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -10.438 6.541 5.371 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.972 6.541 4.411 1.00 0.00 H new ATOM 273 N ARG A 24 -9.430 8.551 1.796 1.00 0.00 N ATOM 274 CA ARG A 24 -8.674 8.921 0.609 1.00 0.00 C ATOM 275 C ARG A 24 -7.714 10.024 1.005 1.00 0.00 C ATOM 276 O ARG A 24 -8.077 10.921 1.762 1.00 0.00 O ATOM 277 CB ARG A 24 -9.561 9.353 -0.571 1.00 0.00 C ATOM 278 CG ARG A 24 -10.810 10.175 -0.251 1.00 0.00 C ATOM 279 CD ARG A 24 -11.961 9.346 0.311 1.00 0.00 C ATOM 280 NE ARG A 24 -13.248 9.850 -0.175 1.00 0.00 N ATOM 281 CZ ARG A 24 -14.350 9.119 -0.313 1.00 0.00 C ATOM 282 NH1 ARG A 24 -14.534 8.004 0.391 1.00 0.00 N ATOM 283 NH2 ARG A 24 -15.256 9.526 -1.191 1.00 0.00 N ATOM 0 H ARG A 24 -9.499 9.307 2.477 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.136 8.044 0.249 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -8.946 9.931 -1.261 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -9.876 8.454 -1.101 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -10.549 10.952 0.467 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -11.145 10.679 -1.158 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.840 8.303 0.020 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -11.940 9.378 1.400 1.00 0.00 H new ATOM 0 HE ARG A 24 -13.303 10.837 -0.427 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -13.822 7.695 1.052 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.387 7.459 0.269 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -15.095 10.375 -1.734 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.114 8.991 -1.324 1.00 0.00 H new ATOM 297 N LEU A 25 -6.518 10.009 0.435 1.00 0.00 N ATOM 298 CA LEU A 25 -5.489 10.989 0.718 1.00 0.00 C ATOM 299 C LEU A 25 -4.626 11.184 -0.528 1.00 0.00 C ATOM 300 O LEU A 25 -4.598 10.337 -1.432 1.00 0.00 O ATOM 301 CB LEU A 25 -4.689 10.555 1.965 1.00 0.00 C ATOM 302 CG LEU A 25 -4.415 9.042 2.156 1.00 0.00 C ATOM 303 CD1 LEU A 25 -3.514 8.457 1.070 1.00 0.00 C ATOM 304 CD2 LEU A 25 -3.753 8.792 3.509 1.00 0.00 C ATOM 0 H LEU A 25 -6.235 9.304 -0.246 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.925 11.959 0.955 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.728 11.069 1.942 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -5.222 10.913 2.846 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.385 8.549 2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.359 7.395 1.259 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.986 8.587 0.096 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.553 8.971 1.079 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.566 7.725 3.631 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.809 9.334 3.558 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.411 9.138 4.306 1.00 0.00 H new ATOM 316 N ASP A 26 -3.929 12.317 -0.561 1.00 0.00 N ATOM 317 CA ASP A 26 -3.015 12.763 -1.617 1.00 0.00 C ATOM 318 C ASP A 26 -1.755 13.292 -0.956 1.00 0.00 C ATOM 319 O ASP A 26 -1.859 14.019 0.026 1.00 0.00 O ATOM 320 CB ASP A 26 -3.640 13.866 -2.491 1.00 0.00 C ATOM 321 CG ASP A 26 -4.120 13.409 -3.866 1.00 0.00 C ATOM 322 OD1 ASP A 26 -5.043 12.564 -3.925 1.00 0.00 O ATOM 323 OD2 ASP A 26 -3.764 14.035 -4.890 1.00 0.00 O ATOM 0 H ASP A 26 -3.990 12.995 0.198 1.00 0.00 H new ATOM 0 HA ASP A 26 -2.794 11.919 -2.270 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.484 14.299 -1.954 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -2.906 14.661 -2.625 1.00 0.00 H new ATOM 328 N GLY A 27 -0.585 12.928 -1.484 1.00 0.00 N ATOM 329 CA GLY A 27 0.711 13.354 -0.964 1.00 0.00 C ATOM 330 C GLY A 27 0.986 14.810 -1.316 1.00 0.00 C ATOM 331 O GLY A 27 1.182 15.643 -0.430 1.00 0.00 O ATOM 0 H GLY A 27 -0.513 12.319 -2.299 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.733 13.227 0.118 1.00 0.00 H new ATOM 0 HA3 GLY A 27 1.498 12.721 -1.375 1.00 0.00 H new ATOM 335 N GLY A 28 0.923 15.119 -2.612 1.00 0.00 N ATOM 336 CA GLY A 28 1.170 16.456 -3.133 1.00 0.00 C ATOM 337 C GLY A 28 2.459 16.520 -3.947 1.00 0.00 C ATOM 338 O GLY A 28 2.469 16.027 -5.079 1.00 0.00 O ATOM 0 H GLY A 28 0.696 14.436 -3.335 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.331 16.763 -3.757 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.228 17.163 -2.306 1.00 0.00 H new ATOM 342 N ALA A 29 3.526 17.138 -3.418 1.00 0.00 N ATOM 343 CA ALA A 29 4.802 17.273 -4.116 1.00 0.00 C ATOM 344 C ALA A 29 5.986 17.188 -3.150 1.00 0.00 C ATOM 345 O ALA A 29 6.336 18.187 -2.519 1.00 0.00 O ATOM 346 CB ALA A 29 4.815 18.593 -4.898 1.00 0.00 C ATOM 0 H ALA A 29 3.522 17.558 -2.489 1.00 0.00 H new ATOM 0 HA ALA A 29 4.909 16.443 -4.814 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.766 18.697 -5.420 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.001 18.595 -5.623 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.687 19.426 -4.207 1.00 0.00 H new ATOM 352 N GLY A 30 6.644 16.031 -3.081 1.00 0.00 N ATOM 353 CA GLY A 30 7.781 15.803 -2.211 1.00 0.00 C ATOM 354 C GLY A 30 8.211 14.342 -2.179 1.00 0.00 C ATOM 355 O GLY A 30 8.094 13.590 -3.152 1.00 0.00 O ATOM 0 H GLY A 30 6.392 15.216 -3.641 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.618 16.417 -2.545 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.531 16.127 -1.201 1.00 0.00 H new ATOM 359 N ASP A 31 8.803 13.958 -1.059 1.00 0.00 N ATOM 360 CA ASP A 31 9.310 12.653 -0.662 1.00 0.00 C ATOM 361 C ASP A 31 8.546 12.330 0.614 1.00 0.00 C ATOM 362 O ASP A 31 9.094 12.051 1.678 1.00 0.00 O ATOM 363 CB ASP A 31 10.831 12.706 -0.467 1.00 0.00 C ATOM 364 CG ASP A 31 11.465 11.318 -0.556 1.00 0.00 C ATOM 365 OD1 ASP A 31 11.749 10.865 -1.693 1.00 0.00 O ATOM 366 OD2 ASP A 31 11.810 10.744 0.504 1.00 0.00 O ATOM 0 H ASP A 31 8.958 14.638 -0.315 1.00 0.00 H new ATOM 0 HA ASP A 31 9.158 11.876 -1.411 1.00 0.00 H new ATOM 0 HB2 ASP A 31 11.272 13.356 -1.223 1.00 0.00 H new ATOM 0 HB3 ASP A 31 11.058 13.147 0.504 1.00 0.00 H new ATOM 371 N ASP A 32 7.242 12.554 0.532 1.00 0.00 N ATOM 372 CA ASP A 32 6.258 12.423 1.593 1.00 0.00 C ATOM 373 C ASP A 32 5.784 10.980 1.641 1.00 0.00 C ATOM 374 O ASP A 32 6.053 10.187 0.730 1.00 0.00 O ATOM 375 CB ASP A 32 5.112 13.443 1.426 1.00 0.00 C ATOM 376 CG ASP A 32 5.558 14.809 0.861 1.00 0.00 C ATOM 377 OD1 ASP A 32 6.652 15.294 1.229 1.00 0.00 O ATOM 378 OD2 ASP A 32 4.824 15.341 -0.010 1.00 0.00 O ATOM 0 H ASP A 32 6.814 12.854 -0.344 1.00 0.00 H new ATOM 0 HA ASP A 32 6.709 12.660 2.557 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.356 13.018 0.765 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.637 13.601 2.394 1.00 0.00 H new ATOM 383 N ILE A 33 5.136 10.602 2.737 1.00 0.00 N ATOM 384 CA ILE A 33 4.647 9.247 2.921 1.00 0.00 C ATOM 385 C ILE A 33 3.156 9.283 3.227 1.00 0.00 C ATOM 386 O ILE A 33 2.641 10.226 3.826 1.00 0.00 O ATOM 387 CB ILE A 33 5.516 8.487 3.948 1.00 0.00 C ATOM 388 CG1 ILE A 33 5.460 9.001 5.404 1.00 0.00 C ATOM 389 CG2 ILE A 33 6.969 8.402 3.438 1.00 0.00 C ATOM 390 CD1 ILE A 33 6.462 10.101 5.778 1.00 0.00 C ATOM 0 H ILE A 33 4.937 11.226 3.519 1.00 0.00 H new ATOM 0 HA ILE A 33 4.747 8.669 2.002 1.00 0.00 H new ATOM 0 HB ILE A 33 5.073 7.494 4.016 1.00 0.00 H new ATOM 0 HG12 ILE A 33 4.454 9.375 5.596 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.618 8.154 6.072 1.00 0.00 H new ATOM 0 HG21 ILE A 33 7.579 7.865 4.165 1.00 0.00 H new ATOM 0 HG22 ILE A 33 6.990 7.873 2.485 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.367 9.408 3.303 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.325 10.378 6.823 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.478 9.734 5.630 1.00 0.00 H new ATOM 0 HD13 ILE A 33 6.296 10.974 5.147 1.00 0.00 H new ATOM 402 N LEU A 34 2.432 8.260 2.787 1.00 0.00 N ATOM 403 CA LEU A 34 1.001 8.161 2.996 1.00 0.00 C ATOM 404 C LEU A 34 0.646 6.716 3.315 1.00 0.00 C ATOM 405 O LEU A 34 1.035 5.787 2.603 1.00 0.00 O ATOM 406 CB LEU A 34 0.212 8.805 1.853 1.00 0.00 C ATOM 407 CG LEU A 34 0.697 8.416 0.458 1.00 0.00 C ATOM 408 CD1 LEU A 34 -0.475 8.130 -0.481 1.00 0.00 C ATOM 409 CD2 LEU A 34 1.586 9.489 -0.189 1.00 0.00 C ATOM 0 H LEU A 34 2.828 7.474 2.273 1.00 0.00 H new ATOM 0 HA LEU A 34 0.697 8.747 3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.838 8.528 1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.266 9.889 1.955 1.00 0.00 H new ATOM 0 HG LEU A 34 1.292 7.514 0.602 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.094 7.856 -1.465 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.070 7.309 -0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.097 9.021 -0.568 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.899 9.154 -1.178 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.025 10.419 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 34 2.466 9.656 0.433 1.00 0.00 H new ATOM 421 N ASP A 35 -0.093 6.537 4.405 1.00 0.00 N ATOM 422 CA ASP A 35 -0.539 5.270 4.931 1.00 0.00 C ATOM 423 C ASP A 35 -2.037 5.167 4.653 1.00 0.00 C ATOM 424 O ASP A 35 -2.854 5.687 5.419 1.00 0.00 O ATOM 425 CB ASP A 35 -0.277 5.184 6.458 1.00 0.00 C ATOM 426 CG ASP A 35 1.097 5.515 7.065 1.00 0.00 C ATOM 427 OD1 ASP A 35 1.901 6.274 6.499 1.00 0.00 O ATOM 428 OD2 ASP A 35 1.325 4.991 8.190 1.00 0.00 O ATOM 0 H ASP A 35 -0.410 7.324 4.971 1.00 0.00 H new ATOM 0 HA ASP A 35 0.005 4.453 4.458 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -1.001 5.841 6.940 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.519 4.166 6.763 1.00 0.00 H new ATOM 433 N GLY A 36 -2.398 4.420 3.606 1.00 0.00 N ATOM 434 CA GLY A 36 -3.774 4.213 3.150 1.00 0.00 C ATOM 435 C GLY A 36 -4.752 3.759 4.232 1.00 0.00 C ATOM 436 O GLY A 36 -5.907 4.189 4.236 1.00 0.00 O ATOM 0 H GLY A 36 -1.715 3.925 3.032 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.141 5.144 2.717 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.768 3.471 2.352 1.00 0.00 H new ATOM 440 N GLY A 37 -4.287 2.956 5.193 1.00 0.00 N ATOM 441 CA GLY A 37 -5.100 2.442 6.279 1.00 0.00 C ATOM 442 C GLY A 37 -5.755 1.122 5.878 1.00 0.00 C ATOM 443 O GLY A 37 -5.233 0.393 5.034 1.00 0.00 O ATOM 0 H GLY A 37 -3.317 2.644 5.231 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -4.482 2.294 7.165 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.867 3.170 6.543 1.00 0.00 H new ATOM 447 N ALA A 38 -6.816 0.745 6.587 1.00 0.00 N ATOM 448 CA ALA A 38 -7.587 -0.470 6.338 1.00 0.00 C ATOM 449 C ALA A 38 -8.870 -0.060 5.622 1.00 0.00 C ATOM 450 O ALA A 38 -9.296 1.092 5.699 1.00 0.00 O ATOM 451 CB ALA A 38 -7.971 -1.101 7.685 1.00 0.00 C ATOM 0 H ALA A 38 -7.173 1.291 7.371 1.00 0.00 H new ATOM 0 HA ALA A 38 -7.009 -1.178 5.745 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -8.547 -2.009 7.510 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -7.067 -1.346 8.243 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -8.571 -0.395 8.259 1.00 0.00 H new ATOM 457 N GLY A 39 -9.613 -1.031 5.104 1.00 0.00 N ATOM 458 CA GLY A 39 -10.842 -0.726 4.406 1.00 0.00 C ATOM 459 C GLY A 39 -10.527 -0.516 2.936 1.00 0.00 C ATOM 460 O GLY A 39 -9.503 -0.985 2.449 1.00 0.00 O ATOM 0 H GLY A 39 -9.384 -2.024 5.156 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -11.557 -1.540 4.527 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -11.303 0.168 4.825 1.00 0.00 H new ATOM 464 N ARG A 40 -11.467 0.056 2.190 1.00 0.00 N ATOM 465 CA ARG A 40 -11.283 0.323 0.785 1.00 0.00 C ATOM 466 C ARG A 40 -10.935 1.798 0.663 1.00 0.00 C ATOM 467 O ARG A 40 -11.824 2.650 0.565 1.00 0.00 O ATOM 468 CB ARG A 40 -12.549 -0.122 0.046 1.00 0.00 C ATOM 469 CG ARG A 40 -13.875 0.578 0.408 1.00 0.00 C ATOM 470 CD ARG A 40 -14.997 -0.420 0.696 1.00 0.00 C ATOM 471 NE ARG A 40 -16.317 0.224 0.530 1.00 0.00 N ATOM 472 CZ ARG A 40 -17.195 0.562 1.487 1.00 0.00 C ATOM 473 NH1 ARG A 40 -17.145 0.046 2.705 1.00 0.00 N ATOM 474 NH2 ARG A 40 -18.149 1.445 1.220 1.00 0.00 N ATOM 0 H ARG A 40 -12.376 0.344 2.552 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.468 -0.233 0.322 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.379 0.014 -1.022 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -12.677 -1.191 0.215 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -13.722 1.212 1.281 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -14.174 1.231 -0.412 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -14.915 -1.273 0.023 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -14.898 -0.804 1.711 1.00 0.00 H new ATOM 0 HE ARG A 40 -16.594 0.437 -0.428 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -16.422 -0.633 2.942 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.830 0.327 3.407 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -18.212 1.863 0.292 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.819 1.706 1.943 1.00 0.00 H new ATOM 488 N ASP A 41 -9.652 2.104 0.575 1.00 0.00 N ATOM 489 CA ASP A 41 -9.128 3.459 0.449 1.00 0.00 C ATOM 490 C ASP A 41 -8.620 3.666 -0.971 1.00 0.00 C ATOM 491 O ASP A 41 -8.576 2.743 -1.795 1.00 0.00 O ATOM 492 CB ASP A 41 -8.121 3.812 1.563 1.00 0.00 C ATOM 493 CG ASP A 41 -6.860 4.533 1.072 1.00 0.00 C ATOM 494 OD1 ASP A 41 -6.935 5.759 0.824 1.00 0.00 O ATOM 495 OD2 ASP A 41 -5.822 3.862 0.922 1.00 0.00 O ATOM 0 H ASP A 41 -8.919 1.394 0.590 1.00 0.00 H new ATOM 0 HA ASP A 41 -9.930 4.180 0.608 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.620 4.440 2.301 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -7.825 2.895 2.073 1.00 0.00 H new ATOM 500 N ARG A 42 -8.467 4.930 -1.332 1.00 0.00 N ATOM 501 CA ARG A 42 -7.983 5.379 -2.605 1.00 0.00 C ATOM 502 C ARG A 42 -6.819 6.329 -2.370 1.00 0.00 C ATOM 503 O ARG A 42 -7.027 7.494 -2.015 1.00 0.00 O ATOM 504 CB ARG A 42 -9.151 6.039 -3.303 1.00 0.00 C ATOM 505 CG ARG A 42 -8.778 6.427 -4.735 1.00 0.00 C ATOM 506 CD ARG A 42 -8.572 7.941 -4.840 1.00 0.00 C ATOM 507 NE ARG A 42 -8.129 8.333 -6.182 1.00 0.00 N ATOM 508 CZ ARG A 42 -8.779 9.126 -7.036 1.00 0.00 C ATOM 509 NH1 ARG A 42 -9.875 9.788 -6.685 1.00 0.00 N ATOM 510 NH2 ARG A 42 -8.333 9.250 -8.276 1.00 0.00 N ATOM 0 H ARG A 42 -8.692 5.702 -0.704 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.610 4.570 -3.233 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -10.004 5.360 -3.316 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -9.458 6.926 -2.749 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.867 5.908 -5.034 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -9.564 6.112 -5.421 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -9.504 8.453 -4.600 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.834 8.260 -4.105 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.232 7.961 -6.495 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.244 9.698 -5.738 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.348 10.386 -7.362 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.499 8.742 -8.571 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.823 9.854 -8.936 1.00 0.00 H new ATOM 524 N LEU A 43 -5.608 5.850 -2.622 1.00 0.00 N ATOM 525 CA LEU A 43 -4.396 6.612 -2.465 1.00 0.00 C ATOM 526 C LEU A 43 -3.859 7.038 -3.829 1.00 0.00 C ATOM 527 O LEU A 43 -3.812 6.237 -4.763 1.00 0.00 O ATOM 528 CB LEU A 43 -3.387 5.790 -1.660 1.00 0.00 C ATOM 529 CG LEU A 43 -3.048 4.357 -2.139 1.00 0.00 C ATOM 530 CD1 LEU A 43 -1.533 4.238 -2.342 1.00 0.00 C ATOM 531 CD2 LEU A 43 -3.464 3.314 -1.109 1.00 0.00 C ATOM 0 H LEU A 43 -5.447 4.897 -2.949 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.594 7.529 -1.910 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.456 6.355 -1.621 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.759 5.718 -0.638 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.589 4.179 -3.069 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.289 3.231 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.208 4.960 -3.091 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.023 4.439 -1.400 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.212 2.319 -1.476 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.939 3.499 -0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.539 3.377 -0.941 1.00 0.00 H new ATOM 543 N SER A 44 -3.489 8.317 -3.932 1.00 0.00 N ATOM 544 CA SER A 44 -2.928 8.949 -5.124 1.00 0.00 C ATOM 545 C SER A 44 -1.827 9.871 -4.592 1.00 0.00 C ATOM 546 O SER A 44 -2.116 10.995 -4.188 1.00 0.00 O ATOM 547 CB SER A 44 -3.996 9.700 -5.950 1.00 0.00 C ATOM 548 OG SER A 44 -5.282 9.093 -5.906 1.00 0.00 O ATOM 0 H SER A 44 -3.577 8.967 -3.151 1.00 0.00 H new ATOM 0 HA SER A 44 -2.530 8.217 -5.826 1.00 0.00 H new ATOM 0 HB2 SER A 44 -4.074 10.723 -5.583 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.666 9.758 -6.987 1.00 0.00 H new ATOM 0 HG SER A 44 -5.910 9.617 -6.446 1.00 0.00 H new ATOM 554 N GLY A 45 -0.594 9.380 -4.467 1.00 0.00 N ATOM 555 CA GLY A 45 0.528 10.151 -3.953 1.00 0.00 C ATOM 556 C GLY A 45 0.701 11.434 -4.752 1.00 0.00 C ATOM 557 O GLY A 45 0.448 12.538 -4.249 1.00 0.00 O ATOM 0 H GLY A 45 -0.348 8.424 -4.724 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.363 10.389 -2.902 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.440 9.557 -4.006 1.00 0.00 H new ATOM 561 N GLY A 46 1.005 11.265 -6.032 1.00 0.00 N ATOM 562 CA GLY A 46 1.240 12.342 -6.982 1.00 0.00 C ATOM 563 C GLY A 46 2.672 12.252 -7.501 1.00 0.00 C ATOM 564 O GLY A 46 3.481 11.535 -6.936 1.00 0.00 O ATOM 0 H GLY A 46 1.098 10.340 -6.452 1.00 0.00 H new ATOM 0 HA2 GLY A 46 0.535 12.272 -7.811 1.00 0.00 H new ATOM 0 HA3 GLY A 46 1.074 13.307 -6.504 1.00 0.00 H new ATOM 568 N ALA A 47 2.995 13.024 -8.553 1.00 0.00 N ATOM 569 CA ALA A 47 4.327 13.000 -9.157 1.00 0.00 C ATOM 570 C ALA A 47 5.393 13.441 -8.144 1.00 0.00 C ATOM 571 O ALA A 47 5.560 14.630 -7.877 1.00 0.00 O ATOM 572 CB ALA A 47 4.320 13.894 -10.409 1.00 0.00 C ATOM 0 H ALA A 47 2.346 13.672 -8.999 1.00 0.00 H new ATOM 0 HA ALA A 47 4.581 11.983 -9.455 1.00 0.00 H new ATOM 0 HB1 ALA A 47 5.308 13.884 -10.869 1.00 0.00 H new ATOM 0 HB2 ALA A 47 3.585 13.518 -11.121 1.00 0.00 H new ATOM 0 HB3 ALA A 47 4.061 14.914 -10.126 1.00 0.00 H new ATOM 578 N GLY A 48 6.152 12.456 -7.649 1.00 0.00 N ATOM 579 CA GLY A 48 7.225 12.549 -6.679 1.00 0.00 C ATOM 580 C GLY A 48 7.582 11.119 -6.268 1.00 0.00 C ATOM 581 O GLY A 48 7.059 10.168 -6.847 1.00 0.00 O ATOM 0 H GLY A 48 6.010 11.492 -7.951 1.00 0.00 H new ATOM 0 HA2 GLY A 48 8.090 13.054 -7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.912 13.132 -5.813 1.00 0.00 H new ATOM 585 N ALA A 49 8.503 10.954 -5.319 1.00 0.00 N ATOM 586 CA ALA A 49 8.922 9.643 -4.847 1.00 0.00 C ATOM 587 C ALA A 49 8.268 9.402 -3.489 1.00 0.00 C ATOM 588 O ALA A 49 8.811 9.754 -2.443 1.00 0.00 O ATOM 589 CB ALA A 49 10.451 9.543 -4.831 1.00 0.00 C ATOM 0 H ALA A 49 8.978 11.730 -4.858 1.00 0.00 H new ATOM 0 HA ALA A 49 8.593 8.851 -5.520 1.00 0.00 H new ATOM 0 HB1 ALA A 49 10.747 8.556 -4.475 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.836 9.696 -5.839 1.00 0.00 H new ATOM 0 HB3 ALA A 49 10.859 10.305 -4.167 1.00 0.00 H new ATOM 595 N ASP A 50 7.016 8.960 -3.524 1.00 0.00 N ATOM 596 CA ASP A 50 6.174 8.638 -2.373 1.00 0.00 C ATOM 597 C ASP A 50 6.528 7.264 -1.812 1.00 0.00 C ATOM 598 O ASP A 50 7.350 6.531 -2.357 1.00 0.00 O ATOM 599 CB ASP A 50 4.675 8.674 -2.685 1.00 0.00 C ATOM 600 CG ASP A 50 4.244 7.751 -3.826 1.00 0.00 C ATOM 601 OD1 ASP A 50 4.719 6.602 -3.884 1.00 0.00 O ATOM 602 OD2 ASP A 50 3.397 8.229 -4.620 1.00 0.00 O ATOM 0 H ASP A 50 6.531 8.807 -4.408 1.00 0.00 H new ATOM 0 HA ASP A 50 6.376 9.415 -1.636 1.00 0.00 H new ATOM 0 HB2 ASP A 50 4.123 8.402 -1.786 1.00 0.00 H new ATOM 0 HB3 ASP A 50 4.393 9.697 -2.935 1.00 0.00 H new ATOM 607 N THR A 51 6.022 6.963 -0.619 1.00 0.00 N ATOM 608 CA THR A 51 6.253 5.684 0.060 1.00 0.00 C ATOM 609 C THR A 51 4.877 5.238 0.608 1.00 0.00 C ATOM 610 O THR A 51 4.382 5.844 1.565 1.00 0.00 O ATOM 611 CB THR A 51 7.402 5.882 1.094 1.00 0.00 C ATOM 612 OG1 THR A 51 8.303 6.905 0.700 1.00 0.00 O ATOM 613 CG2 THR A 51 8.388 4.737 1.354 1.00 0.00 C ATOM 0 H THR A 51 5.433 7.605 -0.088 1.00 0.00 H new ATOM 0 HA THR A 51 6.607 4.871 -0.574 1.00 0.00 H new ATOM 0 HB THR A 51 6.785 6.057 1.975 1.00 0.00 H new ATOM 0 HG1 THR A 51 9.007 6.999 1.375 1.00 0.00 H new ATOM 0 HG21 THR A 51 9.119 5.049 2.100 1.00 0.00 H new ATOM 0 HG22 THR A 51 7.845 3.865 1.720 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.902 4.482 0.427 1.00 0.00 H new ATOM 621 N PHE A 52 4.210 4.234 0.004 1.00 0.00 N ATOM 622 CA PHE A 52 2.880 3.781 0.435 1.00 0.00 C ATOM 623 C PHE A 52 2.969 2.788 1.586 1.00 0.00 C ATOM 624 O PHE A 52 3.497 1.682 1.426 1.00 0.00 O ATOM 625 CB PHE A 52 2.097 3.146 -0.723 1.00 0.00 C ATOM 626 CG PHE A 52 1.933 3.977 -1.978 1.00 0.00 C ATOM 627 CD1 PHE A 52 1.692 5.364 -1.919 1.00 0.00 C ATOM 628 CD2 PHE A 52 2.032 3.342 -3.228 1.00 0.00 C ATOM 629 CE1 PHE A 52 1.607 6.107 -3.109 1.00 0.00 C ATOM 630 CE2 PHE A 52 1.965 4.087 -4.409 1.00 0.00 C ATOM 631 CZ PHE A 52 1.777 5.470 -4.348 1.00 0.00 C ATOM 0 H PHE A 52 4.580 3.718 -0.794 1.00 0.00 H new ATOM 0 HA PHE A 52 2.348 4.669 0.777 1.00 0.00 H new ATOM 0 HB2 PHE A 52 2.592 2.214 -0.996 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.104 2.884 -0.358 1.00 0.00 H new ATOM 0 HD1 PHE A 52 1.573 5.854 -0.964 1.00 0.00 H new ATOM 0 HD2 PHE A 52 2.161 2.271 -3.276 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.411 7.168 -3.070 1.00 0.00 H new ATOM 0 HE2 PHE A 52 2.058 3.595 -5.366 1.00 0.00 H new ATOM 0 HZ PHE A 52 1.762 6.051 -5.258 1.00 0.00 H new ATOM 641 N VAL A 53 2.450 3.164 2.755 1.00 0.00 N ATOM 642 CA VAL A 53 2.480 2.313 3.938 1.00 0.00 C ATOM 643 C VAL A 53 1.231 1.430 4.011 1.00 0.00 C ATOM 644 O VAL A 53 0.117 1.928 4.204 1.00 0.00 O ATOM 645 CB VAL A 53 2.644 3.159 5.218 1.00 0.00 C ATOM 646 CG1 VAL A 53 3.024 2.234 6.385 1.00 0.00 C ATOM 647 CG2 VAL A 53 3.723 4.246 5.078 1.00 0.00 C ATOM 0 H VAL A 53 1.998 4.066 2.905 1.00 0.00 H new ATOM 0 HA VAL A 53 3.345 1.655 3.860 1.00 0.00 H new ATOM 0 HB VAL A 53 1.693 3.659 5.400 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.142 2.824 7.294 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.238 1.493 6.533 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.962 1.727 6.157 1.00 0.00 H new ATOM 0 HG21 VAL A 53 3.795 4.810 6.008 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.684 3.779 4.862 1.00 0.00 H new ATOM 0 HG23 VAL A 53 3.456 4.921 4.265 1.00 0.00 H new ATOM 657 N PHE A 54 1.429 0.113 3.939 1.00 0.00 N ATOM 658 CA PHE A 54 0.387 -0.904 3.997 1.00 0.00 C ATOM 659 C PHE A 54 0.620 -1.762 5.239 1.00 0.00 C ATOM 660 O PHE A 54 1.589 -2.527 5.277 1.00 0.00 O ATOM 661 CB PHE A 54 0.453 -1.737 2.721 1.00 0.00 C ATOM 662 CG PHE A 54 0.067 -0.973 1.472 1.00 0.00 C ATOM 663 CD1 PHE A 54 -1.278 -0.624 1.252 1.00 0.00 C ATOM 664 CD2 PHE A 54 1.045 -0.608 0.528 1.00 0.00 C ATOM 665 CE1 PHE A 54 -1.645 0.076 0.093 1.00 0.00 C ATOM 666 CE2 PHE A 54 0.668 0.059 -0.650 1.00 0.00 C ATOM 667 CZ PHE A 54 -0.676 0.405 -0.866 1.00 0.00 C ATOM 0 H PHE A 54 2.361 -0.288 3.834 1.00 0.00 H new ATOM 0 HA PHE A 54 -0.605 -0.458 4.066 1.00 0.00 H new ATOM 0 HB2 PHE A 54 1.466 -2.122 2.602 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.206 -2.599 2.826 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.030 -0.896 1.978 1.00 0.00 H new ATOM 0 HD2 PHE A 54 2.084 -0.840 0.709 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.675 0.362 -0.061 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.414 0.306 -1.391 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.963 0.923 -1.769 1.00 0.00 H new ATOM 677 N SER A 55 -0.187 -1.602 6.294 1.00 0.00 N ATOM 678 CA SER A 55 -0.036 -2.358 7.524 1.00 0.00 C ATOM 679 C SER A 55 -1.325 -2.384 8.357 1.00 0.00 C ATOM 680 O SER A 55 -1.410 -1.714 9.393 1.00 0.00 O ATOM 681 CB SER A 55 1.171 -1.809 8.313 1.00 0.00 C ATOM 682 OG SER A 55 1.634 -2.734 9.281 1.00 0.00 O ATOM 0 H SER A 55 -0.963 -0.940 6.310 1.00 0.00 H new ATOM 0 HA SER A 55 0.160 -3.401 7.273 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.979 -1.572 7.621 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.890 -0.878 8.806 1.00 0.00 H new ATOM 0 HG SER A 55 2.399 -2.352 9.759 1.00 0.00 H new ATOM 688 N ALA A 56 -2.345 -3.135 7.927 1.00 0.00 N ATOM 689 CA ALA A 56 -3.590 -3.277 8.672 1.00 0.00 C ATOM 690 C ALA A 56 -4.117 -4.700 8.494 1.00 0.00 C ATOM 691 O ALA A 56 -3.671 -5.408 7.592 1.00 0.00 O ATOM 692 CB ALA A 56 -4.614 -2.226 8.256 1.00 0.00 C ATOM 0 H ALA A 56 -2.326 -3.659 7.052 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.399 -3.107 9.732 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.530 -2.362 8.832 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.211 -1.231 8.445 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.834 -2.333 7.194 1.00 0.00 H new ATOM 698 N ARG A 57 -5.064 -5.165 9.324 1.00 0.00 N ATOM 699 CA ARG A 57 -5.576 -6.534 9.181 1.00 0.00 C ATOM 700 C ARG A 57 -6.357 -6.656 7.885 1.00 0.00 C ATOM 701 O ARG A 57 -5.958 -7.413 7.003 1.00 0.00 O ATOM 702 CB ARG A 57 -6.402 -7.016 10.392 1.00 0.00 C ATOM 703 CG ARG A 57 -5.518 -7.446 11.571 1.00 0.00 C ATOM 704 CD ARG A 57 -4.775 -8.775 11.342 1.00 0.00 C ATOM 705 NE ARG A 57 -3.538 -8.820 12.136 1.00 0.00 N ATOM 706 CZ ARG A 57 -2.494 -9.637 11.964 1.00 0.00 C ATOM 707 NH1 ARG A 57 -2.544 -10.701 11.165 1.00 0.00 N ATOM 708 NH2 ARG A 57 -1.378 -9.365 12.620 1.00 0.00 N ATOM 0 H ARG A 57 -5.482 -4.627 10.083 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.713 -7.198 9.146 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.069 -6.216 10.714 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.031 -7.853 10.089 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -4.787 -6.662 11.769 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.138 -7.537 12.463 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.420 -9.610 11.616 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.539 -8.888 10.284 1.00 0.00 H new ATOM 0 HE ARG A 57 -3.469 -8.153 12.904 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.402 -10.917 10.657 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.725 -11.300 11.061 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -1.333 -8.552 13.235 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.563 -9.968 12.511 1.00 0.00 H new ATOM 722 N GLU A 58 -7.413 -5.862 7.746 1.00 0.00 N ATOM 723 CA GLU A 58 -8.280 -5.873 6.577 1.00 0.00 C ATOM 724 C GLU A 58 -7.600 -5.380 5.297 1.00 0.00 C ATOM 725 O GLU A 58 -8.166 -5.599 4.235 1.00 0.00 O ATOM 726 CB GLU A 58 -9.586 -5.122 6.898 1.00 0.00 C ATOM 727 CG GLU A 58 -10.650 -6.050 7.517 1.00 0.00 C ATOM 728 CD GLU A 58 -10.175 -6.866 8.725 1.00 0.00 C ATOM 729 OE1 GLU A 58 -9.628 -6.278 9.683 1.00 0.00 O ATOM 730 OE2 GLU A 58 -10.360 -8.109 8.733 1.00 0.00 O ATOM 0 H GLU A 58 -7.694 -5.183 8.454 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.524 -6.912 6.354 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.374 -4.304 7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -9.981 -4.676 5.985 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.505 -5.446 7.819 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.002 -6.738 6.748 1.00 0.00 H new ATOM 737 N ASP A 59 -6.395 -4.787 5.332 1.00 0.00 N ATOM 738 CA ASP A 59 -5.680 -4.319 4.123 1.00 0.00 C ATOM 739 C ASP A 59 -5.067 -5.517 3.343 1.00 0.00 C ATOM 740 O ASP A 59 -4.205 -5.424 2.475 1.00 0.00 O ATOM 741 CB ASP A 59 -4.637 -3.283 4.563 1.00 0.00 C ATOM 742 CG ASP A 59 -3.656 -2.779 3.496 1.00 0.00 C ATOM 743 OD1 ASP A 59 -3.994 -2.688 2.290 1.00 0.00 O ATOM 744 OD2 ASP A 59 -2.537 -2.440 3.935 1.00 0.00 O ATOM 0 H ASP A 59 -5.885 -4.616 6.199 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.366 -3.841 3.424 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.167 -2.421 4.969 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -4.057 -3.713 5.379 1.00 0.00 H new ATOM 749 N SER A 60 -5.520 -6.713 3.689 1.00 0.00 N ATOM 750 CA SER A 60 -5.102 -7.999 3.154 1.00 0.00 C ATOM 751 C SER A 60 -6.269 -8.810 2.583 1.00 0.00 C ATOM 752 O SER A 60 -6.029 -9.812 1.909 1.00 0.00 O ATOM 753 CB SER A 60 -4.405 -8.709 4.324 1.00 0.00 C ATOM 754 OG SER A 60 -3.590 -9.820 3.999 1.00 0.00 O ATOM 0 H SER A 60 -6.241 -6.817 4.403 1.00 0.00 H new ATOM 0 HA SER A 60 -4.432 -7.878 2.303 1.00 0.00 H new ATOM 0 HB2 SER A 60 -3.790 -7.978 4.848 1.00 0.00 H new ATOM 0 HB3 SER A 60 -5.171 -9.042 5.025 1.00 0.00 H new ATOM 0 HG SER A 60 -3.199 -10.190 4.818 1.00 0.00 H new ATOM 760 N TYR A 61 -7.537 -8.463 2.870 1.00 0.00 N ATOM 761 CA TYR A 61 -8.634 -9.269 2.344 1.00 0.00 C ATOM 762 C TYR A 61 -10.028 -8.642 2.410 1.00 0.00 C ATOM 763 O TYR A 61 -10.306 -7.679 3.127 1.00 0.00 O ATOM 764 CB TYR A 61 -8.662 -10.608 3.128 1.00 0.00 C ATOM 765 CG TYR A 61 -8.033 -10.608 4.526 1.00 0.00 C ATOM 766 CD1 TYR A 61 -8.618 -9.912 5.604 1.00 0.00 C ATOM 767 CD2 TYR A 61 -6.800 -11.256 4.720 1.00 0.00 C ATOM 768 CE1 TYR A 61 -7.963 -9.851 6.850 1.00 0.00 C ATOM 769 CE2 TYR A 61 -6.151 -11.220 5.967 1.00 0.00 C ATOM 770 CZ TYR A 61 -6.725 -10.509 7.038 1.00 0.00 C ATOM 771 OH TYR A 61 -6.062 -10.439 8.227 1.00 0.00 O ATOM 0 H TYR A 61 -7.813 -7.663 3.440 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.426 -9.385 1.280 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -9.701 -10.923 3.224 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -8.154 -11.363 2.528 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -9.572 -9.424 5.474 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.345 -11.789 3.899 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -8.408 -9.300 7.665 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -5.213 -11.737 6.103 1.00 0.00 H new ATOM 0 HH TYR A 61 -5.230 -10.954 8.169 1.00 0.00 H new ATOM 781 N ARG A 62 -10.970 -9.308 1.742 1.00 0.00 N ATOM 782 CA ARG A 62 -12.383 -8.990 1.627 1.00 0.00 C ATOM 783 C ARG A 62 -13.199 -10.089 2.288 1.00 0.00 C ATOM 784 O ARG A 62 -12.700 -11.180 2.573 1.00 0.00 O ATOM 785 CB ARG A 62 -12.778 -8.895 0.145 1.00 0.00 C ATOM 786 CG ARG A 62 -12.567 -10.190 -0.672 1.00 0.00 C ATOM 787 CD ARG A 62 -13.812 -10.638 -1.460 1.00 0.00 C ATOM 788 NE ARG A 62 -13.729 -10.316 -2.891 1.00 0.00 N ATOM 789 CZ ARG A 62 -13.056 -11.045 -3.789 1.00 0.00 C ATOM 790 NH1 ARG A 62 -12.348 -12.106 -3.423 1.00 0.00 N ATOM 791 NH2 ARG A 62 -13.062 -10.685 -5.062 1.00 0.00 N ATOM 0 H ARG A 62 -10.738 -10.156 1.225 1.00 0.00 H new ATOM 0 HA ARG A 62 -12.577 -8.035 2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -13.828 -8.611 0.082 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -12.203 -8.093 -0.318 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.743 -10.039 -1.369 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.269 -10.991 0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -13.943 -11.714 -1.342 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -14.695 -10.161 -1.036 1.00 0.00 H new ATOM 0 HE ARG A 62 -14.216 -9.483 -3.221 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.310 -12.379 -2.441 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -11.842 -12.648 -4.124 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.578 -9.855 -5.355 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.551 -11.237 -5.751 1.00 0.00 H new ATOM 805 N THR A 63 -14.476 -9.816 2.494 1.00 0.00 N ATOM 806 CA THR A 63 -15.411 -10.744 3.104 1.00 0.00 C ATOM 807 C THR A 63 -16.745 -10.616 2.358 1.00 0.00 C ATOM 808 O THR A 63 -16.936 -9.658 1.602 1.00 0.00 O ATOM 809 CB THR A 63 -15.476 -10.441 4.615 1.00 0.00 C ATOM 810 OG1 THR A 63 -15.274 -9.062 4.928 1.00 0.00 O ATOM 811 CG2 THR A 63 -14.400 -11.218 5.382 1.00 0.00 C ATOM 0 H THR A 63 -14.900 -8.925 2.236 1.00 0.00 H new ATOM 0 HA THR A 63 -15.107 -11.787 3.021 1.00 0.00 H new ATOM 0 HB THR A 63 -16.482 -10.739 4.911 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.614 -8.507 4.195 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.470 -10.984 6.444 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.549 -12.288 5.235 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.414 -10.935 5.013 1.00 0.00 H new ATOM 819 N ASP A 64 -17.677 -11.561 2.528 1.00 0.00 N ATOM 820 CA ASP A 64 -18.977 -11.454 1.848 1.00 0.00 C ATOM 821 C ASP A 64 -19.702 -10.199 2.342 1.00 0.00 C ATOM 822 O ASP A 64 -20.312 -9.448 1.574 1.00 0.00 O ATOM 823 CB ASP A 64 -19.857 -12.678 2.082 1.00 0.00 C ATOM 824 CG ASP A 64 -21.221 -12.441 1.432 1.00 0.00 C ATOM 825 OD1 ASP A 64 -21.259 -12.088 0.231 1.00 0.00 O ATOM 826 OD2 ASP A 64 -22.251 -12.587 2.126 1.00 0.00 O ATOM 0 H ASP A 64 -17.563 -12.388 3.114 1.00 0.00 H new ATOM 0 HA ASP A 64 -18.787 -11.391 0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -19.387 -13.566 1.659 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -19.975 -12.858 3.150 1.00 0.00 H new ATOM 831 N THR A 65 -19.599 -9.968 3.648 1.00 0.00 N ATOM 832 CA THR A 65 -20.160 -8.845 4.367 1.00 0.00 C ATOM 833 C THR A 65 -19.710 -7.545 3.697 1.00 0.00 C ATOM 834 O THR A 65 -20.558 -6.742 3.303 1.00 0.00 O ATOM 835 CB THR A 65 -19.751 -8.962 5.835 1.00 0.00 C ATOM 836 OG1 THR A 65 -18.381 -9.306 5.942 1.00 0.00 O ATOM 837 CG2 THR A 65 -20.527 -10.064 6.559 1.00 0.00 C ATOM 0 H THR A 65 -19.089 -10.603 4.263 1.00 0.00 H new ATOM 0 HA THR A 65 -21.250 -8.841 4.338 1.00 0.00 H new ATOM 0 HB THR A 65 -19.961 -7.992 6.285 1.00 0.00 H new ATOM 0 HG1 THR A 65 -18.134 -9.375 6.888 1.00 0.00 H new ATOM 0 HG21 THR A 65 -20.205 -10.113 7.599 1.00 0.00 H new ATOM 0 HG22 THR A 65 -21.594 -9.844 6.519 1.00 0.00 H new ATOM 0 HG23 THR A 65 -20.336 -11.022 6.075 1.00 0.00 H new ATOM 845 N ALA A 66 -18.401 -7.342 3.511 1.00 0.00 N ATOM 846 CA ALA A 66 -17.875 -6.149 2.887 1.00 0.00 C ATOM 847 C ALA A 66 -16.495 -6.458 2.316 1.00 0.00 C ATOM 848 O ALA A 66 -15.756 -7.299 2.839 1.00 0.00 O ATOM 849 CB ALA A 66 -17.811 -5.028 3.928 1.00 0.00 C ATOM 0 H ALA A 66 -17.684 -8.010 3.794 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.520 -5.822 2.071 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.415 -4.124 3.465 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.812 -4.831 4.312 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -17.160 -5.330 4.749 1.00 0.00 H new ATOM 855 N VAL A 67 -16.154 -5.783 1.228 1.00 0.00 N ATOM 856 CA VAL A 67 -14.890 -5.886 0.515 1.00 0.00 C ATOM 857 C VAL A 67 -14.112 -4.644 0.949 1.00 0.00 C ATOM 858 O VAL A 67 -14.683 -3.560 1.064 1.00 0.00 O ATOM 859 CB VAL A 67 -15.143 -5.954 -1.010 1.00 0.00 C ATOM 860 CG1 VAL A 67 -13.862 -6.078 -1.847 1.00 0.00 C ATOM 861 CG2 VAL A 67 -16.066 -7.123 -1.401 1.00 0.00 C ATOM 0 H VAL A 67 -16.788 -5.111 0.795 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.326 -6.791 0.743 1.00 0.00 H new ATOM 0 HB VAL A 67 -15.621 -5.000 -1.233 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.121 -6.120 -2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.223 -5.214 -1.664 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -13.331 -6.988 -1.567 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -16.212 -7.126 -2.481 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -15.611 -8.064 -1.094 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -17.030 -7.007 -0.905 1.00 0.00 H new ATOM 871 N PHE A 68 -12.823 -4.791 1.225 1.00 0.00 N ATOM 872 CA PHE A 68 -11.955 -3.708 1.665 1.00 0.00 C ATOM 873 C PHE A 68 -10.829 -3.617 0.637 1.00 0.00 C ATOM 874 O PHE A 68 -9.649 -3.699 0.970 1.00 0.00 O ATOM 875 CB PHE A 68 -11.456 -4.050 3.081 1.00 0.00 C ATOM 876 CG PHE A 68 -12.545 -4.252 4.127 1.00 0.00 C ATOM 877 CD1 PHE A 68 -13.450 -3.225 4.458 1.00 0.00 C ATOM 878 CD2 PHE A 68 -12.650 -5.487 4.786 1.00 0.00 C ATOM 879 CE1 PHE A 68 -14.431 -3.428 5.447 1.00 0.00 C ATOM 880 CE2 PHE A 68 -13.647 -5.707 5.754 1.00 0.00 C ATOM 881 CZ PHE A 68 -14.539 -4.673 6.087 1.00 0.00 C ATOM 0 H PHE A 68 -12.341 -5.687 1.147 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.452 -2.740 1.724 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.855 -4.958 3.027 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.796 -3.251 3.418 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -13.391 -2.274 3.949 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.956 -6.279 4.547 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.102 -2.625 5.714 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.727 -6.668 6.240 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.304 -4.835 6.832 1.00 0.00 H new ATOM 891 N ASN A 69 -11.207 -3.542 -0.641 1.00 0.00 N ATOM 892 CA ASN A 69 -10.271 -3.482 -1.730 1.00 0.00 C ATOM 893 C ASN A 69 -9.571 -2.141 -1.851 1.00 0.00 C ATOM 894 O ASN A 69 -10.203 -1.105 -2.064 1.00 0.00 O ATOM 895 CB ASN A 69 -10.887 -3.931 -3.058 1.00 0.00 C ATOM 896 CG ASN A 69 -11.872 -2.951 -3.673 1.00 0.00 C ATOM 897 OD1 ASN A 69 -13.061 -2.982 -3.353 1.00 0.00 O ATOM 898 ND2 ASN A 69 -11.420 -2.132 -4.607 1.00 0.00 N ATOM 0 H ASN A 69 -12.183 -3.522 -0.936 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.493 -4.203 -1.481 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -10.083 -4.111 -3.772 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.394 -4.883 -2.902 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -12.062 -1.501 -5.086 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.429 -2.131 -4.848 1.00 0.00 H new ATOM 905 N ASP A 70 -8.255 -2.192 -1.723 1.00 0.00 N ATOM 906 CA ASP A 70 -7.364 -1.045 -1.842 1.00 0.00 C ATOM 907 C ASP A 70 -7.309 -0.672 -3.331 1.00 0.00 C ATOM 908 O ASP A 70 -7.648 -1.492 -4.206 1.00 0.00 O ATOM 909 CB ASP A 70 -6.017 -1.426 -1.221 1.00 0.00 C ATOM 910 CG ASP A 70 -4.820 -0.602 -1.677 1.00 0.00 C ATOM 911 OD1 ASP A 70 -4.976 0.634 -1.806 1.00 0.00 O ATOM 912 OD2 ASP A 70 -3.759 -1.220 -1.882 1.00 0.00 O ATOM 0 H ASP A 70 -7.759 -3.062 -1.527 1.00 0.00 H new ATOM 0 HA ASP A 70 -7.703 -0.160 -1.304 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -6.101 -1.341 -0.138 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -5.819 -2.474 -1.444 1.00 0.00 H new ATOM 917 N LEU A 71 -7.035 0.599 -3.627 1.00 0.00 N ATOM 918 CA LEU A 71 -6.976 1.124 -4.978 1.00 0.00 C ATOM 919 C LEU A 71 -5.879 2.174 -5.087 1.00 0.00 C ATOM 920 O LEU A 71 -6.052 3.292 -4.600 1.00 0.00 O ATOM 921 CB LEU A 71 -8.360 1.706 -5.325 1.00 0.00 C ATOM 922 CG LEU A 71 -8.477 2.232 -6.764 1.00 0.00 C ATOM 923 CD1 LEU A 71 -8.446 1.085 -7.786 1.00 0.00 C ATOM 924 CD2 LEU A 71 -9.795 2.996 -6.927 1.00 0.00 C ATOM 0 H LEU A 71 -6.845 1.302 -2.913 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.732 0.334 -5.688 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.116 0.936 -5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.584 2.518 -4.633 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.627 2.889 -6.948 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.531 1.493 -8.793 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.507 0.540 -7.693 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.279 0.407 -7.598 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.876 3.368 -7.948 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -10.631 2.329 -6.717 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.817 3.835 -6.232 1.00 0.00 H new ATOM 936 N ILE A 72 -4.759 1.828 -5.726 1.00 0.00 N ATOM 937 CA ILE A 72 -3.666 2.770 -5.899 1.00 0.00 C ATOM 938 C ILE A 72 -3.876 3.416 -7.268 1.00 0.00 C ATOM 939 O ILE A 72 -4.432 2.798 -8.193 1.00 0.00 O ATOM 940 CB ILE A 72 -2.295 2.060 -5.807 1.00 0.00 C ATOM 941 CG1 ILE A 72 -2.113 1.246 -4.502 1.00 0.00 C ATOM 942 CG2 ILE A 72 -1.148 3.087 -5.906 1.00 0.00 C ATOM 943 CD1 ILE A 72 -2.323 -0.256 -4.694 1.00 0.00 C ATOM 0 H ILE A 72 -4.591 0.906 -6.128 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.663 3.523 -5.110 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.265 1.362 -6.644 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.110 1.419 -4.111 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.815 1.611 -3.753 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -0.190 2.571 -5.839 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.211 3.613 -6.859 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.231 3.805 -5.090 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.181 -0.768 -3.742 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.335 -0.439 -5.057 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.603 -0.634 -5.420 1.00 0.00 H new ATOM 955 N LEU A 73 -3.517 4.692 -7.363 1.00 0.00 N ATOM 956 CA LEU A 73 -3.586 5.494 -8.570 1.00 0.00 C ATOM 957 C LEU A 73 -2.173 5.751 -9.091 1.00 0.00 C ATOM 958 O LEU A 73 -1.191 5.578 -8.377 1.00 0.00 O ATOM 959 CB LEU A 73 -4.279 6.836 -8.273 1.00 0.00 C ATOM 960 CG LEU A 73 -5.792 6.866 -8.514 1.00 0.00 C ATOM 961 CD1 LEU A 73 -6.180 6.685 -9.987 1.00 0.00 C ATOM 962 CD2 LEU A 73 -6.551 5.864 -7.640 1.00 0.00 C ATOM 0 H LEU A 73 -3.155 5.214 -6.565 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.162 4.957 -9.324 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -4.089 7.100 -7.233 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -3.816 7.608 -8.888 1.00 0.00 H new ATOM 0 HG LEU A 73 -6.095 7.871 -8.220 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.265 6.717 -10.084 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -5.739 7.486 -10.580 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -5.812 5.724 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -7.618 5.930 -7.854 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.200 4.855 -7.855 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.377 6.093 -6.589 1.00 0.00 H new ATOM 974 N ASP A 74 -2.143 6.163 -10.352 1.00 0.00 N ATOM 975 CA ASP A 74 -1.073 6.578 -11.271 1.00 0.00 C ATOM 976 C ASP A 74 0.354 6.165 -10.866 1.00 0.00 C ATOM 977 O ASP A 74 1.287 6.961 -10.948 1.00 0.00 O ATOM 978 CB ASP A 74 -1.181 8.114 -11.429 1.00 0.00 C ATOM 979 CG ASP A 74 -2.538 8.619 -11.934 1.00 0.00 C ATOM 980 OD1 ASP A 74 -3.498 8.773 -11.141 1.00 0.00 O ATOM 981 OD2 ASP A 74 -2.654 8.927 -13.149 1.00 0.00 O ATOM 0 H ASP A 74 -3.033 6.226 -10.846 1.00 0.00 H new ATOM 0 HA ASP A 74 -1.228 6.049 -12.212 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.973 8.579 -10.465 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.406 8.449 -12.119 1.00 0.00 H new ATOM 986 N PHE A 75 0.532 4.904 -10.483 1.00 0.00 N ATOM 987 CA PHE A 75 1.798 4.338 -10.022 1.00 0.00 C ATOM 988 C PHE A 75 2.911 4.399 -11.061 1.00 0.00 C ATOM 989 O PHE A 75 2.822 3.733 -12.098 1.00 0.00 O ATOM 990 CB PHE A 75 1.563 2.910 -9.531 1.00 0.00 C ATOM 991 CG PHE A 75 2.790 2.127 -9.110 1.00 0.00 C ATOM 992 CD1 PHE A 75 3.366 2.365 -7.852 1.00 0.00 C ATOM 993 CD2 PHE A 75 3.296 1.097 -9.924 1.00 0.00 C ATOM 994 CE1 PHE A 75 4.385 1.529 -7.369 1.00 0.00 C ATOM 995 CE2 PHE A 75 4.304 0.248 -9.436 1.00 0.00 C ATOM 996 CZ PHE A 75 4.836 0.451 -8.152 1.00 0.00 C ATOM 0 H PHE A 75 -0.228 4.223 -10.485 1.00 0.00 H new ATOM 0 HA PHE A 75 2.151 4.957 -9.197 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.877 2.949 -8.685 1.00 0.00 H new ATOM 0 HB3 PHE A 75 1.060 2.356 -10.324 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.023 3.196 -7.253 1.00 0.00 H new ATOM 0 HD2 PHE A 75 2.910 0.959 -10.923 1.00 0.00 H new ATOM 0 HE1 PHE A 75 4.822 1.713 -6.399 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.670 -0.562 -10.049 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.590 -0.219 -7.767 1.00 0.00 H new ATOM 1006 N GLU A 76 3.972 5.144 -10.754 1.00 0.00 N ATOM 1007 CA GLU A 76 5.150 5.346 -11.574 1.00 0.00 C ATOM 1008 C GLU A 76 6.323 4.808 -10.744 1.00 0.00 C ATOM 1009 O GLU A 76 7.032 5.547 -10.060 1.00 0.00 O ATOM 1010 CB GLU A 76 5.238 6.843 -11.952 1.00 0.00 C ATOM 1011 CG GLU A 76 5.654 7.068 -13.410 1.00 0.00 C ATOM 1012 CD GLU A 76 7.127 6.772 -13.696 1.00 0.00 C ATOM 1013 OE1 GLU A 76 7.610 5.656 -13.420 1.00 0.00 O ATOM 1014 OE2 GLU A 76 7.794 7.655 -14.307 1.00 0.00 O ATOM 0 H GLU A 76 4.028 5.651 -9.870 1.00 0.00 H new ATOM 0 HA GLU A 76 5.140 4.818 -12.527 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.270 7.313 -11.779 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.954 7.337 -11.295 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.038 6.440 -14.053 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.444 8.103 -13.680 1.00 0.00 H new ATOM 1021 N ALA A 77 6.551 3.485 -10.790 1.00 0.00 N ATOM 1022 CA ALA A 77 7.611 2.809 -10.029 1.00 0.00 C ATOM 1023 C ALA A 77 9.010 3.424 -10.156 1.00 0.00 C ATOM 1024 O ALA A 77 9.909 3.056 -9.385 1.00 0.00 O ATOM 1025 CB ALA A 77 7.671 1.316 -10.337 1.00 0.00 C ATOM 0 H ALA A 77 5.997 2.849 -11.364 1.00 0.00 H new ATOM 0 HA ALA A 77 7.313 2.961 -8.992 1.00 0.00 H new ATOM 0 HB1 ALA A 77 8.468 0.856 -9.753 1.00 0.00 H new ATOM 0 HB2 ALA A 77 6.719 0.853 -10.079 1.00 0.00 H new ATOM 0 HB3 ALA A 77 7.869 1.171 -11.399 1.00 0.00 H new ATOM 1031 N SER A 78 9.247 4.290 -11.145 1.00 0.00 N ATOM 1032 CA SER A 78 10.529 4.962 -11.283 1.00 0.00 C ATOM 1033 C SER A 78 10.777 5.796 -10.001 1.00 0.00 C ATOM 1034 O SER A 78 11.933 5.987 -9.605 1.00 0.00 O ATOM 1035 CB SER A 78 10.498 5.818 -12.555 1.00 0.00 C ATOM 1036 OG SER A 78 11.794 6.252 -12.920 1.00 0.00 O ATOM 0 H SER A 78 8.563 4.538 -11.860 1.00 0.00 H new ATOM 0 HA SER A 78 11.354 4.257 -11.386 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.063 5.242 -13.372 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.855 6.683 -12.397 1.00 0.00 H new ATOM 0 HG SER A 78 11.740 6.794 -13.735 1.00 0.00 H new ATOM 1042 N GLU A 79 9.715 6.243 -9.312 1.00 0.00 N ATOM 1043 CA GLU A 79 9.775 7.029 -8.088 1.00 0.00 C ATOM 1044 C GLU A 79 8.820 6.555 -6.983 1.00 0.00 C ATOM 1045 O GLU A 79 9.262 6.578 -5.833 1.00 0.00 O ATOM 1046 CB GLU A 79 9.677 8.538 -8.378 1.00 0.00 C ATOM 1047 CG GLU A 79 8.735 9.017 -9.501 1.00 0.00 C ATOM 1048 CD GLU A 79 8.993 10.477 -9.911 1.00 0.00 C ATOM 1049 OE1 GLU A 79 9.668 11.245 -9.165 1.00 0.00 O ATOM 1050 OE2 GLU A 79 8.636 10.844 -11.049 1.00 0.00 O ATOM 0 H GLU A 79 8.758 6.055 -9.611 1.00 0.00 H new ATOM 0 HA GLU A 79 10.764 6.850 -7.667 1.00 0.00 H new ATOM 0 HB2 GLU A 79 9.370 9.032 -7.456 1.00 0.00 H new ATOM 0 HB3 GLU A 79 10.680 8.895 -8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 79 8.857 8.373 -10.372 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.701 8.914 -9.171 1.00 0.00 H new ATOM 1057 N ASP A 80 7.609 6.054 -7.269 1.00 0.00 N ATOM 1058 CA ASP A 80 6.686 5.601 -6.213 1.00 0.00 C ATOM 1059 C ASP A 80 7.289 4.392 -5.471 1.00 0.00 C ATOM 1060 O ASP A 80 8.114 3.659 -6.042 1.00 0.00 O ATOM 1061 CB ASP A 80 5.318 5.124 -6.763 1.00 0.00 C ATOM 1062 CG ASP A 80 4.437 6.100 -7.544 1.00 0.00 C ATOM 1063 OD1 ASP A 80 4.936 6.764 -8.470 1.00 0.00 O ATOM 1064 OD2 ASP A 80 3.196 6.015 -7.373 1.00 0.00 O ATOM 0 H ASP A 80 7.246 5.952 -8.217 1.00 0.00 H new ATOM 0 HA ASP A 80 6.538 6.464 -5.564 1.00 0.00 H new ATOM 0 HB2 ASP A 80 5.507 4.267 -7.409 1.00 0.00 H new ATOM 0 HB3 ASP A 80 4.734 4.763 -5.917 1.00 0.00 H new ATOM 1069 N ARG A 81 6.855 4.084 -4.237 1.00 0.00 N ATOM 1070 CA ARG A 81 7.363 2.942 -3.451 1.00 0.00 C ATOM 1071 C ARG A 81 6.214 2.274 -2.687 1.00 0.00 C ATOM 1072 O ARG A 81 5.222 2.929 -2.379 1.00 0.00 O ATOM 1073 CB ARG A 81 8.454 3.404 -2.471 1.00 0.00 C ATOM 1074 CG ARG A 81 9.514 4.393 -2.990 1.00 0.00 C ATOM 1075 CD ARG A 81 10.613 3.727 -3.819 1.00 0.00 C ATOM 1076 NE ARG A 81 11.300 4.609 -4.779 1.00 0.00 N ATOM 1077 CZ ARG A 81 11.854 5.809 -4.564 1.00 0.00 C ATOM 1078 NH1 ARG A 81 11.677 6.457 -3.417 1.00 0.00 N ATOM 1079 NH2 ARG A 81 12.632 6.341 -5.505 1.00 0.00 N ATOM 0 H ARG A 81 6.137 4.623 -3.752 1.00 0.00 H new ATOM 0 HA ARG A 81 7.800 2.216 -4.137 1.00 0.00 H new ATOM 0 HB2 ARG A 81 7.961 3.861 -1.613 1.00 0.00 H new ATOM 0 HB3 ARG A 81 8.973 2.518 -2.106 1.00 0.00 H new ATOM 0 HG2 ARG A 81 9.023 5.155 -3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 81 9.969 4.905 -2.142 1.00 0.00 H new ATOM 0 HD2 ARG A 81 11.355 3.309 -3.139 1.00 0.00 H new ATOM 0 HD3 ARG A 81 10.176 2.892 -4.366 1.00 0.00 H new ATOM 0 HE ARG A 81 11.362 4.259 -5.735 1.00 0.00 H new ATOM 0 HH11 ARG A 81 11.109 6.041 -2.679 1.00 0.00 H new ATOM 0 HH12 ARG A 81 12.109 7.370 -3.275 1.00 0.00 H new ATOM 0 HH21 ARG A 81 12.799 5.835 -6.375 1.00 0.00 H new ATOM 0 HH22 ARG A 81 13.061 7.254 -5.356 1.00 0.00 H new ATOM 1093 N ILE A 82 6.356 0.999 -2.310 1.00 0.00 N ATOM 1094 CA ILE A 82 5.332 0.228 -1.598 1.00 0.00 C ATOM 1095 C ILE A 82 5.955 -0.547 -0.433 1.00 0.00 C ATOM 1096 O ILE A 82 6.879 -1.345 -0.629 1.00 0.00 O ATOM 1097 CB ILE A 82 4.666 -0.733 -2.618 1.00 0.00 C ATOM 1098 CG1 ILE A 82 3.753 0.007 -3.618 1.00 0.00 C ATOM 1099 CG2 ILE A 82 3.881 -1.900 -1.975 1.00 0.00 C ATOM 1100 CD1 ILE A 82 3.379 -0.793 -4.872 1.00 0.00 C ATOM 0 H ILE A 82 7.204 0.463 -2.495 1.00 0.00 H new ATOM 0 HA ILE A 82 4.581 0.894 -1.173 1.00 0.00 H new ATOM 0 HB ILE A 82 5.510 -1.167 -3.154 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.837 0.297 -3.104 1.00 0.00 H new ATOM 0 HG13 ILE A 82 4.249 0.927 -3.927 1.00 0.00 H new ATOM 0 HG21 ILE A 82 3.448 -2.522 -2.758 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.556 -2.501 -1.366 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.085 -1.500 -1.347 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.736 -0.188 -5.511 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.285 -1.060 -5.417 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.850 -1.700 -4.580 1.00 0.00 H new ATOM 1112 N ASP A 83 5.450 -0.363 0.790 1.00 0.00 N ATOM 1113 CA ASP A 83 5.952 -1.091 1.953 1.00 0.00 C ATOM 1114 C ASP A 83 5.206 -2.424 2.072 1.00 0.00 C ATOM 1115 O ASP A 83 4.039 -2.550 1.688 1.00 0.00 O ATOM 1116 CB ASP A 83 5.795 -0.269 3.237 1.00 0.00 C ATOM 1117 CG ASP A 83 5.969 -1.107 4.508 1.00 0.00 C ATOM 1118 OD1 ASP A 83 6.994 -1.823 4.637 1.00 0.00 O ATOM 1119 OD2 ASP A 83 5.080 -1.068 5.377 1.00 0.00 O ATOM 0 H ASP A 83 4.692 0.287 0.998 1.00 0.00 H new ATOM 0 HA ASP A 83 7.017 -1.279 1.817 1.00 0.00 H new ATOM 0 HB2 ASP A 83 6.528 0.538 3.237 1.00 0.00 H new ATOM 0 HB3 ASP A 83 4.809 0.195 3.247 1.00 0.00 H new ATOM 1124 N LEU A 84 5.902 -3.441 2.578 1.00 0.00 N ATOM 1125 CA LEU A 84 5.395 -4.789 2.789 1.00 0.00 C ATOM 1126 C LEU A 84 6.012 -5.436 4.030 1.00 0.00 C ATOM 1127 O LEU A 84 6.016 -6.661 4.163 1.00 0.00 O ATOM 1128 CB LEU A 84 5.533 -5.628 1.503 1.00 0.00 C ATOM 1129 CG LEU A 84 6.911 -5.684 0.819 1.00 0.00 C ATOM 1130 CD1 LEU A 84 7.968 -6.507 1.571 1.00 0.00 C ATOM 1131 CD2 LEU A 84 6.717 -6.325 -0.560 1.00 0.00 C ATOM 0 H LEU A 84 6.876 -3.340 2.863 1.00 0.00 H new ATOM 0 HA LEU A 84 4.327 -4.737 3.002 1.00 0.00 H new ATOM 0 HB2 LEU A 84 5.235 -6.650 1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.815 -5.246 0.777 1.00 0.00 H new ATOM 0 HG LEU A 84 7.283 -4.660 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 84 8.906 -6.490 1.015 1.00 0.00 H new ATOM 0 HD12 LEU A 84 8.125 -6.079 2.561 1.00 0.00 H new ATOM 0 HD13 LEU A 84 7.624 -7.537 1.671 1.00 0.00 H new ATOM 0 HD21 LEU A 84 7.677 -6.380 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 84 6.311 -7.329 -0.440 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.025 -5.722 -1.148 1.00 0.00 H new ATOM 1143 N SER A 85 6.568 -4.647 4.955 1.00 0.00 N ATOM 1144 CA SER A 85 7.192 -5.155 6.171 1.00 0.00 C ATOM 1145 C SER A 85 6.266 -6.154 6.899 1.00 0.00 C ATOM 1146 O SER A 85 6.731 -7.215 7.319 1.00 0.00 O ATOM 1147 CB SER A 85 7.660 -4.000 7.075 1.00 0.00 C ATOM 1148 OG SER A 85 8.423 -3.007 6.395 1.00 0.00 O ATOM 0 H SER A 85 6.595 -3.630 4.876 1.00 0.00 H new ATOM 0 HA SER A 85 8.086 -5.713 5.893 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.787 -3.528 7.526 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.258 -4.409 7.890 1.00 0.00 H new ATOM 0 HG SER A 85 7.820 -2.410 5.905 1.00 0.00 H new ATOM 1154 N ALA A 86 4.954 -5.878 6.991 1.00 0.00 N ATOM 1155 CA ALA A 86 3.984 -6.762 7.645 1.00 0.00 C ATOM 1156 C ALA A 86 3.136 -7.561 6.657 1.00 0.00 C ATOM 1157 O ALA A 86 3.008 -8.785 6.799 1.00 0.00 O ATOM 1158 CB ALA A 86 3.045 -5.938 8.531 1.00 0.00 C ATOM 0 H ALA A 86 4.538 -5.028 6.610 1.00 0.00 H new ATOM 0 HA ALA A 86 4.565 -7.471 8.235 1.00 0.00 H new ATOM 0 HB1 ALA A 86 2.327 -6.600 9.014 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.627 -5.417 9.291 1.00 0.00 H new ATOM 0 HB3 ALA A 86 2.513 -5.210 7.919 1.00 0.00 H new ATOM 1164 N LEU A 87 2.541 -6.892 5.675 1.00 0.00 N ATOM 1165 CA LEU A 87 1.680 -7.501 4.670 1.00 0.00 C ATOM 1166 C LEU A 87 2.514 -7.713 3.421 1.00 0.00 C ATOM 1167 O LEU A 87 2.942 -6.738 2.815 1.00 0.00 O ATOM 1168 CB LEU A 87 0.488 -6.589 4.349 1.00 0.00 C ATOM 1169 CG LEU A 87 -0.690 -6.606 5.340 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -0.297 -6.226 6.775 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -1.750 -5.629 4.827 1.00 0.00 C ATOM 0 H LEU A 87 2.648 -5.885 5.554 1.00 0.00 H new ATOM 0 HA LEU A 87 1.285 -8.447 5.041 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.855 -5.565 4.276 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.107 -6.862 3.365 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.064 -7.628 5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.179 -6.260 7.415 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.448 -6.929 7.146 1.00 0.00 H new ATOM 0 HD13 LEU A 87 0.119 -5.218 6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.598 -5.620 5.511 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.323 -4.628 4.766 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.085 -5.942 3.838 1.00 0.00 H new ATOM 1183 N GLY A 88 2.770 -8.972 3.067 1.00 0.00 N ATOM 1184 CA GLY A 88 3.548 -9.317 1.878 1.00 0.00 C ATOM 1185 C GLY A 88 4.913 -9.884 2.236 1.00 0.00 C ATOM 1186 O GLY A 88 5.898 -9.150 2.280 1.00 0.00 O ATOM 0 H GLY A 88 2.444 -9.781 3.596 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.997 -10.046 1.283 1.00 0.00 H new ATOM 0 HA3 GLY A 88 3.675 -8.430 1.258 1.00 0.00 H new ATOM 1190 N PHE A 89 5.002 -11.180 2.548 1.00 0.00 N ATOM 1191 CA PHE A 89 6.290 -11.790 2.893 1.00 0.00 C ATOM 1192 C PHE A 89 7.250 -11.755 1.704 1.00 0.00 C ATOM 1193 O PHE A 89 6.820 -11.618 0.558 1.00 0.00 O ATOM 1194 CB PHE A 89 6.091 -13.239 3.344 1.00 0.00 C ATOM 1195 CG PHE A 89 5.243 -13.357 4.587 1.00 0.00 C ATOM 1196 CD1 PHE A 89 5.756 -12.952 5.833 1.00 0.00 C ATOM 1197 CD2 PHE A 89 3.932 -13.850 4.494 1.00 0.00 C ATOM 1198 CE1 PHE A 89 4.952 -13.026 6.982 1.00 0.00 C ATOM 1199 CE2 PHE A 89 3.142 -13.942 5.648 1.00 0.00 C ATOM 1200 CZ PHE A 89 3.642 -13.524 6.892 1.00 0.00 C ATOM 0 H PHE A 89 4.209 -11.821 2.569 1.00 0.00 H new ATOM 0 HA PHE A 89 6.723 -11.213 3.710 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.624 -13.804 2.537 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.064 -13.693 3.530 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.769 -12.584 5.906 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.534 -14.157 3.538 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.341 -12.700 7.935 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.140 -14.338 5.580 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.023 -13.585 7.775 1.00 0.00 H new ATOM 1210 N SER A 90 8.552 -11.886 1.977 1.00 0.00 N ATOM 1211 CA SER A 90 9.557 -11.894 0.920 1.00 0.00 C ATOM 1212 C SER A 90 9.413 -13.176 0.095 1.00 0.00 C ATOM 1213 O SER A 90 9.666 -13.170 -1.108 1.00 0.00 O ATOM 1214 CB SER A 90 10.952 -11.769 1.523 1.00 0.00 C ATOM 1215 OG SER A 90 11.860 -11.270 0.571 1.00 0.00 O ATOM 0 H SER A 90 8.930 -11.987 2.919 1.00 0.00 H new ATOM 0 HA SER A 90 9.407 -11.041 0.258 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.922 -11.106 2.388 1.00 0.00 H new ATOM 0 HB3 SER A 90 11.289 -12.743 1.879 1.00 0.00 H new ATOM 0 HG SER A 90 12.547 -10.737 1.022 1.00 0.00 H new ATOM 1221 N GLY A 91 9.024 -14.279 0.741 1.00 0.00 N ATOM 1222 CA GLY A 91 8.822 -15.555 0.094 1.00 0.00 C ATOM 1223 C GLY A 91 7.598 -15.424 -0.799 1.00 0.00 C ATOM 1224 O GLY A 91 6.540 -14.997 -0.335 1.00 0.00 O ATOM 0 H GLY A 91 8.841 -14.299 1.744 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.698 -15.830 -0.493 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.675 -16.341 0.834 1.00 0.00 H new ATOM 1228 N LEU A 92 7.737 -15.796 -2.067 1.00 0.00 N ATOM 1229 CA LEU A 92 6.687 -15.749 -3.072 1.00 0.00 C ATOM 1230 C LEU A 92 6.061 -17.128 -3.279 1.00 0.00 C ATOM 1231 O LEU A 92 6.610 -18.155 -2.876 1.00 0.00 O ATOM 1232 CB LEU A 92 7.228 -15.139 -4.375 1.00 0.00 C ATOM 1233 CG LEU A 92 8.681 -15.465 -4.780 1.00 0.00 C ATOM 1234 CD1 LEU A 92 8.957 -16.965 -4.918 1.00 0.00 C ATOM 1235 CD2 LEU A 92 8.988 -14.770 -6.104 1.00 0.00 C ATOM 0 H LEU A 92 8.619 -16.152 -2.435 1.00 0.00 H new ATOM 0 HA LEU A 92 5.885 -15.100 -2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.576 -15.457 -5.188 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.138 -14.055 -4.299 1.00 0.00 H new ATOM 0 HG LEU A 92 9.327 -15.104 -3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 92 9.997 -17.119 -5.205 1.00 0.00 H new ATOM 0 HD12 LEU A 92 8.766 -17.459 -3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.304 -17.386 -5.682 1.00 0.00 H new ATOM 0 HD21 LEU A 92 10.013 -14.992 -6.402 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.301 -15.128 -6.871 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.870 -13.693 -5.986 1.00 0.00 H new ATOM 1247 N GLY A 93 4.883 -17.165 -3.894 1.00 0.00 N ATOM 1248 CA GLY A 93 4.124 -18.366 -4.191 1.00 0.00 C ATOM 1249 C GLY A 93 2.725 -17.948 -4.613 1.00 0.00 C ATOM 1250 O GLY A 93 2.565 -17.456 -5.728 1.00 0.00 O ATOM 0 H GLY A 93 4.414 -16.317 -4.212 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.607 -18.935 -4.985 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.080 -19.015 -3.316 1.00 0.00 H new ATOM 1254 N ASP A 94 1.737 -18.070 -3.720 1.00 0.00 N ATOM 1255 CA ASP A 94 0.333 -17.724 -4.008 1.00 0.00 C ATOM 1256 C ASP A 94 -0.358 -16.963 -2.870 1.00 0.00 C ATOM 1257 O ASP A 94 -1.575 -16.777 -2.895 1.00 0.00 O ATOM 1258 CB ASP A 94 -0.469 -18.969 -4.428 1.00 0.00 C ATOM 1259 CG ASP A 94 -0.145 -19.393 -5.857 1.00 0.00 C ATOM 1260 OD1 ASP A 94 -0.599 -18.727 -6.815 1.00 0.00 O ATOM 1261 OD2 ASP A 94 0.578 -20.406 -6.029 1.00 0.00 O ATOM 0 H ASP A 94 1.885 -18.413 -2.771 1.00 0.00 H new ATOM 0 HA ASP A 94 0.357 -17.031 -4.849 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -0.249 -19.790 -3.746 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -1.536 -18.761 -4.343 1.00 0.00 H new ATOM 1266 N GLY A 95 0.400 -16.436 -1.908 1.00 0.00 N ATOM 1267 CA GLY A 95 -0.149 -15.686 -0.790 1.00 0.00 C ATOM 1268 C GLY A 95 -0.489 -16.633 0.340 1.00 0.00 C ATOM 1269 O GLY A 95 -1.546 -17.254 0.343 1.00 0.00 O ATOM 0 H GLY A 95 1.416 -16.521 -1.887 1.00 0.00 H new ATOM 0 HA2 GLY A 95 0.571 -14.942 -0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -1.041 -15.145 -1.105 1.00 0.00 H new ATOM 1273 N TYR A 96 0.405 -16.747 1.318 1.00 0.00 N ATOM 1274 CA TYR A 96 0.227 -17.601 2.479 1.00 0.00 C ATOM 1275 C TYR A 96 1.148 -17.133 3.596 1.00 0.00 C ATOM 1276 O TYR A 96 1.669 -16.017 3.547 1.00 0.00 O ATOM 1277 CB TYR A 96 0.424 -19.092 2.140 1.00 0.00 C ATOM 1278 CG TYR A 96 -0.595 -19.949 2.852 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -1.939 -19.843 2.461 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -0.238 -20.814 3.900 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -2.935 -20.594 3.096 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -1.230 -21.572 4.542 1.00 0.00 C ATOM 1283 CZ TYR A 96 -2.583 -21.473 4.140 1.00 0.00 C ATOM 1284 OH TYR A 96 -3.541 -22.232 4.731 1.00 0.00 O ATOM 0 H TYR A 96 1.288 -16.237 1.322 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.804 -17.515 2.823 1.00 0.00 H new ATOM 0 HB2 TYR A 96 0.338 -19.238 1.063 1.00 0.00 H new ATOM 0 HB3 TYR A 96 1.429 -19.404 2.425 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -2.208 -19.172 1.659 1.00 0.00 H new ATOM 0 HD2 TYR A 96 0.793 -20.895 4.210 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -3.966 -20.501 2.788 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -0.958 -22.236 5.349 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.135 -22.785 5.431 1.00 0.00 H new ATOM 1294 N GLY A 97 1.343 -17.986 4.598 1.00 0.00 N ATOM 1295 CA GLY A 97 2.172 -17.760 5.778 1.00 0.00 C ATOM 1296 C GLY A 97 3.623 -17.359 5.514 1.00 0.00 C ATOM 1297 O GLY A 97 4.301 -16.921 6.438 1.00 0.00 O ATOM 0 H GLY A 97 0.902 -18.905 4.609 1.00 0.00 H new ATOM 0 HA2 GLY A 97 1.705 -16.981 6.381 1.00 0.00 H new ATOM 0 HA3 GLY A 97 2.171 -18.671 6.377 1.00 0.00 H new ATOM 1301 N GLY A 98 4.102 -17.531 4.288 1.00 0.00 N ATOM 1302 CA GLY A 98 5.444 -17.201 3.845 1.00 0.00 C ATOM 1303 C GLY A 98 5.486 -17.221 2.322 1.00 0.00 C ATOM 1304 O GLY A 98 6.505 -17.595 1.746 1.00 0.00 O ATOM 0 H GLY A 98 3.532 -17.925 3.540 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.731 -16.217 4.216 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.160 -17.916 4.250 1.00 0.00 H new ATOM 1308 N THR A 99 4.358 -16.937 1.669 1.00 0.00 N ATOM 1309 CA THR A 99 4.228 -16.931 0.221 1.00 0.00 C ATOM 1310 C THR A 99 3.490 -15.629 -0.145 1.00 0.00 C ATOM 1311 O THR A 99 2.802 -15.049 0.706 1.00 0.00 O ATOM 1312 CB THR A 99 3.623 -18.257 -0.285 1.00 0.00 C ATOM 1313 OG1 THR A 99 2.238 -18.144 -0.386 1.00 0.00 O ATOM 1314 CG2 THR A 99 3.937 -19.494 0.578 1.00 0.00 C ATOM 0 H THR A 99 3.490 -16.699 2.150 1.00 0.00 H new ATOM 0 HA THR A 99 5.183 -16.908 -0.305 1.00 0.00 H new ATOM 0 HB THR A 99 4.096 -18.420 -1.253 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.863 -18.990 -0.709 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.467 -20.373 0.138 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.016 -19.643 0.622 1.00 0.00 H new ATOM 0 HG23 THR A 99 3.551 -19.342 1.586 1.00 0.00 H new ATOM 1322 N LEU A 100 3.576 -15.185 -1.402 1.00 0.00 N ATOM 1323 CA LEU A 100 2.967 -13.951 -1.900 1.00 0.00 C ATOM 1324 C LEU A 100 2.575 -14.160 -3.362 1.00 0.00 C ATOM 1325 O LEU A 100 3.346 -14.804 -4.081 1.00 0.00 O ATOM 1326 CB LEU A 100 4.048 -12.858 -1.732 1.00 0.00 C ATOM 1327 CG LEU A 100 3.629 -11.387 -1.873 1.00 0.00 C ATOM 1328 CD1 LEU A 100 3.434 -10.943 -3.329 1.00 0.00 C ATOM 1329 CD2 LEU A 100 2.364 -11.084 -1.091 1.00 0.00 C ATOM 0 H LEU A 100 4.088 -15.692 -2.124 1.00 0.00 H new ATOM 0 HA LEU A 100 2.062 -13.663 -1.365 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.495 -12.983 -0.746 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.832 -13.051 -2.464 1.00 0.00 H new ATOM 0 HG LEU A 100 4.462 -10.819 -1.459 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.139 -9.894 -3.353 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.368 -11.070 -3.876 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.656 -11.549 -3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 100 2.101 -10.034 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.550 -11.708 -1.460 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.531 -11.292 -0.034 1.00 0.00 H new ATOM 1341 N LEU A 101 1.406 -13.685 -3.807 1.00 0.00 N ATOM 1342 CA LEU A 101 0.937 -13.834 -5.189 1.00 0.00 C ATOM 1343 C LEU A 101 1.002 -12.498 -5.910 1.00 0.00 C ATOM 1344 O LEU A 101 0.565 -11.490 -5.364 1.00 0.00 O ATOM 1345 CB LEU A 101 -0.533 -14.282 -5.196 1.00 0.00 C ATOM 1346 CG LEU A 101 -1.018 -15.018 -6.463 1.00 0.00 C ATOM 1347 CD1 LEU A 101 -2.293 -15.806 -6.138 1.00 0.00 C ATOM 1348 CD2 LEU A 101 -1.306 -14.100 -7.657 1.00 0.00 C ATOM 0 H LEU A 101 0.751 -13.180 -3.210 1.00 0.00 H new ATOM 0 HA LEU A 101 1.571 -14.570 -5.683 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -0.696 -14.934 -4.338 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.159 -13.402 -5.051 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.198 -15.672 -6.759 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -2.637 -16.326 -7.032 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.082 -16.533 -5.354 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.068 -15.120 -5.797 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.641 -14.699 -8.504 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.084 -13.385 -7.387 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.398 -13.562 -7.930 1.00 0.00 H new ATOM 1360 N LEU A 102 1.547 -12.493 -7.119 1.00 0.00 N ATOM 1361 CA LEU A 102 1.669 -11.348 -8.007 1.00 0.00 C ATOM 1362 C LEU A 102 1.272 -11.789 -9.409 1.00 0.00 C ATOM 1363 O LEU A 102 1.586 -12.902 -9.855 1.00 0.00 O ATOM 1364 CB LEU A 102 3.070 -10.697 -7.957 1.00 0.00 C ATOM 1365 CG LEU A 102 3.822 -10.454 -9.295 1.00 0.00 C ATOM 1366 CD1 LEU A 102 3.414 -9.133 -9.972 1.00 0.00 C ATOM 1367 CD2 LEU A 102 5.329 -10.411 -9.054 1.00 0.00 C ATOM 0 H LEU A 102 1.939 -13.340 -7.529 1.00 0.00 H new ATOM 0 HA LEU A 102 0.994 -10.560 -7.673 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.971 -9.736 -7.453 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.704 -11.323 -7.329 1.00 0.00 H new ATOM 0 HG LEU A 102 3.552 -11.281 -9.951 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.970 -9.014 -10.902 1.00 0.00 H new ATOM 0 HD12 LEU A 102 2.346 -9.149 -10.187 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.637 -8.299 -9.307 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.844 -10.240 -9.999 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.564 -9.603 -8.362 1.00 0.00 H new ATOM 0 HD23 LEU A 102 5.657 -11.360 -8.629 1.00 0.00 H new ATOM 1379 N LYS A 103 0.566 -10.896 -10.088 1.00 0.00 N ATOM 1380 CA LYS A 103 0.084 -11.034 -11.451 1.00 0.00 C ATOM 1381 C LYS A 103 -0.263 -9.661 -12.014 1.00 0.00 C ATOM 1382 O LYS A 103 -0.326 -8.668 -11.286 1.00 0.00 O ATOM 1383 CB LYS A 103 -1.136 -11.986 -11.524 1.00 0.00 C ATOM 1384 CG LYS A 103 -0.834 -13.379 -12.107 1.00 0.00 C ATOM 1385 CD LYS A 103 0.050 -13.336 -13.370 1.00 0.00 C ATOM 1386 CE LYS A 103 -0.127 -14.580 -14.235 1.00 0.00 C ATOM 1387 NZ LYS A 103 0.847 -14.600 -15.341 1.00 0.00 N ATOM 0 H LYS A 103 0.299 -10.002 -9.675 1.00 0.00 H new ATOM 0 HA LYS A 103 0.876 -11.476 -12.056 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.544 -12.108 -10.521 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.911 -11.515 -12.128 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.339 -13.983 -11.347 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.774 -13.876 -12.347 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.197 -12.450 -13.955 1.00 0.00 H new ATOM 0 HD3 LYS A 103 1.096 -13.244 -13.077 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -0.005 -15.473 -13.622 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -1.140 -14.606 -14.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 0.705 -15.456 -15.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 0.713 -13.759 -15.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 1.812 -14.599 -14.954 1.00 0.00 H new ATOM 1401 N THR A 104 -0.545 -9.616 -13.309 1.00 0.00 N ATOM 1402 CA THR A 104 -0.898 -8.409 -14.024 1.00 0.00 C ATOM 1403 C THR A 104 -2.148 -8.664 -14.865 1.00 0.00 C ATOM 1404 O THR A 104 -2.539 -9.809 -15.149 1.00 0.00 O ATOM 1405 CB THR A 104 0.308 -7.970 -14.885 1.00 0.00 C ATOM 1406 OG1 THR A 104 0.784 -9.085 -15.616 1.00 0.00 O ATOM 1407 CG2 THR A 104 1.458 -7.428 -14.028 1.00 0.00 C ATOM 0 H THR A 104 -0.533 -10.445 -13.903 1.00 0.00 H new ATOM 0 HA THR A 104 -1.131 -7.600 -13.332 1.00 0.00 H new ATOM 0 HB THR A 104 -0.031 -7.175 -15.549 1.00 0.00 H new ATOM 0 HG1 THR A 104 1.548 -8.813 -16.166 1.00 0.00 H new ATOM 0 HG21 THR A 104 2.284 -7.131 -14.674 1.00 0.00 H new ATOM 0 HG22 THR A 104 1.113 -6.564 -13.460 1.00 0.00 H new ATOM 0 HG23 THR A 104 1.795 -8.203 -13.340 1.00 0.00 H new ATOM 1415 N ASN A 105 -2.774 -7.561 -15.266 1.00 0.00 N ATOM 1416 CA ASN A 105 -3.958 -7.547 -16.119 1.00 0.00 C ATOM 1417 C ASN A 105 -3.592 -8.170 -17.473 1.00 0.00 C ATOM 1418 O ASN A 105 -2.404 -8.251 -17.781 1.00 0.00 O ATOM 1419 CB ASN A 105 -4.493 -6.146 -16.244 1.00 0.00 C ATOM 1420 CG ASN A 105 -5.943 -6.083 -16.696 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -6.805 -6.669 -16.054 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -6.238 -5.349 -17.759 1.00 0.00 N ATOM 0 H ASN A 105 -2.463 -6.627 -14.999 1.00 0.00 H new ATOM 0 HA ASN A 105 -4.759 -8.142 -15.680 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -4.400 -5.644 -15.281 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -3.876 -5.593 -16.953 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -7.207 -5.260 -18.064 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -5.496 -4.873 -18.272 1.00 0.00 H new ATOM 1429 N ALA A 106 -4.559 -8.518 -18.329 1.00 0.00 N ATOM 1430 CA ALA A 106 -4.268 -9.127 -19.633 1.00 0.00 C ATOM 1431 C ALA A 106 -3.235 -8.327 -20.427 1.00 0.00 C ATOM 1432 O ALA A 106 -2.239 -8.870 -20.900 1.00 0.00 O ATOM 1433 CB ALA A 106 -5.554 -9.258 -20.442 1.00 0.00 C ATOM 0 H ALA A 106 -5.553 -8.388 -18.142 1.00 0.00 H new ATOM 0 HA ALA A 106 -3.844 -10.114 -19.446 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.331 -9.710 -21.408 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -6.262 -9.887 -19.901 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -5.990 -8.271 -20.595 1.00 0.00 H new ATOM 1439 N GLU A 107 -3.463 -7.019 -20.538 1.00 0.00 N ATOM 1440 CA GLU A 107 -2.557 -6.130 -21.254 1.00 0.00 C ATOM 1441 C GLU A 107 -1.484 -5.555 -20.313 1.00 0.00 C ATOM 1442 O GLU A 107 -0.491 -5.001 -20.774 1.00 0.00 O ATOM 1443 CB GLU A 107 -3.400 -5.050 -21.935 1.00 0.00 C ATOM 1444 CG GLU A 107 -2.662 -4.410 -23.111 1.00 0.00 C ATOM 1445 CD GLU A 107 -3.562 -3.425 -23.845 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -4.626 -3.822 -24.383 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -3.218 -2.229 -23.870 1.00 0.00 O ATOM 0 H GLU A 107 -4.275 -6.551 -20.136 1.00 0.00 H new ATOM 0 HA GLU A 107 -2.004 -6.676 -22.019 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -4.335 -5.487 -22.287 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -3.661 -4.281 -21.208 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -1.771 -3.896 -22.750 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -2.326 -5.185 -23.800 1.00 0.00 H new ATOM 1454 N GLY A 108 -1.665 -5.685 -18.993 1.00 0.00 N ATOM 1455 CA GLY A 108 -0.734 -5.196 -17.987 1.00 0.00 C ATOM 1456 C GLY A 108 -1.043 -3.768 -17.549 1.00 0.00 C ATOM 1457 O GLY A 108 -0.241 -3.177 -16.847 1.00 0.00 O ATOM 0 H GLY A 108 -2.483 -6.144 -18.593 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.765 -5.854 -17.118 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.280 -5.239 -18.384 1.00 0.00 H new ATOM 1461 N THR A 109 -2.207 -3.208 -17.881 1.00 0.00 N ATOM 1462 CA THR A 109 -2.592 -1.845 -17.505 1.00 0.00 C ATOM 1463 C THR A 109 -2.656 -1.704 -15.982 1.00 0.00 C ATOM 1464 O THR A 109 -2.521 -0.621 -15.423 1.00 0.00 O ATOM 1465 CB THR A 109 -3.976 -1.529 -18.108 1.00 0.00 C ATOM 1466 OG1 THR A 109 -4.288 -2.382 -19.210 1.00 0.00 O ATOM 1467 CG2 THR A 109 -4.085 -0.070 -18.542 1.00 0.00 C ATOM 0 H THR A 109 -2.919 -3.694 -18.426 1.00 0.00 H new ATOM 0 HA THR A 109 -1.847 -1.148 -17.888 1.00 0.00 H new ATOM 0 HB THR A 109 -4.701 -1.713 -17.315 1.00 0.00 H new ATOM 0 HG1 THR A 109 -5.173 -2.151 -19.562 1.00 0.00 H new ATOM 0 HG21 THR A 109 -5.075 0.112 -18.961 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.932 0.579 -17.680 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.327 0.143 -19.296 1.00 0.00 H new ATOM 1475 N ARG A 110 -2.904 -2.830 -15.313 1.00 0.00 N ATOM 1476 CA ARG A 110 -3.005 -2.934 -13.879 1.00 0.00 C ATOM 1477 C ARG A 110 -2.239 -4.135 -13.382 1.00 0.00 C ATOM 1478 O ARG A 110 -1.930 -5.054 -14.151 1.00 0.00 O ATOM 1479 CB ARG A 110 -4.481 -3.096 -13.513 1.00 0.00 C ATOM 1480 CG ARG A 110 -5.294 -1.804 -13.605 1.00 0.00 C ATOM 1481 CD ARG A 110 -6.608 -1.914 -12.822 1.00 0.00 C ATOM 1482 NE ARG A 110 -7.450 -3.026 -13.296 1.00 0.00 N ATOM 1483 CZ ARG A 110 -8.291 -2.997 -14.335 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -8.367 -1.931 -15.129 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -9.050 -4.062 -14.570 1.00 0.00 N ATOM 0 H ARG A 110 -3.044 -3.723 -15.785 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.587 -2.039 -13.419 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -4.928 -3.841 -14.172 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -4.552 -3.485 -12.497 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.705 -0.973 -13.216 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.509 -1.581 -14.650 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.387 -2.054 -11.764 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -7.161 -0.979 -12.911 1.00 0.00 H new ATOM 0 HE ARG A 110 -7.385 -3.904 -12.781 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -7.778 -1.118 -14.949 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -9.015 -1.927 -15.917 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -8.984 -4.879 -13.963 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -9.699 -4.062 -15.357 1.00 0.00 H new ATOM 1499 N THR A 111 -2.002 -4.139 -12.079 1.00 0.00 N ATOM 1500 CA THR A 111 -1.318 -5.190 -11.369 1.00 0.00 C ATOM 1501 C THR A 111 -2.224 -5.631 -10.219 1.00 0.00 C ATOM 1502 O THR A 111 -2.835 -4.812 -9.527 1.00 0.00 O ATOM 1503 CB THR A 111 0.016 -4.652 -10.845 1.00 0.00 C ATOM 1504 OG1 THR A 111 0.804 -4.038 -11.832 1.00 0.00 O ATOM 1505 CG2 THR A 111 0.887 -5.723 -10.187 1.00 0.00 C ATOM 0 H THR A 111 -2.296 -3.376 -11.470 1.00 0.00 H new ATOM 0 HA THR A 111 -1.108 -6.042 -12.016 1.00 0.00 H new ATOM 0 HB THR A 111 -0.296 -3.914 -10.106 1.00 0.00 H new ATOM 0 HG1 THR A 111 0.505 -4.330 -12.718 1.00 0.00 H new ATOM 0 HG21 THR A 111 1.816 -5.273 -9.839 1.00 0.00 H new ATOM 0 HG22 THR A 111 0.354 -6.156 -9.340 1.00 0.00 H new ATOM 0 HG23 THR A 111 1.112 -6.505 -10.912 1.00 0.00 H new ATOM 1513 N TYR A 112 -2.321 -6.941 -10.021 1.00 0.00 N ATOM 1514 CA TYR A 112 -3.089 -7.575 -8.959 1.00 0.00 C ATOM 1515 C TYR A 112 -2.026 -8.421 -8.251 1.00 0.00 C ATOM 1516 O TYR A 112 -1.560 -9.425 -8.784 1.00 0.00 O ATOM 1517 CB TYR A 112 -4.165 -8.474 -9.608 1.00 0.00 C ATOM 1518 CG TYR A 112 -5.573 -7.899 -9.647 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -5.806 -6.533 -9.907 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -6.663 -8.739 -9.347 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -7.094 -5.989 -9.758 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -7.946 -8.198 -9.178 1.00 0.00 C ATOM 1523 CZ TYR A 112 -8.155 -6.812 -9.324 1.00 0.00 C ATOM 1524 OH TYR A 112 -9.356 -6.281 -8.975 1.00 0.00 O ATOM 0 H TYR A 112 -1.847 -7.616 -10.621 1.00 0.00 H new ATOM 0 HA TYR A 112 -3.604 -6.890 -8.285 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -3.856 -8.699 -10.629 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -4.194 -9.421 -9.068 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -4.990 -5.900 -10.223 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -6.510 -9.803 -9.247 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -7.271 -4.946 -9.975 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -8.776 -8.845 -8.935 1.00 0.00 H new ATOM 0 HH TYR A 112 -9.667 -6.694 -8.142 1.00 0.00 H new ATOM 1534 N LEU A 113 -1.729 -8.113 -6.996 1.00 0.00 N ATOM 1535 CA LEU A 113 -0.763 -8.826 -6.164 1.00 0.00 C ATOM 1536 C LEU A 113 -1.271 -8.716 -4.743 1.00 0.00 C ATOM 1537 O LEU A 113 -1.737 -7.635 -4.382 1.00 0.00 O ATOM 1538 CB LEU A 113 0.677 -8.284 -6.314 1.00 0.00 C ATOM 1539 CG LEU A 113 0.994 -6.897 -5.702 1.00 0.00 C ATOM 1540 CD1 LEU A 113 1.451 -6.971 -4.236 1.00 0.00 C ATOM 1541 CD2 LEU A 113 2.134 -6.240 -6.488 1.00 0.00 C ATOM 0 H LEU A 113 -2.169 -7.332 -6.510 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.688 -9.868 -6.476 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.356 -9.010 -5.868 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.910 -8.242 -7.378 1.00 0.00 H new ATOM 0 HG LEU A 113 0.067 -6.326 -5.753 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.657 -5.966 -3.868 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.665 -7.425 -3.632 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.356 -7.575 -4.167 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.357 -5.264 -6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.022 -6.871 -6.437 1.00 0.00 H new ATOM 0 HD23 LEU A 113 1.835 -6.118 -7.529 1.00 0.00 H new ATOM 1553 N LYS A 114 -1.306 -9.817 -3.994 1.00 0.00 N ATOM 1554 CA LYS A 114 -1.778 -9.791 -2.612 1.00 0.00 C ATOM 1555 C LYS A 114 -1.140 -10.872 -1.773 1.00 0.00 C ATOM 1556 O LYS A 114 -0.727 -11.921 -2.282 1.00 0.00 O ATOM 1557 CB LYS A 114 -3.298 -9.997 -2.457 1.00 0.00 C ATOM 1558 CG LYS A 114 -4.187 -8.939 -3.111 1.00 0.00 C ATOM 1559 CD LYS A 114 -4.552 -9.331 -4.552 1.00 0.00 C ATOM 1560 CE LYS A 114 -4.714 -8.043 -5.339 1.00 0.00 C ATOM 1561 NZ LYS A 114 -5.453 -8.222 -6.596 1.00 0.00 N ATOM 0 H LYS A 114 -1.013 -10.738 -4.321 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.501 -8.791 -2.278 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.557 -10.970 -2.875 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.533 -10.034 -1.393 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.097 -8.812 -2.525 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.672 -7.978 -3.112 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -3.773 -9.955 -4.990 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.474 -9.912 -4.571 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.233 -7.310 -4.721 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.728 -7.633 -5.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.574 -7.300 -7.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.922 -8.859 -7.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.387 -8.633 -6.394 1.00 0.00 H new ATOM 1575 N SER A 115 -1.059 -10.584 -0.480 1.00 0.00 N ATOM 1576 CA SER A 115 -0.537 -11.492 0.513 1.00 0.00 C ATOM 1577 C SER A 115 -1.715 -12.352 0.971 1.00 0.00 C ATOM 1578 O SER A 115 -2.875 -11.970 0.826 1.00 0.00 O ATOM 1579 CB SER A 115 0.069 -10.683 1.670 1.00 0.00 C ATOM 1580 OG SER A 115 1.107 -11.397 2.323 1.00 0.00 O ATOM 0 H SER A 115 -1.363 -9.691 -0.092 1.00 0.00 H new ATOM 0 HA SER A 115 0.256 -12.129 0.121 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.460 -9.740 1.289 1.00 0.00 H new ATOM 0 HB3 SER A 115 -0.712 -10.437 2.390 1.00 0.00 H new ATOM 0 HG SER A 115 1.044 -11.253 3.290 1.00 0.00 H new ATOM 1586 N PHE A 116 -1.395 -13.507 1.555 1.00 0.00 N ATOM 1587 CA PHE A 116 -2.317 -14.492 2.098 1.00 0.00 C ATOM 1588 C PHE A 116 -3.422 -14.943 1.117 1.00 0.00 C ATOM 1589 O PHE A 116 -3.422 -14.569 -0.059 1.00 0.00 O ATOM 1590 CB PHE A 116 -2.808 -13.897 3.427 1.00 0.00 C ATOM 1591 CG PHE A 116 -3.565 -14.818 4.365 1.00 0.00 C ATOM 1592 CD1 PHE A 116 -3.086 -16.106 4.667 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -4.767 -14.375 4.938 1.00 0.00 C ATOM 1594 CE1 PHE A 116 -3.810 -16.933 5.539 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -5.496 -15.199 5.806 1.00 0.00 C ATOM 1596 CZ PHE A 116 -5.004 -16.473 6.123 1.00 0.00 C ATOM 0 H PHE A 116 -0.422 -13.793 1.666 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.822 -15.447 2.275 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -1.942 -13.508 3.963 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -3.450 -13.046 3.199 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -2.163 -16.457 4.229 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -5.135 -13.386 4.707 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -3.449 -17.926 5.763 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.429 -14.855 6.227 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.542 -17.102 6.816 1.00 0.00 H new ATOM 1606 N GLU A 117 -4.290 -15.858 1.563 1.00 0.00 N ATOM 1607 CA GLU A 117 -5.415 -16.392 0.803 1.00 0.00 C ATOM 1608 C GLU A 117 -6.364 -17.123 1.749 1.00 0.00 C ATOM 1609 O GLU A 117 -6.041 -17.310 2.928 1.00 0.00 O ATOM 1610 CB GLU A 117 -4.954 -17.320 -0.340 1.00 0.00 C ATOM 1611 CG GLU A 117 -4.552 -18.744 0.091 1.00 0.00 C ATOM 1612 CD GLU A 117 -5.692 -19.766 0.006 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -6.429 -19.762 -1.010 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -5.877 -20.579 0.940 1.00 0.00 O ATOM 0 H GLU A 117 -4.222 -16.259 2.498 1.00 0.00 H new ATOM 0 HA GLU A 117 -5.938 -15.558 0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -5.757 -17.393 -1.073 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -4.105 -16.857 -0.842 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -3.727 -19.083 -0.535 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -4.182 -18.712 1.116 1.00 0.00 H new ATOM 1621 N ALA A 118 -7.546 -17.476 1.241 1.00 0.00 N ATOM 1622 CA ALA A 118 -8.603 -18.199 1.927 1.00 0.00 C ATOM 1623 C ALA A 118 -9.705 -18.526 0.918 1.00 0.00 C ATOM 1624 O ALA A 118 -9.441 -18.747 -0.266 1.00 0.00 O ATOM 1625 CB ALA A 118 -9.136 -17.447 3.160 1.00 0.00 C ATOM 0 H ALA A 118 -7.800 -17.248 0.280 1.00 0.00 H new ATOM 0 HA ALA A 118 -8.195 -19.128 2.325 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -9.923 -18.034 3.632 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -8.324 -17.291 3.870 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -9.539 -16.482 2.852 1.00 0.00 H new ATOM 1631 N ASP A 119 -10.935 -18.598 1.409 1.00 0.00 N ATOM 1632 CA ASP A 119 -12.184 -18.863 0.720 1.00 0.00 C ATOM 1633 C ASP A 119 -13.075 -17.654 0.978 1.00 0.00 C ATOM 1634 O ASP A 119 -12.819 -16.917 1.929 1.00 0.00 O ATOM 1635 CB ASP A 119 -12.851 -20.157 1.209 1.00 0.00 C ATOM 1636 CG ASP A 119 -12.738 -21.294 0.196 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -12.889 -21.064 -1.025 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -12.567 -22.458 0.637 1.00 0.00 O ATOM 0 H ASP A 119 -11.095 -18.457 2.406 1.00 0.00 H new ATOM 0 HA ASP A 119 -12.009 -19.011 -0.346 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -12.392 -20.465 2.149 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -13.903 -19.963 1.416 1.00 0.00 H new ATOM 1643 N ALA A 120 -14.077 -17.407 0.132 1.00 0.00 N ATOM 1644 CA ALA A 120 -15.036 -16.297 0.236 1.00 0.00 C ATOM 1645 C ALA A 120 -15.356 -15.900 1.690 1.00 0.00 C ATOM 1646 O ALA A 120 -15.265 -14.724 2.058 1.00 0.00 O ATOM 1647 CB ALA A 120 -16.328 -16.680 -0.496 1.00 0.00 C ATOM 0 H ALA A 120 -14.253 -17.998 -0.680 1.00 0.00 H new ATOM 0 HA ALA A 120 -14.572 -15.426 -0.226 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -17.044 -15.861 -0.423 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -16.107 -16.876 -1.545 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -16.752 -17.575 -0.041 1.00 0.00 H new ATOM 1653 N GLU A 121 -15.726 -16.877 2.517 1.00 0.00 N ATOM 1654 CA GLU A 121 -16.051 -16.689 3.924 1.00 0.00 C ATOM 1655 C GLU A 121 -14.788 -16.574 4.789 1.00 0.00 C ATOM 1656 O GLU A 121 -14.759 -15.755 5.707 1.00 0.00 O ATOM 1657 CB GLU A 121 -16.901 -17.899 4.350 1.00 0.00 C ATOM 1658 CG GLU A 121 -17.023 -18.090 5.869 1.00 0.00 C ATOM 1659 CD GLU A 121 -18.150 -19.047 6.271 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -18.504 -19.958 5.495 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -18.675 -18.865 7.401 1.00 0.00 O ATOM 0 H GLU A 121 -15.809 -17.848 2.215 1.00 0.00 H new ATOM 0 HA GLU A 121 -16.598 -15.757 4.064 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -17.901 -17.791 3.929 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -16.469 -18.801 3.917 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -16.078 -18.469 6.258 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -17.194 -17.121 6.337 1.00 0.00 H new ATOM 1668 N GLY A 122 -13.759 -17.366 4.477 1.00 0.00 N ATOM 1669 CA GLY A 122 -12.477 -17.444 5.166 1.00 0.00 C ATOM 1670 C GLY A 122 -11.570 -16.222 5.043 1.00 0.00 C ATOM 1671 O GLY A 122 -10.639 -16.148 5.844 1.00 0.00 O ATOM 0 H GLY A 122 -13.806 -18.009 3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -12.667 -17.624 6.224 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.937 -18.311 4.787 1.00 0.00 H new ATOM 1675 N ARG A 123 -11.823 -15.301 4.089 1.00 0.00 N ATOM 1676 CA ARG A 123 -11.125 -14.022 3.775 1.00 0.00 C ATOM 1677 C ARG A 123 -10.259 -14.089 2.510 1.00 0.00 C ATOM 1678 O ARG A 123 -9.091 -14.456 2.603 1.00 0.00 O ATOM 1679 CB ARG A 123 -10.208 -13.507 4.909 1.00 0.00 C ATOM 1680 CG ARG A 123 -10.890 -13.179 6.246 1.00 0.00 C ATOM 1681 CD ARG A 123 -9.838 -13.340 7.349 1.00 0.00 C ATOM 1682 NE ARG A 123 -10.415 -13.204 8.691 1.00 0.00 N ATOM 1683 CZ ARG A 123 -10.413 -12.111 9.454 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -9.936 -10.962 8.981 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -10.875 -12.187 10.695 1.00 0.00 N ATOM 0 H ARG A 123 -12.603 -15.444 3.448 1.00 0.00 H new ATOM 0 HA ARG A 123 -11.958 -13.334 3.630 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -9.439 -14.257 5.093 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -9.700 -12.610 4.556 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -11.284 -12.163 6.237 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -11.734 -13.846 6.420 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -9.364 -14.317 7.257 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -9.056 -12.593 7.214 1.00 0.00 H new ATOM 0 HE ARG A 123 -10.865 -14.032 9.081 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -9.570 -10.915 8.030 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -9.937 -10.129 9.569 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -11.226 -13.074 11.055 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -10.879 -11.358 11.289 1.00 0.00 H new ATOM 1699 N ARG A 124 -10.749 -13.780 1.310 1.00 0.00 N ATOM 1700 CA ARG A 124 -9.933 -13.811 0.103 1.00 0.00 C ATOM 1701 C ARG A 124 -9.378 -12.417 -0.149 1.00 0.00 C ATOM 1702 O ARG A 124 -9.921 -11.442 0.354 1.00 0.00 O ATOM 1703 CB ARG A 124 -10.797 -14.290 -1.054 1.00 0.00 C ATOM 1704 CG ARG A 124 -11.159 -15.775 -0.901 1.00 0.00 C ATOM 1705 CD ARG A 124 -10.774 -16.644 -2.096 1.00 0.00 C ATOM 1706 NE ARG A 124 -11.335 -16.197 -3.380 1.00 0.00 N ATOM 1707 CZ ARG A 124 -10.721 -16.202 -4.572 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -9.443 -16.562 -4.700 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -11.416 -15.847 -5.649 1.00 0.00 N ATOM 0 H ARG A 124 -11.718 -13.503 1.150 1.00 0.00 H new ATOM 0 HA ARG A 124 -9.093 -14.497 0.211 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -11.708 -13.694 -1.101 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -10.267 -14.137 -1.994 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.668 -16.166 -0.010 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -12.233 -15.860 -0.737 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.687 -16.668 -2.177 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -11.102 -17.666 -1.907 1.00 0.00 H new ATOM 0 HE ARG A 124 -12.293 -15.846 -3.362 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -8.908 -16.843 -3.879 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.001 -16.556 -5.619 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.396 -15.578 -5.558 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -10.969 -15.843 -6.566 1.00 0.00 H new ATOM 1723 N PHE A 125 -8.331 -12.300 -0.946 1.00 0.00 N ATOM 1724 CA PHE A 125 -7.649 -11.089 -1.290 1.00 0.00 C ATOM 1725 C PHE A 125 -8.307 -10.283 -2.423 1.00 0.00 C ATOM 1726 O PHE A 125 -8.911 -10.879 -3.321 1.00 0.00 O ATOM 1727 CB PHE A 125 -6.307 -11.637 -1.802 1.00 0.00 C ATOM 1728 CG PHE A 125 -6.340 -12.829 -2.762 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -6.746 -12.684 -4.105 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -5.964 -14.100 -2.299 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -6.823 -13.800 -4.956 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -5.999 -15.210 -3.163 1.00 0.00 C ATOM 1733 CZ PHE A 125 -6.437 -15.065 -4.485 1.00 0.00 C ATOM 0 H PHE A 125 -7.914 -13.114 -1.396 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.617 -10.399 -0.447 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.781 -10.822 -2.299 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.710 -11.921 -0.936 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -7.000 -11.705 -4.483 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.646 -14.226 -1.275 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.178 -13.685 -5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -5.686 -16.180 -2.804 1.00 0.00 H new ATOM 0 HZ PHE A 125 -6.478 -15.923 -5.140 1.00 0.00 H new ATOM 1743 N GLU A 126 -8.164 -8.953 -2.413 1.00 0.00 N ATOM 1744 CA GLU A 126 -8.663 -8.046 -3.464 1.00 0.00 C ATOM 1745 C GLU A 126 -8.019 -6.655 -3.390 1.00 0.00 C ATOM 1746 O GLU A 126 -8.308 -5.934 -2.442 1.00 0.00 O ATOM 1747 CB GLU A 126 -10.190 -7.889 -3.400 1.00 0.00 C ATOM 1748 CG GLU A 126 -10.899 -8.501 -4.606 1.00 0.00 C ATOM 1749 CD GLU A 126 -10.801 -7.735 -5.937 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -9.741 -7.787 -6.599 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -11.828 -7.147 -6.371 1.00 0.00 O ATOM 0 H GLU A 126 -7.687 -8.461 -1.657 1.00 0.00 H new ATOM 0 HA GLU A 126 -8.385 -8.510 -4.410 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.561 -8.359 -2.489 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.439 -6.830 -3.337 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -10.499 -9.503 -4.762 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.954 -8.614 -4.357 1.00 0.00 H new ATOM 1758 N VAL A 127 -7.157 -6.257 -4.343 1.00 0.00 N ATOM 1759 CA VAL A 127 -6.513 -4.940 -4.417 1.00 0.00 C ATOM 1760 C VAL A 127 -6.358 -4.648 -5.910 1.00 0.00 C ATOM 1761 O VAL A 127 -6.283 -5.602 -6.697 1.00 0.00 O ATOM 1762 CB VAL A 127 -5.146 -4.899 -3.682 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -4.427 -3.555 -3.857 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -5.309 -5.212 -2.197 1.00 0.00 C ATOM 0 H VAL A 127 -6.882 -6.870 -5.110 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.117 -4.184 -3.914 1.00 0.00 H new ATOM 0 HB VAL A 127 -4.527 -5.669 -4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.477 -3.579 -3.324 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -4.244 -3.375 -4.916 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -5.049 -2.755 -3.455 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -4.335 -5.176 -1.709 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.971 -4.476 -1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.737 -6.208 -2.080 1.00 0.00 H new ATOM 1774 N ALA A 128 -6.287 -3.382 -6.317 1.00 0.00 N ATOM 1775 CA ALA A 128 -6.102 -3.008 -7.708 1.00 0.00 C ATOM 1776 C ALA A 128 -5.073 -1.883 -7.773 1.00 0.00 C ATOM 1777 O ALA A 128 -5.269 -0.825 -7.180 1.00 0.00 O ATOM 1778 CB ALA A 128 -7.448 -2.597 -8.310 1.00 0.00 C ATOM 0 H ALA A 128 -6.357 -2.586 -5.683 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.729 -3.848 -8.294 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.309 -2.316 -9.354 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.145 -3.433 -8.249 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.850 -1.748 -7.757 1.00 0.00 H new ATOM 1784 N LEU A 129 -3.981 -2.113 -8.499 1.00 0.00 N ATOM 1785 CA LEU A 129 -2.903 -1.152 -8.690 1.00 0.00 C ATOM 1786 C LEU A 129 -2.980 -0.742 -10.150 1.00 0.00 C ATOM 1787 O LEU A 129 -2.964 -1.620 -11.022 1.00 0.00 O ATOM 1788 CB LEU A 129 -1.556 -1.799 -8.324 1.00 0.00 C ATOM 1789 CG LEU A 129 -0.338 -0.875 -8.547 1.00 0.00 C ATOM 1790 CD1 LEU A 129 0.800 -1.277 -7.600 1.00 0.00 C ATOM 1791 CD2 LEU A 129 0.224 -0.900 -9.977 1.00 0.00 C ATOM 0 H LEU A 129 -3.820 -2.997 -8.982 1.00 0.00 H new ATOM 0 HA LEU A 129 -2.995 -0.275 -8.049 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.582 -2.103 -7.278 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.426 -2.705 -8.916 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.705 0.133 -8.353 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.656 -0.622 -7.762 1.00 0.00 H new ATOM 0 HD12 LEU A 129 0.463 -1.186 -6.567 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.090 -2.309 -7.797 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.076 -0.224 -10.045 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.544 -1.912 -10.225 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.548 -0.582 -10.677 1.00 0.00 H new ATOM 1803 N ASP A 130 -3.162 0.546 -10.417 1.00 0.00 N ATOM 1804 CA ASP A 130 -3.249 1.132 -11.753 1.00 0.00 C ATOM 1805 C ASP A 130 -1.987 1.937 -12.070 1.00 0.00 C ATOM 1806 O ASP A 130 -1.785 3.004 -11.482 1.00 0.00 O ATOM 1807 CB ASP A 130 -4.533 1.963 -11.826 1.00 0.00 C ATOM 1808 CG ASP A 130 -4.882 2.468 -13.222 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -4.722 1.716 -14.214 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -5.504 3.546 -13.317 1.00 0.00 O ATOM 0 H ASP A 130 -3.257 1.242 -9.678 1.00 0.00 H new ATOM 0 HA ASP A 130 -3.302 0.357 -12.518 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -5.362 1.361 -11.454 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -4.435 2.819 -11.158 1.00 0.00 H new ATOM 1815 N GLY A 131 -1.116 1.436 -12.946 1.00 0.00 N ATOM 1816 CA GLY A 131 0.125 2.113 -13.316 1.00 0.00 C ATOM 1817 C GLY A 131 0.783 1.420 -14.503 1.00 0.00 C ATOM 1818 O GLY A 131 0.398 0.302 -14.855 1.00 0.00 O ATOM 0 H GLY A 131 -1.253 0.544 -13.421 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -0.083 3.154 -13.565 1.00 0.00 H new ATOM 0 HA3 GLY A 131 0.809 2.119 -12.467 1.00 0.00 H new ATOM 1822 N ASP A 132 1.755 2.082 -15.125 1.00 0.00 N ATOM 1823 CA ASP A 132 2.520 1.659 -16.274 1.00 0.00 C ATOM 1824 C ASP A 132 3.608 0.679 -15.859 1.00 0.00 C ATOM 1825 O ASP A 132 3.809 -0.327 -16.539 1.00 0.00 O ATOM 1826 CB ASP A 132 3.120 2.889 -16.979 1.00 0.00 C ATOM 1827 CG ASP A 132 3.018 4.235 -16.258 1.00 0.00 C ATOM 1828 OD1 ASP A 132 3.494 4.328 -15.108 1.00 0.00 O ATOM 1829 OD2 ASP A 132 2.331 5.136 -16.795 1.00 0.00 O ATOM 0 H ASP A 132 2.045 3.006 -14.803 1.00 0.00 H new ATOM 0 HA ASP A 132 1.861 1.145 -16.974 1.00 0.00 H new ATOM 0 HB2 ASP A 132 4.174 2.688 -17.168 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.636 2.990 -17.950 1.00 0.00 H new ATOM 1834 N HIS A 133 4.291 0.930 -14.737 1.00 0.00 N ATOM 1835 CA HIS A 133 5.348 0.064 -14.203 1.00 0.00 C ATOM 1836 C HIS A 133 4.705 -1.135 -13.468 1.00 0.00 C ATOM 1837 O HIS A 133 5.002 -1.465 -12.318 1.00 0.00 O ATOM 1838 CB HIS A 133 6.305 0.895 -13.338 1.00 0.00 C ATOM 1839 CG HIS A 133 7.406 1.546 -14.130 1.00 0.00 C ATOM 1840 ND1 HIS A 133 8.687 1.055 -14.270 1.00 0.00 N ATOM 1841 CD2 HIS A 133 7.321 2.715 -14.838 1.00 0.00 C ATOM 1842 CE1 HIS A 133 9.357 1.906 -15.059 1.00 0.00 C ATOM 1843 NE2 HIS A 133 8.571 2.929 -15.437 1.00 0.00 N ATOM 0 H HIS A 133 4.121 1.756 -14.164 1.00 0.00 H new ATOM 0 HA HIS A 133 5.956 -0.359 -15.003 1.00 0.00 H new ATOM 0 HB2 HIS A 133 5.737 1.665 -12.817 1.00 0.00 H new ATOM 0 HB3 HIS A 133 6.746 0.253 -12.575 1.00 0.00 H new ATOM 0 HD1 HIS A 133 9.056 0.202 -13.850 1.00 0.00 H new ATOM 0 HD2 HIS A 133 6.453 3.353 -14.920 1.00 0.00 H new ATOM 0 HE1 HIS A 133 10.390 1.786 -15.352 1.00 0.00 H new ATOM 1851 N THR A 134 3.792 -1.799 -14.161 1.00 0.00 N ATOM 1852 CA THR A 134 2.995 -2.936 -13.753 1.00 0.00 C ATOM 1853 C THR A 134 3.838 -4.099 -13.200 1.00 0.00 C ATOM 1854 O THR A 134 4.530 -4.808 -13.937 1.00 0.00 O ATOM 1855 CB THR A 134 2.081 -3.259 -14.948 1.00 0.00 C ATOM 1856 OG1 THR A 134 0.953 -4.039 -14.610 1.00 0.00 O ATOM 1857 CG2 THR A 134 2.788 -3.902 -16.147 1.00 0.00 C ATOM 0 H THR A 134 3.573 -1.523 -15.118 1.00 0.00 H new ATOM 0 HA THR A 134 2.371 -2.713 -12.888 1.00 0.00 H new ATOM 0 HB THR A 134 1.747 -2.267 -15.253 1.00 0.00 H new ATOM 0 HG1 THR A 134 0.251 -3.907 -15.281 1.00 0.00 H new ATOM 0 HG21 THR A 134 2.063 -4.092 -16.938 1.00 0.00 H new ATOM 0 HG22 THR A 134 3.561 -3.229 -16.518 1.00 0.00 H new ATOM 0 HG23 THR A 134 3.244 -4.843 -15.839 1.00 0.00 H new ATOM 1865 N GLY A 135 3.794 -4.309 -11.881 1.00 0.00 N ATOM 1866 CA GLY A 135 4.531 -5.373 -11.204 1.00 0.00 C ATOM 1867 C GLY A 135 6.049 -5.236 -11.346 1.00 0.00 C ATOM 1868 O GLY A 135 6.762 -6.247 -11.295 1.00 0.00 O ATOM 0 H GLY A 135 3.237 -3.735 -11.248 1.00 0.00 H new ATOM 0 HA2 GLY A 135 4.269 -5.372 -10.146 1.00 0.00 H new ATOM 0 HA3 GLY A 135 4.220 -6.336 -11.608 1.00 0.00 H new ATOM 1872 N ASP A 136 6.548 -4.028 -11.608 1.00 0.00 N ATOM 1873 CA ASP A 136 7.969 -3.763 -11.752 1.00 0.00 C ATOM 1874 C ASP A 136 8.495 -3.352 -10.382 1.00 0.00 C ATOM 1875 O ASP A 136 8.242 -2.245 -9.909 1.00 0.00 O ATOM 1876 CB ASP A 136 8.206 -2.688 -12.815 1.00 0.00 C ATOM 1877 CG ASP A 136 9.687 -2.354 -12.939 1.00 0.00 C ATOM 1878 OD1 ASP A 136 10.531 -3.277 -12.882 1.00 0.00 O ATOM 1879 OD2 ASP A 136 10.018 -1.157 -13.104 1.00 0.00 O ATOM 0 H ASP A 136 5.965 -3.200 -11.727 1.00 0.00 H new ATOM 0 HA ASP A 136 8.505 -4.649 -12.092 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.827 -3.034 -13.777 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.648 -1.788 -12.557 1.00 0.00 H new ATOM 1884 N LEU A 137 9.218 -4.257 -9.723 1.00 0.00 N ATOM 1885 CA LEU A 137 9.810 -4.065 -8.413 1.00 0.00 C ATOM 1886 C LEU A 137 11.334 -4.024 -8.516 1.00 0.00 C ATOM 1887 O LEU A 137 11.912 -4.627 -9.426 1.00 0.00 O ATOM 1888 CB LEU A 137 9.318 -5.188 -7.484 1.00 0.00 C ATOM 1889 CG LEU A 137 10.136 -6.502 -7.463 1.00 0.00 C ATOM 1890 CD1 LEU A 137 9.735 -7.341 -6.252 1.00 0.00 C ATOM 1891 CD2 LEU A 137 9.922 -7.347 -8.724 1.00 0.00 C ATOM 0 H LEU A 137 9.411 -5.181 -10.110 1.00 0.00 H new ATOM 0 HA LEU A 137 9.501 -3.108 -7.993 1.00 0.00 H new ATOM 0 HB2 LEU A 137 9.285 -4.795 -6.468 1.00 0.00 H new ATOM 0 HB3 LEU A 137 8.294 -5.433 -7.764 1.00 0.00 H new ATOM 0 HG LEU A 137 11.187 -6.218 -7.414 1.00 0.00 H new ATOM 0 HD11 LEU A 137 10.313 -8.265 -6.242 1.00 0.00 H new ATOM 0 HD12 LEU A 137 9.932 -6.779 -5.339 1.00 0.00 H new ATOM 0 HD13 LEU A 137 8.673 -7.579 -6.310 1.00 0.00 H new ATOM 0 HD21 LEU A 137 10.518 -8.257 -8.658 1.00 0.00 H new ATOM 0 HD22 LEU A 137 8.868 -7.610 -8.811 1.00 0.00 H new ATOM 0 HD23 LEU A 137 10.227 -6.776 -9.601 1.00 0.00 H new ATOM 1903 N SER A 138 11.979 -3.356 -7.561 1.00 0.00 N ATOM 1904 CA SER A 138 13.397 -3.190 -7.410 1.00 0.00 C ATOM 1905 C SER A 138 13.587 -2.963 -5.906 1.00 0.00 C ATOM 1906 O SER A 138 12.626 -2.850 -5.137 1.00 0.00 O ATOM 1907 CB SER A 138 13.898 -2.013 -8.254 1.00 0.00 C ATOM 1908 OG SER A 138 13.656 -2.227 -9.628 1.00 0.00 O ATOM 0 H SER A 138 11.466 -2.882 -6.817 1.00 0.00 H new ATOM 0 HA SER A 138 13.972 -4.048 -7.759 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.403 -1.096 -7.934 1.00 0.00 H new ATOM 0 HB3 SER A 138 14.966 -1.873 -8.088 1.00 0.00 H new ATOM 0 HG SER A 138 13.984 -1.460 -10.141 1.00 0.00 H new ATOM 1914 N ALA A 139 14.842 -2.880 -5.498 1.00 0.00 N ATOM 1915 CA ALA A 139 15.267 -2.705 -4.110 1.00 0.00 C ATOM 1916 C ALA A 139 14.710 -1.460 -3.413 1.00 0.00 C ATOM 1917 O ALA A 139 14.756 -1.409 -2.181 1.00 0.00 O ATOM 1918 CB ALA A 139 16.791 -2.746 -4.010 1.00 0.00 C ATOM 0 H ALA A 139 15.627 -2.934 -6.146 1.00 0.00 H new ATOM 0 HA ALA A 139 14.834 -3.546 -3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 139 17.091 -2.614 -2.970 1.00 0.00 H new ATOM 0 HB2 ALA A 139 17.154 -3.708 -4.373 1.00 0.00 H new ATOM 0 HB3 ALA A 139 17.217 -1.945 -4.615 1.00 0.00 H new ATOM 1924 N ALA A 140 14.226 -0.455 -4.149 1.00 0.00 N ATOM 1925 CA ALA A 140 13.645 0.754 -3.588 1.00 0.00 C ATOM 1926 C ALA A 140 12.124 0.643 -3.552 1.00 0.00 C ATOM 1927 O ALA A 140 11.486 1.022 -2.575 1.00 0.00 O ATOM 1928 CB ALA A 140 14.036 1.971 -4.428 1.00 0.00 C ATOM 0 H ALA A 140 14.230 -0.466 -5.169 1.00 0.00 H new ATOM 0 HA ALA A 140 14.025 0.875 -2.574 1.00 0.00 H new ATOM 0 HB1 ALA A 140 13.594 2.869 -3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 140 15.121 2.071 -4.440 1.00 0.00 H new ATOM 0 HB3 ALA A 140 13.672 1.842 -5.447 1.00 0.00 H new ATOM 1934 N ASN A 141 11.548 0.076 -4.617 1.00 0.00 N ATOM 1935 CA ASN A 141 10.117 -0.120 -4.829 1.00 0.00 C ATOM 1936 C ASN A 141 9.470 -0.946 -3.721 1.00 0.00 C ATOM 1937 O ASN A 141 8.245 -0.952 -3.602 1.00 0.00 O ATOM 1938 CB ASN A 141 9.868 -0.835 -6.174 1.00 0.00 C ATOM 1939 CG ASN A 141 10.533 -0.222 -7.409 1.00 0.00 C ATOM 1940 OD1 ASN A 141 11.500 0.531 -7.322 1.00 0.00 O ATOM 1941 ND2 ASN A 141 10.128 -0.627 -8.592 1.00 0.00 N ATOM 0 H ASN A 141 12.103 -0.277 -5.396 1.00 0.00 H new ATOM 0 HA ASN A 141 9.667 0.873 -4.829 1.00 0.00 H new ATOM 0 HB2 ASN A 141 10.209 -1.866 -6.080 1.00 0.00 H new ATOM 0 HB3 ASN A 141 8.792 -0.869 -6.348 1.00 0.00 H new ATOM 0 HD21 ASN A 141 10.616 -0.316 -9.432 1.00 0.00 H new ATOM 0 HD22 ASN A 141 9.326 -1.252 -8.670 1.00 0.00 H new ATOM 1948 N VAL A 142 10.273 -1.667 -2.942 1.00 0.00 N ATOM 1949 CA VAL A 142 9.858 -2.525 -1.854 1.00 0.00 C ATOM 1950 C VAL A 142 10.658 -2.199 -0.598 1.00 0.00 C ATOM 1951 O VAL A 142 11.858 -1.916 -0.627 1.00 0.00 O ATOM 1952 CB VAL A 142 10.077 -3.983 -2.295 1.00 0.00 C ATOM 1953 CG1 VAL A 142 10.071 -5.004 -1.152 1.00 0.00 C ATOM 1954 CG2 VAL A 142 9.040 -4.385 -3.354 1.00 0.00 C ATOM 0 H VAL A 142 11.285 -1.662 -3.067 1.00 0.00 H new ATOM 0 HA VAL A 142 8.805 -2.370 -1.617 1.00 0.00 H new ATOM 0 HB VAL A 142 11.083 -4.007 -2.715 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.232 -6.003 -1.556 1.00 0.00 H new ATOM 0 HG12 VAL A 142 10.867 -4.765 -0.447 1.00 0.00 H new ATOM 0 HG13 VAL A 142 9.110 -4.971 -0.639 1.00 0.00 H new ATOM 0 HG21 VAL A 142 9.209 -5.419 -3.655 1.00 0.00 H new ATOM 0 HG22 VAL A 142 8.038 -4.288 -2.937 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.136 -3.734 -4.223 1.00 0.00 H new ATOM 1964 N VAL A 143 9.981 -2.319 0.535 1.00 0.00 N ATOM 1965 CA VAL A 143 10.512 -2.096 1.873 1.00 0.00 C ATOM 1966 C VAL A 143 10.538 -3.476 2.518 1.00 0.00 C ATOM 1967 O VAL A 143 9.491 -4.070 2.767 1.00 0.00 O ATOM 1968 CB VAL A 143 9.696 -1.066 2.662 1.00 0.00 C ATOM 1969 CG1 VAL A 143 10.348 -0.808 4.022 1.00 0.00 C ATOM 1970 CG2 VAL A 143 9.563 0.268 1.909 1.00 0.00 C ATOM 0 H VAL A 143 8.997 -2.588 0.547 1.00 0.00 H new ATOM 0 HA VAL A 143 11.510 -1.657 1.851 1.00 0.00 H new ATOM 0 HB VAL A 143 8.698 -1.483 2.794 1.00 0.00 H new ATOM 0 HG11 VAL A 143 9.760 -0.075 4.574 1.00 0.00 H new ATOM 0 HG12 VAL A 143 10.391 -1.739 4.587 1.00 0.00 H new ATOM 0 HG13 VAL A 143 11.358 -0.426 3.875 1.00 0.00 H new ATOM 0 HG21 VAL A 143 8.977 0.966 2.507 1.00 0.00 H new ATOM 0 HG22 VAL A 143 10.554 0.686 1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.064 0.099 0.955 1.00 0.00 H new ATOM 1980 N PHE A 144 11.737 -4.011 2.742 1.00 0.00 N ATOM 1981 CA PHE A 144 11.929 -5.333 3.331 1.00 0.00 C ATOM 1982 C PHE A 144 11.308 -5.445 4.723 1.00 0.00 C ATOM 1983 O PHE A 144 10.557 -6.386 4.980 1.00 0.00 O ATOM 1984 CB PHE A 144 13.425 -5.692 3.363 1.00 0.00 C ATOM 1985 CG PHE A 144 13.728 -7.038 2.742 1.00 0.00 C ATOM 1986 CD1 PHE A 144 13.544 -8.226 3.477 1.00 0.00 C ATOM 1987 CD2 PHE A 144 14.174 -7.102 1.410 1.00 0.00 C ATOM 1988 CE1 PHE A 144 13.830 -9.471 2.886 1.00 0.00 C ATOM 1989 CE2 PHE A 144 14.443 -8.346 0.820 1.00 0.00 C ATOM 1990 CZ PHE A 144 14.288 -9.531 1.558 1.00 0.00 C ATOM 0 H PHE A 144 12.610 -3.534 2.517 1.00 0.00 H new ATOM 0 HA PHE A 144 11.408 -6.051 2.698 1.00 0.00 H new ATOM 0 HB2 PHE A 144 13.988 -4.921 2.837 1.00 0.00 H new ATOM 0 HB3 PHE A 144 13.771 -5.690 4.397 1.00 0.00 H new ATOM 0 HD1 PHE A 144 13.183 -8.181 4.494 1.00 0.00 H new ATOM 0 HD2 PHE A 144 14.309 -6.194 0.841 1.00 0.00 H new ATOM 0 HE1 PHE A 144 13.698 -10.381 3.453 1.00 0.00 H new ATOM 0 HE2 PHE A 144 14.771 -8.393 -0.208 1.00 0.00 H new ATOM 0 HZ PHE A 144 14.520 -10.485 1.107 1.00 0.00 H new