USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 881 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 114 THR OG1 : rot 177:sc= 0.9 USER MOD Set 1.2: A 135 ASN : amide:sc= 0.335 X(o=1.2,f=1.1) USER MOD Set 2.1: A 81 SER OG : rot -23:sc= 0.62 USER MOD Set 2.2: A 82 GLN : amide:sc= 0 X(o=0.62,f=0.56) USER MOD Set 3.1: A 70 THR OG1 : rot 180:sc= 0.7 USER MOD Set 3.2: A 72 SER OG : rot -68:sc= 1.29 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 THR OG1 : rot -74:sc= 0.724 USER MOD Single : A 7 ASN : amide:sc= 0.489 K(o=0.49,f=-3.1!) USER MOD Single : A 13 SER OG : rot -66:sc= 0.736 USER MOD Single : A 18 GLN : amide:sc= -0.0107 X(o=-0.011,f=-0.0015) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 105:sc= 1.11 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0.00108 USER MOD Single : A 64 HIS : no HE2:sc= -0.202 X(o=-0.2,f=-0.12) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 170:sc= 0.695 (180deg=0.645) USER MOD Single : A 88 SER OG : rot 180:sc= 0.117 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -86:sc= 0.928 USER MOD Single : A 106 SER OG : rot 180:sc=-0.00176 USER MOD Single : A 115 TYR OH : rot 180:sc= -0.168 USER MOD Single : A 117 LYS NZ :NH3+ 169:sc= 1.09 (180deg=1) USER MOD Single : A 118 SER OG : rot 39:sc= 1.25 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS : no HE2:sc= 0.437 K(o=0.44,f=-1.4!) USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 141 SER OG : rot 180:sc= 0.0936 USER MOD Single : A 144 ASN : amide:sc= -0.0488 K(o=-0.049,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -11.782 14.935 3.728 1.00 25.00 N ATOM 14 CA GLN A 2 -10.757 15.713 2.986 1.00 25.00 C ATOM 15 C GLN A 2 -9.471 16.102 3.744 1.00 25.00 C ATOM 16 O GLN A 2 -9.405 17.117 4.427 1.00 25.00 O ATOM 17 CB GLN A 2 -11.383 16.955 2.301 1.00 25.00 C ATOM 18 CG GLN A 2 -12.138 17.950 3.207 1.00 25.00 C ATOM 19 CD GLN A 2 -12.624 19.154 2.437 1.00 25.00 C ATOM 20 OE1 GLN A 2 -13.512 19.052 1.611 1.00 25.00 O ATOM 21 NE2 GLN A 2 -12.044 20.294 2.700 1.00 25.00 N ATOM 0 HA GLN A 2 -10.405 14.997 2.243 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.587 17.498 1.792 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -12.073 16.606 1.533 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -12.988 17.447 3.669 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -11.482 18.276 4.014 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -11.303 20.340 3.399 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -12.332 21.139 2.206 1.00 25.00 H new ATOM 30 N GLY A 3 -8.429 15.303 3.576 1.00 25.00 N ATOM 31 CA GLY A 3 -7.156 15.629 4.194 1.00 25.00 C ATOM 32 C GLY A 3 -6.486 16.805 3.515 1.00 25.00 C ATOM 33 O GLY A 3 -6.609 16.996 2.309 1.00 25.00 O ATOM 0 H GLY A 3 -8.438 14.442 3.029 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.312 15.858 5.248 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.498 14.761 4.151 1.00 25.00 H new ATOM 37 N THR A 4 -5.760 17.589 4.302 1.00 25.00 N ATOM 38 CA THR A 4 -4.997 18.728 3.800 1.00 25.00 C ATOM 39 C THR A 4 -3.627 18.217 3.363 1.00 25.00 C ATOM 40 O THR A 4 -3.350 17.022 3.461 1.00 25.00 O ATOM 41 CB THR A 4 -4.795 19.781 4.918 1.00 25.00 C ATOM 42 OG1 THR A 4 -4.041 19.198 5.987 1.00 25.00 O ATOM 43 CG2 THR A 4 -6.126 20.265 5.478 1.00 25.00 C ATOM 0 H THR A 4 -5.683 17.454 5.310 1.00 25.00 H new ATOM 0 HA THR A 4 -5.534 19.190 2.972 1.00 25.00 H new ATOM 0 HB THR A 4 -4.267 20.630 4.485 1.00 25.00 H new ATOM 0 HG1 THR A 4 -4.610 18.576 6.487 1.00 25.00 H new ATOM 0 HG21 THR A 4 -5.945 21.003 6.260 1.00 25.00 H new ATOM 0 HG22 THR A 4 -6.713 20.719 4.680 1.00 25.00 H new ATOM 0 HG23 THR A 4 -6.674 19.420 5.896 1.00 25.00 H new ATOM 51 N ASP A 5 -2.726 19.097 2.965 1.00 25.00 N ATOM 52 CA ASP A 5 -1.352 18.677 2.663 1.00 25.00 C ATOM 53 C ASP A 5 -0.478 18.686 3.914 1.00 25.00 C ATOM 54 O ASP A 5 0.707 18.370 3.875 1.00 25.00 O ATOM 55 CB ASP A 5 -0.758 19.550 1.554 1.00 25.00 C ATOM 56 CG ASP A 5 -1.282 19.157 0.183 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.460 17.935 -0.057 1.00 25.00 O ATOM 58 OD2 ASP A 5 -1.538 20.048 -0.637 1.00 25.00 O ATOM 0 H ASP A 5 -2.907 20.093 2.842 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.382 17.648 2.304 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -0.997 20.596 1.748 1.00 25.00 H new ATOM 0 HB3 ASP A 5 0.328 19.463 1.566 1.00 25.00 H new ATOM 63 N GLY A 6 -1.116 18.958 5.040 1.00 25.00 N ATOM 64 CA GLY A 6 -0.467 18.845 6.342 1.00 25.00 C ATOM 65 C GLY A 6 -0.656 17.428 6.850 1.00 25.00 C ATOM 66 O GLY A 6 -0.964 16.533 6.064 1.00 25.00 O ATOM 0 H GLY A 6 -2.089 19.261 5.082 1.00 25.00 H new ATOM 0 HA2 GLY A 6 0.594 19.079 6.258 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -0.897 19.560 7.043 1.00 25.00 H new ATOM 70 N ASN A 7 -0.505 17.202 8.146 1.00 25.00 N ATOM 71 CA ASN A 7 -0.731 15.869 8.713 1.00 25.00 C ATOM 72 C ASN A 7 -2.183 15.798 9.185 1.00 25.00 C ATOM 73 O ASN A 7 -2.636 16.684 9.905 1.00 25.00 O ATOM 74 CB ASN A 7 0.205 15.626 9.898 1.00 25.00 C ATOM 75 CG ASN A 7 1.663 15.549 9.492 1.00 25.00 C ATOM 76 OD1 ASN A 7 2.006 15.429 8.322 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.533 15.645 10.462 1.00 25.00 N ATOM 0 H ASN A 7 -0.230 17.912 8.824 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.532 15.107 7.959 1.00 25.00 H new ATOM 0 HB2 ASN A 7 0.078 16.428 10.625 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.078 14.698 10.394 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.532 15.621 10.256 1.00 25.00 H new ATOM 0 HD22 ASN A 7 2.214 15.744 11.426 1.00 25.00 H new ATOM 84 N ASP A 8 -2.915 14.774 8.765 1.00 25.00 N ATOM 85 CA ASP A 8 -4.340 14.648 9.086 1.00 25.00 C ATOM 86 C ASP A 8 -4.667 13.293 9.698 1.00 25.00 C ATOM 87 O ASP A 8 -4.014 12.287 9.410 1.00 25.00 O ATOM 88 CB ASP A 8 -5.193 14.774 7.817 1.00 25.00 C ATOM 89 CG ASP A 8 -4.933 16.045 7.055 1.00 25.00 C ATOM 90 OD1 ASP A 8 -4.094 15.988 6.144 1.00 50.00 O ATOM 91 OD2 ASP A 8 -5.637 17.049 7.241 1.00 50.00 O ATOM 0 H ASP A 8 -2.546 14.011 8.197 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.562 15.444 9.796 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.996 13.921 7.168 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.248 14.730 8.089 1.00 25.00 H new ATOM 96 N VAL A 9 -5.747 13.253 10.456 1.00 25.00 N ATOM 97 CA VAL A 9 -6.305 11.999 10.959 1.00 25.00 C ATOM 98 C VAL A 9 -7.719 11.943 10.406 1.00 25.00 C ATOM 99 O VAL A 9 -8.530 12.835 10.664 1.00 25.00 O ATOM 100 CB VAL A 9 -6.322 11.939 12.515 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.942 10.616 13.003 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.890 12.079 13.067 1.00 25.00 C ATOM 0 H VAL A 9 -6.265 14.083 10.743 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.698 11.151 10.643 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.931 12.765 12.882 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.944 10.595 14.093 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.966 10.537 12.637 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -6.356 9.778 12.625 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.914 12.036 14.156 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -4.272 11.267 12.685 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.470 13.034 12.751 1.00 25.00 H new ATOM 112 N LEU A 10 -7.993 10.941 9.584 1.00 25.00 N ATOM 113 CA LEU A 10 -9.276 10.804 8.910 1.00 25.00 C ATOM 114 C LEU A 10 -9.880 9.466 9.300 1.00 25.00 C ATOM 115 O LEU A 10 -9.202 8.444 9.272 1.00 25.00 O ATOM 116 CB LEU A 10 -9.077 10.870 7.393 1.00 25.00 C ATOM 117 CG LEU A 10 -8.487 12.194 6.867 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.088 12.023 5.413 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.484 13.350 7.000 1.00 25.00 C ATOM 0 H LEU A 10 -7.330 10.198 9.365 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.944 11.613 9.205 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.421 10.053 7.093 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.039 10.701 6.908 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.612 12.440 7.469 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -7.670 12.957 5.038 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -7.341 11.233 5.331 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -8.965 11.755 4.824 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -9.032 14.266 6.619 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.383 13.123 6.427 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.747 13.485 8.049 1.00 25.00 H new ATOM 131 N ILE A 11 -11.146 9.483 9.686 1.00 25.00 N ATOM 132 CA ILE A 11 -11.844 8.275 10.117 1.00 25.00 C ATOM 133 C ILE A 11 -13.182 8.243 9.385 1.00 25.00 C ATOM 134 O ILE A 11 -13.910 9.243 9.379 1.00 25.00 O ATOM 135 CB ILE A 11 -12.086 8.274 11.670 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.740 8.409 12.425 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.824 6.974 12.111 1.00 25.00 C ATOM 138 CD1 ILE A 11 -10.885 8.654 13.935 1.00 25.00 C ATOM 0 H ILE A 11 -11.718 10.327 9.711 1.00 25.00 H new ATOM 0 HA ILE A 11 -11.241 7.397 9.885 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.715 9.129 11.919 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -10.157 7.501 12.270 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -10.172 9.231 11.988 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -12.982 6.993 13.189 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.787 6.913 11.604 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -12.220 6.106 11.848 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -9.896 8.736 14.387 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -11.439 9.578 14.102 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -11.423 7.822 14.389 1.00 25.00 H new ATOM 150 N GLY A 12 -13.479 7.123 8.741 1.00 25.00 N ATOM 151 CA GLY A 12 -14.714 6.977 7.995 1.00 25.00 C ATOM 152 C GLY A 12 -15.840 6.370 8.810 1.00 25.00 C ATOM 153 O GLY A 12 -15.629 5.758 9.853 1.00 25.00 O ATOM 0 H GLY A 12 -12.876 6.300 8.722 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -15.027 7.955 7.628 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.530 6.353 7.121 1.00 25.00 H new ATOM 157 N SER A 13 -17.050 6.541 8.300 1.00 25.00 N ATOM 158 CA SER A 13 -18.270 6.025 8.912 1.00 25.00 C ATOM 159 C SER A 13 -18.609 4.666 8.300 1.00 25.00 C ATOM 160 O SER A 13 -17.869 4.156 7.452 1.00 25.00 O ATOM 161 CB SER A 13 -19.415 7.010 8.670 1.00 25.00 C ATOM 162 OG SER A 13 -19.721 7.109 7.290 1.00 25.00 O ATOM 0 H SER A 13 -17.217 7.052 7.433 1.00 25.00 H new ATOM 0 HA SER A 13 -18.123 5.906 9.985 1.00 25.00 H new ATOM 0 HB2 SER A 13 -20.299 6.686 9.219 1.00 25.00 H new ATOM 0 HB3 SER A 13 -19.142 7.992 9.056 1.00 25.00 H new ATOM 0 HG SER A 13 -18.966 7.516 6.816 1.00 25.00 H new ATOM 168 N ASP A 14 -19.719 4.074 8.707 1.00 25.00 N ATOM 169 CA ASP A 14 -20.107 2.739 8.236 1.00 25.00 C ATOM 170 C ASP A 14 -20.609 2.659 6.790 1.00 25.00 C ATOM 171 O ASP A 14 -20.657 1.576 6.213 1.00 25.00 O ATOM 172 CB ASP A 14 -21.185 2.167 9.151 1.00 25.00 C ATOM 173 CG ASP A 14 -20.663 1.877 10.535 1.00 25.00 C ATOM 174 OD1 ASP A 14 -19.517 1.384 10.654 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.376 2.178 11.508 1.00 25.00 O ATOM 0 H ASP A 14 -20.376 4.493 9.366 1.00 25.00 H new ATOM 0 HA ASP A 14 -19.184 2.161 8.263 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -22.014 2.872 9.218 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.581 1.250 8.714 1.00 25.00 H new ATOM 180 N VAL A 15 -20.949 3.785 6.183 1.00 25.00 N ATOM 181 CA VAL A 15 -21.385 3.774 4.782 1.00 25.00 C ATOM 182 C VAL A 15 -20.157 3.784 3.874 1.00 25.00 C ATOM 183 O VAL A 15 -19.034 4.026 4.335 1.00 25.00 O ATOM 184 CB VAL A 15 -22.317 4.982 4.442 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.600 4.901 5.281 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.621 6.323 4.680 1.00 25.00 C ATOM 0 H VAL A 15 -20.935 4.706 6.622 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.967 2.867 4.617 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.565 4.923 3.382 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.246 5.745 5.040 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -24.122 3.970 5.059 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.345 4.930 6.340 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.303 7.136 4.432 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.330 6.401 5.727 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.733 6.389 4.051 1.00 25.00 H new ATOM 196 N GLY A 16 -20.356 3.501 2.591 1.00 25.00 N ATOM 197 CA GLY A 16 -19.247 3.524 1.648 1.00 25.00 C ATOM 198 C GLY A 16 -18.771 4.944 1.399 1.00 25.00 C ATOM 199 O GLY A 16 -19.593 5.859 1.316 1.00 25.00 O ATOM 0 H GLY A 16 -21.260 3.257 2.186 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.424 2.924 2.035 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.557 3.071 0.706 1.00 25.00 H new ATOM 203 N GLU A 17 -17.458 5.151 1.345 1.00 25.00 N ATOM 204 CA GLU A 17 -16.884 6.498 1.244 1.00 25.00 C ATOM 205 C GLU A 17 -15.619 6.528 0.381 1.00 25.00 C ATOM 206 O GLU A 17 -14.989 5.501 0.131 1.00 25.00 O ATOM 207 CB GLU A 17 -16.473 6.987 2.637 1.00 25.00 C ATOM 208 CG GLU A 17 -17.602 7.192 3.625 1.00 25.00 C ATOM 209 CD GLU A 17 -17.133 7.074 5.039 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.446 6.085 5.353 1.00 75.00 O ATOM 211 OE2 GLU A 17 -17.522 7.901 5.878 1.00 75.00 O ATOM 0 H GLU A 17 -16.766 4.402 1.369 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.650 7.129 0.793 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.771 6.269 3.061 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.937 7.930 2.527 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -18.046 8.176 3.470 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.385 6.457 3.440 1.00 25.00 H new ATOM 218 N GLN A 18 -15.215 7.731 -0.006 1.00 25.00 N ATOM 219 CA GLN A 18 -13.963 7.955 -0.718 1.00 25.00 C ATOM 220 C GLN A 18 -13.128 8.891 0.161 1.00 25.00 C ATOM 221 O GLN A 18 -13.542 10.017 0.442 1.00 25.00 O ATOM 222 CB GLN A 18 -14.263 8.572 -2.080 1.00 25.00 C ATOM 223 CG GLN A 18 -13.047 8.789 -2.951 1.00 25.00 C ATOM 224 CD GLN A 18 -13.421 9.452 -4.249 1.00 25.00 C ATOM 225 OE1 GLN A 18 -14.171 8.913 -5.045 1.00 25.00 O ATOM 226 NE2 GLN A 18 -12.931 10.643 -4.448 1.00 25.00 N ATOM 0 H GLN A 18 -15.749 8.583 0.166 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.415 7.030 -0.900 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -14.964 7.927 -2.610 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -14.762 9.529 -1.929 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.321 9.405 -2.420 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.566 7.832 -3.153 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.306 11.059 -3.757 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -13.172 11.159 -5.294 1.00 25.00 H new ATOM 235 N ILE A 19 -11.991 8.408 0.645 1.00 25.00 N ATOM 236 CA ILE A 19 -11.162 9.156 1.599 1.00 25.00 C ATOM 237 C ILE A 19 -9.788 9.426 0.982 1.00 25.00 C ATOM 238 O ILE A 19 -9.090 8.508 0.583 1.00 25.00 O ATOM 239 CB ILE A 19 -10.976 8.336 2.929 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.339 7.887 3.525 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.181 9.156 3.985 1.00 25.00 C ATOM 242 CD1 ILE A 19 -13.299 9.020 3.970 1.00 25.00 C ATOM 0 H ILE A 19 -11.614 7.494 0.394 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.660 10.098 1.828 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.406 7.443 2.673 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -12.852 7.275 2.783 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -12.142 7.247 4.385 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.067 8.565 4.894 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.197 9.404 3.588 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -10.721 10.074 4.214 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -14.216 8.585 4.368 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.818 9.622 4.741 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -13.539 9.651 3.114 1.00 25.00 H new ATOM 254 N SER A 20 -9.393 10.686 0.929 1.00 25.00 N ATOM 255 CA SER A 20 -8.085 11.060 0.393 1.00 25.00 C ATOM 256 C SER A 20 -7.305 11.863 1.427 1.00 25.00 C ATOM 257 O SER A 20 -7.865 12.740 2.093 1.00 25.00 O ATOM 258 CB SER A 20 -8.266 11.869 -0.885 1.00 25.00 C ATOM 259 OG SER A 20 -9.082 11.158 -1.807 1.00 25.00 O ATOM 0 H SER A 20 -9.957 11.473 1.250 1.00 25.00 H new ATOM 0 HA SER A 20 -7.520 10.157 0.161 1.00 25.00 H new ATOM 0 HB2 SER A 20 -8.722 12.832 -0.653 1.00 25.00 H new ATOM 0 HB3 SER A 20 -7.294 12.076 -1.333 1.00 25.00 H new ATOM 0 HG SER A 20 -9.192 11.689 -2.623 1.00 25.00 H new ATOM 265 N GLY A 21 -6.036 11.519 1.606 1.00 25.00 N ATOM 266 CA GLY A 21 -5.215 12.133 2.638 1.00 25.00 C ATOM 267 C GLY A 21 -4.333 13.296 2.212 1.00 25.00 C ATOM 268 O GLY A 21 -3.913 14.083 3.062 1.00 25.00 O ATOM 0 H GLY A 21 -5.553 10.816 1.047 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.874 12.480 3.434 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.576 11.361 3.067 1.00 25.00 H new ATOM 272 N GLY A 22 -4.018 13.402 0.930 1.00 25.00 N ATOM 273 CA GLY A 22 -3.140 14.471 0.457 1.00 25.00 C ATOM 274 C GLY A 22 -1.684 14.253 0.856 1.00 25.00 C ATOM 275 O GLY A 22 -1.303 13.148 1.279 1.00 25.00 O ATOM 0 H GLY A 22 -4.351 12.770 0.202 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.209 14.539 -0.629 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.484 15.424 0.859 1.00 25.00 H new ATOM 279 N ALA A 23 -0.854 15.287 0.752 1.00 25.00 N ATOM 280 CA ALA A 23 0.551 15.186 1.157 1.00 25.00 C ATOM 281 C ALA A 23 0.635 15.108 2.688 1.00 25.00 C ATOM 282 O ALA A 23 -0.391 15.097 3.369 1.00 25.00 O ATOM 283 CB ALA A 23 1.348 16.385 0.625 1.00 25.00 C ATOM 0 H ALA A 23 -1.125 16.202 0.393 1.00 25.00 H new ATOM 0 HA ALA A 23 0.986 14.281 0.733 1.00 25.00 H new ATOM 0 HB1 ALA A 23 2.389 16.296 0.934 1.00 25.00 H new ATOM 0 HB2 ALA A 23 1.293 16.404 -0.463 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.928 17.308 1.026 1.00 25.00 H new ATOM 289 N GLY A 24 1.842 15.015 3.221 1.00 25.00 N ATOM 290 CA GLY A 24 2.020 14.896 4.659 1.00 25.00 C ATOM 291 C GLY A 24 1.779 13.482 5.160 1.00 25.00 C ATOM 292 O GLY A 24 1.316 12.611 4.404 1.00 25.00 O ATOM 0 H GLY A 24 2.709 15.019 2.683 1.00 25.00 H new ATOM 0 HA2 GLY A 24 3.032 15.204 4.923 1.00 25.00 H new ATOM 0 HA3 GLY A 24 1.337 15.578 5.164 1.00 25.00 H new ATOM 296 N ASP A 25 2.099 13.245 6.416 1.00 25.00 N ATOM 297 CA ASP A 25 1.961 11.921 7.025 1.00 25.00 C ATOM 298 C ASP A 25 0.579 11.822 7.662 1.00 25.00 C ATOM 299 O ASP A 25 0.250 12.600 8.551 1.00 25.00 O ATOM 300 CB ASP A 25 3.028 11.714 8.107 1.00 25.00 C ATOM 301 CG ASP A 25 4.379 11.278 7.537 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.603 11.317 6.300 1.00 25.00 O ATOM 303 OD2 ASP A 25 5.212 10.825 8.360 1.00 25.00 O ATOM 0 H ASP A 25 2.462 13.958 7.049 1.00 25.00 H new ATOM 0 HA ASP A 25 2.087 11.157 6.258 1.00 25.00 H new ATOM 0 HB2 ASP A 25 3.157 12.642 8.665 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.679 10.963 8.815 1.00 25.00 H new ATOM 308 N ASP A 26 -0.247 10.904 7.179 1.00 25.00 N ATOM 309 CA ASP A 26 -1.653 10.839 7.593 1.00 25.00 C ATOM 310 C ASP A 26 -2.079 9.479 8.130 1.00 25.00 C ATOM 311 O ASP A 26 -1.400 8.468 7.915 1.00 25.00 O ATOM 312 CB ASP A 26 -2.535 11.143 6.379 1.00 25.00 C ATOM 313 CG ASP A 26 -2.163 12.432 5.707 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.159 13.475 6.374 1.00 50.00 O ATOM 315 OD2 ASP A 26 -1.918 12.443 4.476 1.00 50.00 O ATOM 0 H ASP A 26 0.026 10.193 6.501 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.767 11.564 8.399 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.454 10.326 5.662 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.578 11.189 6.694 1.00 25.00 H new ATOM 320 N ARG A 27 -3.273 9.434 8.709 1.00 25.00 N ATOM 321 CA ARG A 27 -3.945 8.169 9.006 1.00 25.00 C ATOM 322 C ARG A 27 -5.311 8.202 8.348 1.00 25.00 C ATOM 323 O ARG A 27 -6.035 9.184 8.489 1.00 25.00 O ATOM 324 CB ARG A 27 -4.087 7.922 10.513 1.00 25.00 C ATOM 325 CG ARG A 27 -4.846 6.622 10.803 1.00 25.00 C ATOM 326 CD ARG A 27 -4.688 6.122 12.229 1.00 25.00 C ATOM 327 NE ARG A 27 -5.563 4.958 12.434 1.00 25.00 N ATOM 328 CZ ARG A 27 -5.415 4.014 13.356 1.00 25.00 C ATOM 329 NH1 ARG A 27 -4.414 4.009 14.205 1.00 25.00 N ATOM 330 NH2 ARG A 27 -6.296 3.059 13.415 1.00 25.00 N ATOM 0 H ARG A 27 -3.800 10.262 8.985 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.342 7.349 8.615 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -3.098 7.876 10.969 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.611 8.760 10.972 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -5.905 6.778 10.598 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -4.499 5.849 10.117 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -3.650 5.849 12.418 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -4.944 6.913 12.935 1.00 25.00 H new ATOM 0 HE ARG A 27 -6.362 4.867 11.806 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -3.713 4.749 14.171 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -4.337 3.265 14.898 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -7.079 3.047 12.762 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -6.204 2.323 14.115 1.00 25.00 H new ATOM 344 N LEU A 28 -5.643 7.154 7.607 1.00 25.00 N ATOM 345 CA LEU A 28 -6.926 7.054 6.910 1.00 25.00 C ATOM 346 C LEU A 28 -7.618 5.756 7.312 1.00 25.00 C ATOM 347 O LEU A 28 -7.264 4.681 6.833 1.00 25.00 O ATOM 348 CB LEU A 28 -6.741 7.021 5.378 1.00 25.00 C ATOM 349 CG LEU A 28 -6.275 8.267 4.607 1.00 25.00 C ATOM 350 CD1 LEU A 28 -4.785 8.578 4.798 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.544 8.037 3.119 1.00 25.00 C ATOM 0 H LEU A 28 -5.034 6.348 7.470 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.516 7.928 7.185 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.028 6.226 5.160 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.696 6.719 4.948 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.829 9.120 4.998 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -4.523 9.469 4.227 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -4.582 8.752 5.855 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -4.190 7.735 4.448 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.221 8.910 2.552 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -5.993 7.160 2.781 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -7.611 7.877 2.963 1.00 25.00 H new ATOM 363 N ASP A 29 -8.634 5.858 8.147 1.00 25.00 N ATOM 364 CA ASP A 29 -9.425 4.688 8.531 1.00 25.00 C ATOM 365 C ASP A 29 -10.722 4.776 7.747 1.00 25.00 C ATOM 366 O ASP A 29 -11.289 5.850 7.626 1.00 25.00 O ATOM 367 CB ASP A 29 -9.711 4.668 10.039 1.00 25.00 C ATOM 368 CG ASP A 29 -8.471 4.348 10.871 1.00 25.00 C ATOM 369 OD1 ASP A 29 -7.357 4.239 10.312 1.00 25.00 O ATOM 370 OD2 ASP A 29 -8.612 4.171 12.094 1.00 25.00 O ATOM 0 H ASP A 29 -8.936 6.733 8.575 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.881 3.770 8.310 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -10.106 5.637 10.342 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.484 3.929 10.248 1.00 25.00 H new ATOM 375 N GLY A 30 -11.165 3.664 7.182 1.00 25.00 N ATOM 376 CA GLY A 30 -12.363 3.651 6.349 1.00 25.00 C ATOM 377 C GLY A 30 -13.626 3.195 7.062 1.00 25.00 C ATOM 378 O GLY A 30 -14.734 3.545 6.654 1.00 25.00 O ATOM 0 H GLY A 30 -10.713 2.755 7.284 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.526 4.654 5.955 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.188 2.997 5.494 1.00 25.00 H new ATOM 382 N GLY A 31 -13.479 2.397 8.110 1.00 25.00 N ATOM 383 CA GLY A 31 -14.637 1.868 8.819 1.00 25.00 C ATOM 384 C GLY A 31 -15.360 0.812 7.994 1.00 25.00 C ATOM 385 O GLY A 31 -14.783 0.224 7.063 1.00 25.00 O ATOM 0 H GLY A 31 -12.578 2.103 8.486 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -14.318 1.435 9.767 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.324 2.681 9.054 1.00 25.00 H new ATOM 389 N ALA A 32 -16.621 0.555 8.312 1.00 25.00 N ATOM 390 CA ALA A 32 -17.402 -0.427 7.554 1.00 25.00 C ATOM 391 C ALA A 32 -17.782 0.157 6.189 1.00 25.00 C ATOM 392 O ALA A 32 -17.461 1.318 5.876 1.00 25.00 O ATOM 393 CB ALA A 32 -18.656 -0.858 8.346 1.00 25.00 C ATOM 0 H ALA A 32 -17.124 1.003 9.078 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.794 -1.317 7.393 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -19.221 -1.587 7.765 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -18.353 -1.305 9.293 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -19.281 0.014 8.540 1.00 25.00 H new ATOM 399 N GLY A 33 -18.423 -0.668 5.371 1.00 25.00 N ATOM 400 CA GLY A 33 -18.800 -0.268 4.027 1.00 25.00 C ATOM 401 C GLY A 33 -17.615 -0.393 3.090 1.00 25.00 C ATOM 402 O GLY A 33 -16.477 -0.573 3.536 1.00 25.00 O ATOM 0 H GLY A 33 -18.692 -1.620 5.618 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.621 -0.891 3.672 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -19.160 0.761 4.034 1.00 25.00 H new ATOM 406 N ASP A 34 -17.879 -0.332 1.801 1.00 0.00 N ATOM 407 CA ASP A 34 -16.827 -0.458 0.801 1.00 25.00 C ATOM 408 C ASP A 34 -16.193 0.914 0.645 1.00 25.00 C ATOM 409 O ASP A 34 -16.905 1.910 0.550 1.00 25.00 O ATOM 410 CB ASP A 34 -17.417 -0.932 -0.528 1.00 25.00 C ATOM 411 CG ASP A 34 -18.027 -2.336 -0.433 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.740 -3.074 0.540 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.849 -2.669 -1.308 1.00 25.00 O ATOM 0 H ASP A 34 -18.814 -0.196 1.416 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.082 -1.191 1.109 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.183 -0.228 -0.853 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.637 -0.929 -1.290 1.00 25.00 H new ATOM 418 N ASP A 35 -14.871 1.005 0.718 1.00 25.00 N ATOM 419 CA ASP A 35 -14.213 2.318 0.753 1.00 25.00 C ATOM 420 C ASP A 35 -13.055 2.449 -0.234 1.00 25.00 C ATOM 421 O ASP A 35 -12.348 1.486 -0.529 1.00 25.00 O ATOM 422 CB ASP A 35 -13.682 2.611 2.167 1.00 25.00 C ATOM 423 CG ASP A 35 -14.777 2.641 3.219 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.707 3.471 3.138 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.678 1.875 4.212 1.00 50.00 O ATOM 0 H ASP A 35 -14.238 0.206 0.754 1.00 25.00 H new ATOM 0 HA ASP A 35 -14.978 3.038 0.463 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -12.947 1.853 2.437 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.164 3.570 2.163 1.00 25.00 H new ATOM 430 N LEU A 36 -12.845 3.672 -0.695 1.00 25.00 N ATOM 431 CA LEU A 36 -11.718 4.010 -1.560 1.00 25.00 C ATOM 432 C LEU A 36 -10.769 4.839 -0.712 1.00 25.00 C ATOM 433 O LEU A 36 -11.204 5.786 -0.058 1.00 25.00 O ATOM 434 CB LEU A 36 -12.179 4.851 -2.764 1.00 25.00 C ATOM 435 CG LEU A 36 -12.862 4.164 -3.963 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.216 3.533 -3.616 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.059 5.197 -5.076 1.00 25.00 C ATOM 0 H LEU A 36 -13.452 4.463 -0.481 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.249 3.106 -1.947 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -12.868 5.607 -2.387 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.305 5.378 -3.146 1.00 25.00 H new ATOM 0 HG LEU A 36 -12.210 3.351 -4.281 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -14.639 3.068 -4.506 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -14.078 2.778 -2.843 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -14.895 4.305 -3.252 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -13.542 4.723 -5.931 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -13.685 6.011 -4.710 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.090 5.593 -5.380 1.00 25.00 H new ATOM 449 N LEU A 37 -9.495 4.466 -0.673 1.00 25.00 N ATOM 450 CA LEU A 37 -8.520 5.153 0.175 1.00 25.00 C ATOM 451 C LEU A 37 -7.263 5.572 -0.608 1.00 25.00 C ATOM 452 O LEU A 37 -6.519 4.725 -1.106 1.00 25.00 O ATOM 453 CB LEU A 37 -8.109 4.252 1.347 1.00 25.00 C ATOM 454 CG LEU A 37 -9.228 3.825 2.320 1.00 25.00 C ATOM 455 CD1 LEU A 37 -9.772 2.433 1.972 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.701 3.817 3.750 1.00 25.00 C ATOM 0 H LEU A 37 -9.111 3.693 -1.217 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.002 6.056 0.549 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -7.651 3.351 0.939 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.339 4.769 1.920 1.00 25.00 H new ATOM 0 HG LEU A 37 -10.040 4.546 2.228 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.558 2.163 2.677 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.179 2.444 0.961 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -8.966 1.702 2.031 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -9.498 3.514 4.430 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -7.871 3.115 3.828 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -8.357 4.816 4.016 1.00 25.00 H new ATOM 468 N ASP A 38 -7.021 6.873 -0.675 1.00 25.00 N ATOM 469 CA ASP A 38 -5.852 7.432 -1.372 1.00 25.00 C ATOM 470 C ASP A 38 -4.932 8.125 -0.365 1.00 25.00 C ATOM 471 O ASP A 38 -5.237 9.211 0.139 1.00 25.00 O ATOM 472 CB ASP A 38 -6.280 8.444 -2.443 1.00 25.00 C ATOM 473 CG ASP A 38 -6.837 7.782 -3.695 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.916 7.154 -3.629 1.00 25.00 O ATOM 475 OD2 ASP A 38 -6.213 7.946 -4.765 1.00 25.00 O ATOM 0 H ASP A 38 -7.624 7.578 -0.251 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.323 6.612 -1.858 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -7.034 9.111 -2.025 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.424 9.061 -2.715 1.00 25.00 H new ATOM 480 N GLY A 39 -3.805 7.494 -0.053 1.00 25.00 N ATOM 481 CA GLY A 39 -2.896 8.029 0.955 1.00 25.00 C ATOM 482 C GLY A 39 -2.259 9.365 0.599 1.00 25.00 C ATOM 483 O GLY A 39 -2.085 10.244 1.469 1.00 25.00 O ATOM 0 H GLY A 39 -3.501 6.619 -0.479 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.441 8.141 1.892 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -2.104 7.301 1.132 1.00 25.00 H new ATOM 487 N GLY A 40 -1.874 9.530 -0.659 1.00 25.00 N ATOM 488 CA GLY A 40 -1.214 10.754 -1.092 1.00 25.00 C ATOM 489 C GLY A 40 0.259 10.724 -0.729 1.00 25.00 C ATOM 490 O GLY A 40 0.732 9.761 -0.119 1.00 25.00 O ATOM 0 H GLY A 40 -2.006 8.836 -1.394 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -1.326 10.872 -2.170 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.692 11.616 -0.625 1.00 25.00 H new ATOM 494 N ALA A 41 0.999 11.773 -1.066 1.00 25.00 N ATOM 495 CA ALA A 41 2.431 11.830 -0.748 1.00 25.00 C ATOM 496 C ALA A 41 2.652 11.725 0.777 1.00 25.00 C ATOM 497 O ALA A 41 1.736 11.996 1.565 1.00 25.00 O ATOM 498 CB ALA A 41 3.040 13.127 -1.305 1.00 25.00 C ATOM 0 H ALA A 41 0.640 12.593 -1.556 1.00 25.00 H new ATOM 0 HA ALA A 41 2.932 10.983 -1.217 1.00 25.00 H new ATOM 0 HB1 ALA A 41 4.103 13.162 -1.065 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.911 13.154 -2.387 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.539 13.986 -0.858 1.00 25.00 H new ATOM 504 N GLY A 42 3.848 11.308 1.174 1.00 25.00 N ATOM 505 CA GLY A 42 4.154 11.089 2.583 1.00 25.00 C ATOM 506 C GLY A 42 3.831 9.659 2.976 1.00 25.00 C ATOM 507 O GLY A 42 3.167 8.944 2.206 1.00 25.00 O ATOM 0 H GLY A 42 4.623 11.114 0.540 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.208 11.295 2.770 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.580 11.781 3.199 1.00 25.00 H new ATOM 511 N ARG A 43 4.297 9.223 4.142 1.00 25.00 N ATOM 512 CA ARG A 43 4.024 7.856 4.604 1.00 25.00 C ATOM 513 C ARG A 43 2.712 7.895 5.371 1.00 25.00 C ATOM 514 O ARG A 43 2.471 8.800 6.165 1.00 25.00 O ATOM 515 CB ARG A 43 5.171 7.285 5.469 1.00 25.00 C ATOM 516 CG ARG A 43 5.267 7.862 6.870 1.00 25.00 C ATOM 517 CD ARG A 43 6.563 7.519 7.581 1.00 25.00 C ATOM 518 NE ARG A 43 7.692 8.288 7.038 1.00 25.00 N ATOM 519 CZ ARG A 43 8.787 8.633 7.708 1.00 25.00 C ATOM 520 NH1 ARG A 43 8.986 8.296 8.959 1.00 25.00 N ATOM 521 NH2 ARG A 43 9.703 9.329 7.097 1.00 25.00 N ATOM 0 H ARG A 43 4.859 9.784 4.782 1.00 25.00 H new ATOM 0 HA ARG A 43 3.950 7.185 3.748 1.00 25.00 H new ATOM 0 HB2 ARG A 43 5.045 6.205 5.545 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.116 7.461 4.955 1.00 25.00 H new ATOM 0 HG2 ARG A 43 5.169 8.946 6.815 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.429 7.496 7.463 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.460 7.724 8.647 1.00 25.00 H new ATOM 0 HD3 ARG A 43 6.765 6.453 7.479 1.00 25.00 H new ATOM 0 HE ARG A 43 7.630 8.582 6.063 1.00 25.00 H new ATOM 0 HH11 ARG A 43 8.285 7.747 9.457 1.00 25.00 H new ATOM 0 HH12 ARG A 43 9.842 8.583 9.434 1.00 25.00 H new ATOM 0 HH21 ARG A 43 9.573 9.599 6.122 1.00 25.00 H new ATOM 0 HH22 ARG A 43 10.551 9.604 7.593 1.00 25.00 H new ATOM 535 N ASP A 44 1.837 6.959 5.082 1.00 25.00 N ATOM 536 CA ASP A 44 0.494 6.983 5.646 1.00 25.00 C ATOM 537 C ASP A 44 0.166 5.654 6.294 1.00 25.00 C ATOM 538 O ASP A 44 0.831 4.646 6.046 1.00 25.00 O ATOM 539 CB ASP A 44 -0.513 7.307 4.546 1.00 25.00 C ATOM 540 CG ASP A 44 -0.211 8.630 3.867 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.219 9.673 4.540 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.053 8.648 2.644 1.00 50.00 O ATOM 0 H ASP A 44 2.024 6.171 4.462 1.00 25.00 H new ATOM 0 HA ASP A 44 0.443 7.754 6.415 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.507 6.509 3.803 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.516 7.339 4.971 1.00 25.00 H new ATOM 547 N ARG A 45 -0.831 5.676 7.164 1.00 25.00 N ATOM 548 CA ARG A 45 -1.257 4.498 7.912 1.00 25.00 C ATOM 549 C ARG A 45 -2.718 4.341 7.568 1.00 25.00 C ATOM 550 O ARG A 45 -3.459 5.304 7.680 1.00 25.00 O ATOM 551 CB ARG A 45 -1.074 4.712 9.422 1.00 25.00 C ATOM 552 CG ARG A 45 0.390 4.754 9.904 1.00 25.00 C ATOM 553 CD ARG A 45 1.017 6.144 9.722 1.00 25.00 C ATOM 554 NE ARG A 45 2.342 6.250 10.357 1.00 25.00 N ATOM 555 CZ ARG A 45 3.149 7.301 10.264 1.00 25.00 C ATOM 556 NH1 ARG A 45 2.850 8.362 9.557 1.00 25.00 N ATOM 557 NH2 ARG A 45 4.288 7.283 10.898 1.00 25.00 N ATOM 0 H ARG A 45 -1.372 6.515 7.374 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.673 3.614 7.658 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.559 5.647 9.702 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -1.592 3.913 9.952 1.00 25.00 H new ATOM 0 HG2 ARG A 45 0.433 4.472 10.956 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.974 4.018 9.352 1.00 25.00 H new ATOM 0 HD2 ARG A 45 1.109 6.362 8.658 1.00 25.00 H new ATOM 0 HD3 ARG A 45 0.353 6.897 10.145 1.00 25.00 H new ATOM 0 HE ARG A 45 2.664 5.456 10.910 1.00 25.00 H new ATOM 0 HH11 ARG A 45 1.966 8.404 9.049 1.00 25.00 H new ATOM 0 HH12 ARG A 45 3.501 9.146 9.514 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.549 6.470 11.456 1.00 25.00 H new ATOM 0 HH22 ARG A 45 4.919 8.082 10.836 1.00 25.00 H new ATOM 571 N LEU A 46 -3.123 3.192 7.064 1.00 25.00 N ATOM 572 CA LEU A 46 -4.490 3.034 6.564 1.00 25.00 C ATOM 573 C LEU A 46 -5.173 1.818 7.172 1.00 25.00 C ATOM 574 O LEU A 46 -4.544 0.791 7.361 1.00 25.00 O ATOM 575 CB LEU A 46 -4.477 2.915 5.035 1.00 25.00 C ATOM 576 CG LEU A 46 -3.838 4.113 4.302 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.418 3.787 3.840 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.662 4.521 3.100 1.00 25.00 C ATOM 0 H LEU A 46 -2.540 2.359 6.987 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.057 3.917 6.858 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.939 2.008 4.759 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.502 2.796 4.684 1.00 25.00 H new ATOM 0 HG LEU A 46 -3.804 4.938 5.014 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.995 4.651 3.327 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.802 3.541 4.705 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -2.443 2.937 3.158 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -4.187 5.367 2.604 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -4.730 3.684 2.405 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -5.663 4.806 3.425 1.00 25.00 H new ATOM 590 N THR A 47 -6.460 1.932 7.464 1.00 25.00 N ATOM 591 CA THR A 47 -7.224 0.815 8.034 1.00 25.00 C ATOM 592 C THR A 47 -8.506 0.615 7.227 1.00 25.00 C ATOM 593 O THR A 47 -9.414 1.444 7.281 1.00 25.00 O ATOM 594 CB THR A 47 -7.582 1.099 9.499 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.436 1.642 10.163 1.00 25.00 O ATOM 596 CG2 THR A 47 -8.007 -0.152 10.221 1.00 25.00 C ATOM 0 H THR A 47 -7.003 2.783 7.319 1.00 25.00 H new ATOM 0 HA THR A 47 -6.613 -0.087 7.992 1.00 25.00 H new ATOM 0 HB THR A 47 -8.414 1.803 9.511 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.562 2.604 10.300 1.00 25.00 H new ATOM 0 HG21 THR A 47 -8.252 0.090 11.255 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.883 -0.576 9.730 1.00 25.00 H new ATOM 0 HG23 THR A 47 -7.194 -0.878 10.201 1.00 25.00 H new ATOM 604 N GLY A 48 -8.578 -0.449 6.441 1.00 25.00 N ATOM 605 CA GLY A 48 -9.735 -0.639 5.571 1.00 25.00 C ATOM 606 C GLY A 48 -10.995 -1.100 6.287 1.00 25.00 C ATOM 607 O GLY A 48 -12.108 -0.651 5.972 1.00 25.00 O ATOM 0 H GLY A 48 -7.869 -1.180 6.385 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.946 0.300 5.059 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.480 -1.370 4.804 1.00 25.00 H new ATOM 611 N GLY A 49 -10.834 -1.995 7.251 1.00 25.00 N ATOM 612 CA GLY A 49 -11.973 -2.523 7.984 1.00 25.00 C ATOM 613 C GLY A 49 -12.825 -3.451 7.140 1.00 25.00 C ATOM 614 O GLY A 49 -12.398 -3.923 6.080 1.00 25.00 O ATOM 0 H GLY A 49 -9.931 -2.368 7.542 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -11.618 -3.060 8.864 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.586 -1.696 8.341 1.00 25.00 H new ATOM 618 N LEU A 50 -14.047 -3.693 7.588 1.00 25.00 N ATOM 619 CA LEU A 50 -14.992 -4.540 6.851 1.00 25.00 C ATOM 620 C LEU A 50 -15.362 -3.902 5.518 1.00 25.00 C ATOM 621 O LEU A 50 -15.201 -2.688 5.327 1.00 25.00 O ATOM 622 CB LEU A 50 -16.275 -4.763 7.671 1.00 25.00 C ATOM 623 CG LEU A 50 -16.135 -5.593 8.957 1.00 25.00 C ATOM 624 CD1 LEU A 50 -17.445 -5.538 9.747 1.00 25.00 C ATOM 625 CD2 LEU A 50 -15.777 -7.049 8.643 1.00 25.00 C ATOM 0 H LEU A 50 -14.415 -3.316 8.461 1.00 25.00 H new ATOM 0 HA LEU A 50 -14.505 -5.498 6.671 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.682 -3.788 7.938 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -17.009 -5.250 7.029 1.00 25.00 H new ATOM 0 HG LEU A 50 -15.327 -5.169 9.553 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -17.345 -6.127 10.659 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -17.671 -4.504 10.006 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -18.254 -5.944 9.139 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -15.685 -7.610 9.573 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -16.561 -7.492 8.028 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -14.830 -7.083 8.104 1.00 25.00 H new ATOM 637 N GLY A 51 -15.865 -4.729 4.615 1.00 25.00 N ATOM 638 CA GLY A 51 -16.224 -4.289 3.279 1.00 25.00 C ATOM 639 C GLY A 51 -15.055 -4.467 2.337 1.00 25.00 C ATOM 640 O GLY A 51 -13.919 -4.698 2.793 1.00 25.00 O ATOM 0 H GLY A 51 -16.035 -5.720 4.788 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -17.080 -4.859 2.919 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.525 -3.242 3.302 1.00 25.00 H new ATOM 644 N ALA A 52 -15.315 -4.359 1.043 1.00 25.00 N ATOM 645 CA ALA A 52 -14.271 -4.450 0.023 1.00 25.00 C ATOM 646 C ALA A 52 -13.650 -3.061 -0.070 1.00 25.00 C ATOM 647 O ALA A 52 -14.351 -2.073 -0.218 1.00 25.00 O ATOM 648 CB ALA A 52 -14.880 -4.866 -1.313 1.00 25.00 C ATOM 0 H ALA A 52 -16.251 -4.206 0.667 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.519 -5.197 0.278 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -14.095 -4.931 -2.066 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -15.362 -5.838 -1.206 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.619 -4.127 -1.622 1.00 25.00 H new ATOM 654 N ASP A 53 -12.344 -2.975 0.097 1.00 25.00 N ATOM 655 CA ASP A 53 -11.666 -1.686 0.129 1.00 25.00 C ATOM 656 C ASP A 53 -10.579 -1.655 -0.915 1.00 25.00 C ATOM 657 O ASP A 53 -9.895 -2.652 -1.122 1.00 25.00 O ATOM 658 CB ASP A 53 -11.045 -1.458 1.504 1.00 25.00 C ATOM 659 CG ASP A 53 -12.061 -1.514 2.620 1.00 25.00 C ATOM 660 OD1 ASP A 53 -13.013 -0.705 2.648 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.904 -2.372 3.521 1.00 50.00 O ATOM 0 H ASP A 53 -11.729 -3.780 0.213 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.394 -0.901 -0.076 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.276 -2.211 1.680 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.550 -0.487 1.518 1.00 25.00 H new ATOM 666 N THR A 54 -10.384 -0.514 -1.554 1.00 25.00 N ATOM 667 CA THR A 54 -9.293 -0.375 -2.512 1.00 25.00 C ATOM 668 C THR A 54 -8.381 0.746 -2.061 1.00 25.00 C ATOM 669 O THR A 54 -8.824 1.799 -1.598 1.00 25.00 O ATOM 670 CB THR A 54 -9.792 -0.169 -3.974 1.00 25.00 C ATOM 671 OG1 THR A 54 -8.665 -0.099 -4.853 1.00 25.00 O ATOM 672 CG2 THR A 54 -10.603 1.103 -4.132 1.00 25.00 C ATOM 0 H THR A 54 -10.957 0.321 -1.432 1.00 25.00 H new ATOM 0 HA THR A 54 -8.733 -1.310 -2.532 1.00 25.00 H new ATOM 0 HB THR A 54 -10.434 -1.015 -4.220 1.00 25.00 H new ATOM 0 HG1 THR A 54 -8.976 0.029 -5.774 1.00 25.00 H new ATOM 0 HG21 THR A 54 -10.928 1.201 -5.168 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.476 1.061 -3.481 1.00 25.00 H new ATOM 0 HG23 THR A 54 -9.989 1.962 -3.861 1.00 25.00 H new ATOM 680 N PHE A 55 -7.094 0.477 -2.142 1.00 25.00 N ATOM 681 CA PHE A 55 -6.073 1.414 -1.720 1.00 25.00 C ATOM 682 C PHE A 55 -5.352 1.814 -2.987 1.00 25.00 C ATOM 683 O PHE A 55 -4.814 0.960 -3.695 1.00 25.00 O ATOM 684 CB PHE A 55 -5.131 0.746 -0.717 1.00 25.00 C ATOM 685 CG PHE A 55 -5.838 0.215 0.504 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.373 -1.088 0.517 1.00 25.00 C ATOM 687 CD2 PHE A 55 -5.971 1.016 1.650 1.00 25.00 C ATOM 688 CE1 PHE A 55 -7.039 -1.589 1.666 1.00 25.00 C ATOM 689 CE2 PHE A 55 -6.621 0.523 2.811 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.155 -0.782 2.815 1.00 25.00 C ATOM 0 H PHE A 55 -6.725 -0.402 -2.504 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.487 2.287 -1.215 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.608 -0.073 -1.210 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.374 1.466 -0.406 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.275 -1.713 -0.358 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -5.573 2.020 1.648 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.455 -2.585 1.659 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -6.706 1.146 3.689 1.00 25.00 H new ATOM 0 HZ PHE A 55 -7.651 -1.162 3.696 1.00 25.00 H new ATOM 700 N ARG A 56 -5.417 3.087 -3.329 1.00 25.00 N ATOM 701 CA ARG A 56 -4.914 3.552 -4.622 1.00 25.00 C ATOM 702 C ARG A 56 -3.876 4.647 -4.478 1.00 25.00 C ATOM 703 O ARG A 56 -3.926 5.476 -3.575 1.00 25.00 O ATOM 704 CB ARG A 56 -6.095 4.034 -5.480 1.00 25.00 C ATOM 705 CG ARG A 56 -5.710 4.380 -6.915 1.00 25.00 C ATOM 706 CD ARG A 56 -6.919 4.615 -7.792 1.00 25.00 C ATOM 707 NE ARG A 56 -6.494 5.009 -9.152 1.00 25.00 N ATOM 708 CZ ARG A 56 -6.328 4.188 -10.183 1.00 25.00 C ATOM 709 NH1 ARG A 56 -6.556 2.897 -10.117 1.00 25.00 N ATOM 710 NH2 ARG A 56 -5.931 4.684 -11.322 1.00 25.00 N ATOM 0 H ARG A 56 -5.810 3.820 -2.738 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.416 2.715 -5.112 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -6.861 3.259 -5.496 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.539 4.912 -5.011 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -5.084 5.272 -6.916 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -5.112 3.571 -7.334 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.524 3.710 -7.840 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -7.546 5.395 -7.359 1.00 25.00 H new ATOM 0 HE ARG A 56 -6.312 6.000 -9.313 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -6.877 2.480 -9.243 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -6.412 2.311 -10.939 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -5.754 5.685 -11.409 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -5.797 4.071 -12.126 1.00 25.00 H new ATOM 724 N PHE A 57 -2.911 4.610 -5.382 1.00 25.00 N ATOM 725 CA PHE A 57 -1.882 5.632 -5.451 1.00 25.00 C ATOM 726 C PHE A 57 -2.484 6.929 -6.014 1.00 25.00 C ATOM 727 O PHE A 57 -3.199 6.911 -7.007 1.00 25.00 O ATOM 728 CB PHE A 57 -0.725 5.159 -6.352 1.00 25.00 C ATOM 729 CG PHE A 57 -1.063 5.148 -7.830 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.789 4.078 -8.398 1.00 25.00 C ATOM 731 CD2 PHE A 57 -0.686 6.227 -8.655 1.00 25.00 C ATOM 732 CE1 PHE A 57 -2.150 4.086 -9.770 1.00 25.00 C ATOM 733 CE2 PHE A 57 -1.039 6.246 -10.030 1.00 25.00 C ATOM 734 CZ PHE A 57 -1.772 5.170 -10.585 1.00 25.00 C ATOM 0 H PHE A 57 -2.820 3.876 -6.084 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.494 5.817 -4.449 1.00 25.00 H new ATOM 0 HB2 PHE A 57 0.136 5.807 -6.191 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.429 4.155 -6.049 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -2.074 3.241 -7.778 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -0.123 7.048 -8.237 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -2.712 3.264 -10.188 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -0.749 7.080 -10.651 1.00 25.00 H new ATOM 0 HZ PHE A 57 -2.041 5.180 -11.631 1.00 25.00 H new ATOM 744 N ALA A 58 -2.126 8.054 -5.414 1.00 25.00 N ATOM 745 CA ALA A 58 -2.506 9.354 -5.958 1.00 25.00 C ATOM 746 C ALA A 58 -1.325 9.921 -6.766 1.00 25.00 C ATOM 747 O ALA A 58 -1.498 10.718 -7.681 1.00 25.00 O ATOM 748 CB ALA A 58 -2.896 10.295 -4.826 1.00 25.00 C ATOM 0 H ALA A 58 -1.576 8.096 -4.556 1.00 25.00 H new ATOM 0 HA ALA A 58 -3.367 9.247 -6.618 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -3.178 11.263 -5.239 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.739 9.875 -4.277 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -2.050 10.421 -4.150 1.00 25.00 H new ATOM 754 N LEU A 59 -0.119 9.487 -6.417 1.00 25.00 N ATOM 755 CA LEU A 59 1.113 9.905 -7.099 1.00 25.00 C ATOM 756 C LEU A 59 1.979 8.666 -7.274 1.00 25.00 C ATOM 757 O LEU A 59 1.804 7.693 -6.569 1.00 25.00 O ATOM 758 CB LEU A 59 1.915 10.929 -6.260 1.00 25.00 C ATOM 759 CG LEU A 59 1.465 12.393 -6.186 1.00 25.00 C ATOM 760 CD1 LEU A 59 0.295 12.641 -5.229 1.00 25.00 C ATOM 761 CD2 LEU A 59 2.664 13.244 -5.742 1.00 25.00 C ATOM 0 H LEU A 59 0.039 8.833 -5.651 1.00 25.00 H new ATOM 0 HA LEU A 59 0.848 10.371 -8.048 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.951 10.551 -5.238 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.937 10.925 -6.638 1.00 25.00 H new ATOM 0 HG LEU A 59 1.109 12.667 -7.179 1.00 25.00 H new ATOM 0 HD11 LEU A 59 0.038 13.700 -5.235 1.00 25.00 H new ATOM 0 HD12 LEU A 59 -0.568 12.057 -5.550 1.00 25.00 H new ATOM 0 HD13 LEU A 59 0.580 12.343 -4.220 1.00 25.00 H new ATOM 0 HD21 LEU A 59 2.365 14.291 -5.683 1.00 25.00 H new ATOM 0 HD22 LEU A 59 3.006 12.908 -4.763 1.00 25.00 H new ATOM 0 HD23 LEU A 59 3.473 13.138 -6.465 1.00 25.00 H new ATOM 773 N ARG A 60 2.986 8.733 -8.135 1.00 25.00 N ATOM 774 CA ARG A 60 3.946 7.623 -8.259 1.00 25.00 C ATOM 775 C ARG A 60 4.855 7.549 -7.034 1.00 25.00 C ATOM 776 O ARG A 60 5.519 6.558 -6.799 1.00 25.00 O ATOM 777 CB ARG A 60 4.776 7.779 -9.537 1.00 25.00 C ATOM 778 CG ARG A 60 5.756 8.943 -9.484 1.00 25.00 C ATOM 779 CD ARG A 60 6.365 9.234 -10.830 1.00 25.00 C ATOM 780 NE ARG A 60 7.292 10.373 -10.735 1.00 25.00 N ATOM 781 CZ ARG A 60 7.980 10.885 -11.744 1.00 25.00 C ATOM 782 NH1 ARG A 60 7.886 10.428 -12.972 1.00 25.00 N ATOM 783 NH2 ARG A 60 8.772 11.893 -11.511 1.00 25.00 N ATOM 0 H ARG A 60 3.165 9.525 -8.752 1.00 25.00 H new ATOM 0 HA ARG A 60 3.385 6.690 -8.319 1.00 25.00 H new ATOM 0 HB2 ARG A 60 5.328 6.857 -9.717 1.00 25.00 H new ATOM 0 HB3 ARG A 60 4.103 7.918 -10.383 1.00 25.00 H new ATOM 0 HG2 ARG A 60 5.242 9.832 -9.119 1.00 25.00 H new ATOM 0 HG3 ARG A 60 6.548 8.717 -8.770 1.00 25.00 H new ATOM 0 HD2 ARG A 60 6.895 8.354 -11.195 1.00 25.00 H new ATOM 0 HD3 ARG A 60 5.579 9.455 -11.552 1.00 25.00 H new ATOM 0 HE ARG A 60 7.414 10.803 -9.818 1.00 25.00 H new ATOM 0 HH11 ARG A 60 7.263 9.647 -13.179 1.00 25.00 H new ATOM 0 HH12 ARG A 60 8.436 10.854 -13.718 1.00 25.00 H new ATOM 0 HH21 ARG A 60 8.852 12.271 -10.567 1.00 25.00 H new ATOM 0 HH22 ARG A 60 9.312 12.304 -12.273 1.00 25.00 H new ATOM 797 N GLU A 61 4.854 8.619 -6.253 1.00 25.00 N ATOM 798 CA GLU A 61 5.688 8.745 -5.058 1.00 25.00 C ATOM 799 C GLU A 61 4.837 8.534 -3.806 1.00 25.00 C ATOM 800 O GLU A 61 5.260 8.817 -2.689 1.00 25.00 O ATOM 801 CB GLU A 61 6.298 10.144 -5.053 1.00 25.00 C ATOM 802 CG GLU A 61 7.343 10.313 -6.149 1.00 25.00 C ATOM 803 CD GLU A 61 7.667 11.766 -6.444 1.00 25.00 C ATOM 804 OE1 GLU A 61 8.097 12.488 -5.522 1.00 25.00 O ATOM 805 OE2 GLU A 61 7.502 12.175 -7.623 1.00 25.00 O ATOM 0 H GLU A 61 4.269 9.436 -6.430 1.00 25.00 H new ATOM 0 HA GLU A 61 6.477 7.993 -5.064 1.00 25.00 H new ATOM 0 HB2 GLU A 61 5.509 10.884 -5.186 1.00 25.00 H new ATOM 0 HB3 GLU A 61 6.755 10.337 -4.083 1.00 25.00 H new ATOM 0 HG2 GLU A 61 8.256 9.796 -5.855 1.00 25.00 H new ATOM 0 HG3 GLU A 61 6.985 9.834 -7.061 1.00 25.00 H new ATOM 812 N ASP A 62 3.617 8.044 -4.003 1.00 25.00 N ATOM 813 CA ASP A 62 2.696 7.785 -2.887 1.00 25.00 C ATOM 814 C ASP A 62 3.298 6.766 -1.911 1.00 25.00 C ATOM 815 O ASP A 62 3.122 6.875 -0.700 1.00 25.00 O ATOM 816 CB ASP A 62 1.356 7.271 -3.425 1.00 25.00 C ATOM 817 CG ASP A 62 0.215 7.472 -2.454 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.350 7.159 -1.259 1.00 25.00 O ATOM 819 OD2 ASP A 62 -0.813 8.019 -2.892 1.00 25.00 O ATOM 0 H ASP A 62 3.238 7.816 -4.922 1.00 25.00 H new ATOM 0 HA ASP A 62 2.532 8.719 -2.349 1.00 25.00 H new ATOM 0 HB2 ASP A 62 1.125 7.783 -4.359 1.00 25.00 H new ATOM 0 HB3 ASP A 62 1.446 6.210 -3.657 1.00 25.00 H new ATOM 824 N SER A 63 4.039 5.803 -2.442 1.00 25.00 N ATOM 825 CA SER A 63 4.759 4.820 -1.633 1.00 25.00 C ATOM 826 C SER A 63 6.121 4.602 -2.271 1.00 25.00 C ATOM 827 O SER A 63 6.219 4.102 -3.387 1.00 25.00 O ATOM 828 CB SER A 63 3.980 3.510 -1.538 1.00 25.00 C ATOM 829 OG SER A 63 2.838 3.677 -0.712 1.00 25.00 O ATOM 0 H SER A 63 4.160 5.678 -3.447 1.00 25.00 H new ATOM 0 HA SER A 63 4.878 5.188 -0.614 1.00 25.00 H new ATOM 0 HB2 SER A 63 3.674 3.188 -2.533 1.00 25.00 H new ATOM 0 HB3 SER A 63 4.620 2.727 -1.132 1.00 25.00 H new ATOM 0 HG SER A 63 2.345 2.831 -0.660 1.00 25.00 H new ATOM 835 N HIS A 64 7.160 5.079 -1.601 1.00 25.00 N ATOM 836 CA HIS A 64 8.506 5.134 -2.168 1.00 25.00 C ATOM 837 C HIS A 64 9.502 5.088 -1.007 1.00 25.00 C ATOM 838 O HIS A 64 9.161 5.491 0.104 1.00 25.00 O ATOM 839 CB HIS A 64 8.621 6.453 -2.959 1.00 25.00 C ATOM 840 CG HIS A 64 10.021 6.837 -3.325 1.00 25.00 C ATOM 841 ND1 HIS A 64 10.692 7.899 -2.770 1.00 25.00 N ATOM 842 CD2 HIS A 64 10.885 6.311 -4.239 1.00 25.00 C ATOM 843 CE1 HIS A 64 11.889 7.976 -3.333 1.00 25.00 C ATOM 844 NE2 HIS A 64 12.069 7.028 -4.226 1.00 25.00 N ATOM 0 H HIS A 64 7.097 5.440 -0.649 1.00 25.00 H new ATOM 0 HA HIS A 64 8.713 4.300 -2.839 1.00 25.00 H new ATOM 0 HB2 HIS A 64 8.031 6.367 -3.871 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.180 7.256 -2.368 1.00 25.00 H new ATOM 0 HD1 HIS A 64 10.331 8.522 -2.048 1.00 25.00 H new ATOM 0 HD2 HIS A 64 10.677 5.464 -4.876 1.00 25.00 H new ATOM 0 HE1 HIS A 64 12.627 8.726 -3.088 1.00 25.00 H new ATOM 852 N ARG A 65 10.714 4.599 -1.237 1.00 25.00 N ATOM 853 CA ARG A 65 11.760 4.594 -0.201 1.00 25.00 C ATOM 854 C ARG A 65 13.084 4.994 -0.822 1.00 25.00 C ATOM 855 O ARG A 65 13.364 4.665 -1.970 1.00 25.00 O ATOM 856 CB ARG A 65 11.890 3.213 0.460 1.00 25.00 C ATOM 857 CG ARG A 65 10.690 2.825 1.319 1.00 25.00 C ATOM 858 CD ARG A 65 10.936 1.547 2.119 1.00 25.00 C ATOM 859 NE ARG A 65 9.754 1.163 2.913 1.00 25.00 N ATOM 860 CZ ARG A 65 9.475 -0.065 3.345 1.00 25.00 C ATOM 861 NH1 ARG A 65 10.231 -1.101 3.090 1.00 25.00 N ATOM 862 NH2 ARG A 65 8.392 -0.254 4.046 1.00 25.00 N ATOM 0 H ARG A 65 11.005 4.199 -2.129 1.00 25.00 H new ATOM 0 HA ARG A 65 11.480 5.309 0.572 1.00 25.00 H new ATOM 0 HB2 ARG A 65 12.027 2.461 -0.317 1.00 25.00 H new ATOM 0 HB3 ARG A 65 12.787 3.200 1.079 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.458 3.640 2.004 1.00 25.00 H new ATOM 0 HG3 ARG A 65 9.818 2.688 0.680 1.00 25.00 H new ATOM 0 HD2 ARG A 65 11.196 0.736 1.438 1.00 25.00 H new ATOM 0 HD3 ARG A 65 11.789 1.692 2.783 1.00 25.00 H new ATOM 0 HE ARG A 65 9.093 1.902 3.152 1.00 25.00 H new ATOM 0 HH11 ARG A 65 11.080 -0.989 2.536 1.00 25.00 H new ATOM 0 HH12 ARG A 65 9.972 -2.021 3.445 1.00 25.00 H new ATOM 0 HH21 ARG A 65 7.776 0.532 4.254 1.00 25.00 H new ATOM 0 HH22 ARG A 65 8.161 -1.188 4.386 1.00 25.00 H new ATOM 876 N SER A 66 13.885 5.722 -0.061 1.00 25.00 N ATOM 877 CA SER A 66 15.182 6.207 -0.524 1.00 25.00 C ATOM 878 C SER A 66 16.042 6.400 0.731 1.00 25.00 C ATOM 879 O SER A 66 15.507 6.357 1.840 1.00 25.00 O ATOM 880 CB SER A 66 14.986 7.532 -1.265 1.00 25.00 C ATOM 881 OG SER A 66 14.577 8.553 -0.368 1.00 25.00 O ATOM 0 H SER A 66 13.658 5.995 0.895 1.00 25.00 H new ATOM 0 HA SER A 66 15.663 5.511 -1.212 1.00 25.00 H new ATOM 0 HB2 SER A 66 15.916 7.822 -1.754 1.00 25.00 H new ATOM 0 HB3 SER A 66 14.239 7.409 -2.049 1.00 25.00 H new ATOM 0 HG SER A 66 14.459 9.392 -0.860 1.00 25.00 H new ATOM 887 N PRO A 67 17.362 6.652 0.594 1.00 25.00 N ATOM 888 CA PRO A 67 18.093 6.893 1.851 1.00 25.00 C ATOM 889 C PRO A 67 17.726 8.215 2.531 1.00 25.00 C ATOM 890 O PRO A 67 18.106 8.466 3.662 1.00 25.00 O ATOM 891 CB PRO A 67 19.551 6.911 1.391 1.00 25.00 C ATOM 892 CG PRO A 67 19.485 7.418 0.005 1.00 25.00 C ATOM 893 CD PRO A 67 18.267 6.753 -0.570 1.00 25.00 C ATOM 0 HA PRO A 67 17.862 6.139 2.603 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.161 7.557 2.023 1.00 25.00 H new ATOM 0 HB3 PRO A 67 19.994 5.916 1.431 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.395 8.504 -0.018 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.383 7.160 -0.557 1.00 25.00 H new ATOM 0 HD2 PRO A 67 17.826 7.343 -1.374 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.501 5.773 -0.986 1.00 25.00 H new ATOM 901 N LEU A 68 16.951 9.042 1.837 1.00 25.00 N ATOM 902 CA LEU A 68 16.488 10.312 2.393 1.00 25.00 C ATOM 903 C LEU A 68 15.303 10.091 3.335 1.00 25.00 C ATOM 904 O LEU A 68 14.888 10.996 4.059 1.00 25.00 O ATOM 905 CB LEU A 68 16.059 11.260 1.265 1.00 25.00 C ATOM 906 CG LEU A 68 17.122 11.587 0.204 1.00 25.00 C ATOM 907 CD1 LEU A 68 16.468 12.416 -0.902 1.00 25.00 C ATOM 908 CD2 LEU A 68 18.312 12.349 0.785 1.00 25.00 C ATOM 0 H LEU A 68 16.629 8.857 0.887 1.00 25.00 H new ATOM 0 HA LEU A 68 17.313 10.754 2.952 1.00 25.00 H new ATOM 0 HB2 LEU A 68 15.197 10.823 0.761 1.00 25.00 H new ATOM 0 HB3 LEU A 68 15.725 12.196 1.714 1.00 25.00 H new ATOM 0 HG LEU A 68 17.508 10.647 -0.190 1.00 25.00 H new ATOM 0 HD11 LEU A 68 17.210 12.657 -1.663 1.00 25.00 H new ATOM 0 HD12 LEU A 68 15.657 11.845 -1.353 1.00 25.00 H new ATOM 0 HD13 LEU A 68 16.071 13.338 -0.479 1.00 25.00 H new ATOM 0 HD21 LEU A 68 19.033 12.555 -0.006 1.00 25.00 H new ATOM 0 HD22 LEU A 68 17.967 13.289 1.215 1.00 25.00 H new ATOM 0 HD23 LEU A 68 18.786 11.747 1.561 1.00 25.00 H new ATOM 920 N GLY A 69 14.745 8.888 3.308 1.00 25.00 N ATOM 921 CA GLY A 69 13.620 8.563 4.167 1.00 25.00 C ATOM 922 C GLY A 69 12.632 7.620 3.516 1.00 25.00 C ATOM 923 O GLY A 69 12.756 7.268 2.342 1.00 25.00 O ATOM 0 H GLY A 69 15.053 8.126 2.703 1.00 25.00 H new ATOM 0 HA2 GLY A 69 13.991 8.113 5.088 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.106 9.483 4.447 1.00 25.00 H new ATOM 927 N THR A 70 11.640 7.203 4.285 1.00 25.00 N ATOM 928 CA THR A 70 10.612 6.305 3.791 1.00 25.00 C ATOM 929 C THR A 70 9.309 7.067 3.633 1.00 25.00 C ATOM 930 O THR A 70 8.966 7.939 4.441 1.00 25.00 O ATOM 931 CB THR A 70 10.428 5.077 4.728 1.00 25.00 C ATOM 932 OG1 THR A 70 9.383 4.249 4.215 1.00 25.00 O ATOM 933 CG2 THR A 70 10.058 5.479 6.155 1.00 25.00 C ATOM 0 H THR A 70 11.526 7.475 5.261 1.00 25.00 H new ATOM 0 HA THR A 70 10.923 5.921 2.819 1.00 25.00 H new ATOM 0 HB THR A 70 11.382 4.550 4.759 1.00 25.00 H new ATOM 0 HG1 THR A 70 9.264 3.472 4.801 1.00 25.00 H new ATOM 0 HG21 THR A 70 9.942 4.584 6.766 1.00 25.00 H new ATOM 0 HG22 THR A 70 10.847 6.104 6.573 1.00 25.00 H new ATOM 0 HG23 THR A 70 9.121 6.036 6.145 1.00 25.00 H new ATOM 941 N PHE A 71 8.595 6.748 2.570 1.00 25.00 N ATOM 942 CA PHE A 71 7.325 7.374 2.253 1.00 25.00 C ATOM 943 C PHE A 71 6.328 6.253 1.976 1.00 25.00 C ATOM 944 O PHE A 71 5.242 6.482 1.465 1.00 25.00 O ATOM 945 CB PHE A 71 7.502 8.284 1.031 1.00 25.00 C ATOM 946 CG PHE A 71 8.692 9.211 1.141 1.00 25.00 C ATOM 947 CD1 PHE A 71 8.579 10.454 1.788 1.00 25.00 C ATOM 948 CD2 PHE A 71 9.942 8.830 0.607 1.00 25.00 C ATOM 949 CE1 PHE A 71 9.703 11.315 1.915 1.00 25.00 C ATOM 950 CE2 PHE A 71 11.071 9.673 0.730 1.00 25.00 C ATOM 951 CZ PHE A 71 10.951 10.917 1.392 1.00 25.00 C ATOM 0 H PHE A 71 8.883 6.040 1.895 1.00 25.00 H new ATOM 0 HA PHE A 71 6.961 7.993 3.073 1.00 25.00 H new ATOM 0 HB2 PHE A 71 7.613 7.666 0.140 1.00 25.00 H new ATOM 0 HB3 PHE A 71 6.599 8.879 0.896 1.00 25.00 H new ATOM 0 HD1 PHE A 71 7.626 10.759 2.194 1.00 25.00 H new ATOM 0 HD2 PHE A 71 10.037 7.882 0.098 1.00 25.00 H new ATOM 0 HE1 PHE A 71 9.602 12.270 2.410 1.00 25.00 H new ATOM 0 HE2 PHE A 71 12.022 9.368 0.320 1.00 25.00 H new ATOM 0 HZ PHE A 71 11.812 11.560 1.497 1.00 25.00 H new ATOM 961 N SER A 72 6.741 5.025 2.284 1.00 25.00 N ATOM 962 CA SER A 72 5.923 3.844 2.039 1.00 25.00 C ATOM 963 C SER A 72 4.746 3.816 2.990 1.00 25.00 C ATOM 964 O SER A 72 4.899 4.118 4.175 1.00 25.00 O ATOM 965 CB SER A 72 6.742 2.583 2.275 1.00 25.00 C ATOM 966 OG SER A 72 7.218 2.544 3.614 1.00 25.00 O ATOM 0 H SER A 72 7.647 4.824 2.708 1.00 25.00 H new ATOM 0 HA SER A 72 5.574 3.884 1.007 1.00 25.00 H new ATOM 0 HB2 SER A 72 6.132 1.703 2.074 1.00 25.00 H new ATOM 0 HB3 SER A 72 7.583 2.553 1.582 1.00 25.00 H new ATOM 0 HG SER A 72 7.878 3.256 3.747 1.00 25.00 H new ATOM 972 N ASP A 73 3.597 3.404 2.493 1.00 25.00 N ATOM 973 CA ASP A 73 2.400 3.321 3.321 1.00 25.00 C ATOM 974 C ASP A 73 2.288 1.975 3.996 1.00 25.00 C ATOM 975 O ASP A 73 2.788 0.963 3.495 1.00 25.00 O ATOM 976 CB ASP A 73 1.160 3.591 2.481 1.00 25.00 C ATOM 977 CG ASP A 73 1.053 5.035 2.076 1.00 25.00 C ATOM 978 OD1 ASP A 73 1.897 5.841 2.521 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.160 5.410 1.302 1.00 50.00 O ATOM 0 H ASP A 73 3.462 3.121 1.522 1.00 25.00 H new ATOM 0 HA ASP A 73 2.478 4.081 4.099 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.184 2.966 1.588 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.272 3.307 3.045 1.00 25.00 H new ATOM 984 N LEU A 74 1.630 1.986 5.147 1.00 25.00 N ATOM 985 CA LEU A 74 1.409 0.791 5.941 1.00 25.00 C ATOM 986 C LEU A 74 -0.089 0.621 6.115 1.00 25.00 C ATOM 987 O LEU A 74 -0.775 1.551 6.540 1.00 25.00 O ATOM 988 CB LEU A 74 2.058 0.930 7.326 1.00 25.00 C ATOM 989 CG LEU A 74 3.583 1.145 7.360 1.00 25.00 C ATOM 990 CD1 LEU A 74 3.942 2.632 7.518 1.00 25.00 C ATOM 991 CD2 LEU A 74 4.192 0.350 8.519 1.00 25.00 C ATOM 0 H LEU A 74 1.233 2.832 5.557 1.00 25.00 H new ATOM 0 HA LEU A 74 1.851 -0.069 5.438 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.585 1.767 7.840 1.00 25.00 H new ATOM 0 HB3 LEU A 74 1.829 0.032 7.900 1.00 25.00 H new ATOM 0 HG LEU A 74 3.990 0.796 6.411 1.00 25.00 H new ATOM 0 HD11 LEU A 74 5.026 2.744 7.538 1.00 25.00 H new ATOM 0 HD12 LEU A 74 3.534 3.196 6.679 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.521 3.011 8.449 1.00 25.00 H new ATOM 0 HD21 LEU A 74 5.271 0.505 8.539 1.00 25.00 H new ATOM 0 HD22 LEU A 74 3.759 0.689 9.460 1.00 25.00 H new ATOM 0 HD23 LEU A 74 3.980 -0.711 8.384 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.606 -0.554 5.807 1.00 25.00 N ATOM 1004 CA ILE A 75 -2.021 -0.835 6.042 1.00 25.00 C ATOM 1005 C ILE A 75 -2.057 -1.720 7.272 1.00 25.00 C ATOM 1006 O ILE A 75 -1.209 -2.587 7.442 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.721 -1.519 4.849 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -2.338 -0.794 3.536 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -4.263 -1.513 5.044 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -3.038 -1.313 2.256 1.00 25.00 C ATOM 0 H ILE A 75 -0.079 -1.325 5.398 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.569 0.097 6.179 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.391 -2.556 4.792 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.565 0.266 3.648 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -1.260 -0.876 3.398 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.739 -2.000 4.193 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.516 -2.051 5.958 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.616 -0.485 5.118 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -2.698 -0.736 1.396 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -2.792 -2.365 2.108 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -4.117 -1.204 2.362 1.00 25.00 H new ATOM 1022 N LEU A 76 -2.997 -1.428 8.150 1.00 25.00 N ATOM 1023 CA LEU A 76 -3.103 -2.073 9.468 1.00 25.00 C ATOM 1024 C LEU A 76 -3.964 -3.320 9.410 1.00 25.00 C ATOM 1025 O LEU A 76 -3.742 -4.274 10.133 1.00 25.00 O ATOM 1026 CB LEU A 76 -3.758 -1.110 10.476 1.00 25.00 C ATOM 1027 CG LEU A 76 -2.935 0.009 11.138 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -1.798 -0.591 11.979 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -2.365 1.030 10.152 1.00 25.00 C ATOM 0 H LEU A 76 -3.721 -0.731 7.978 1.00 25.00 H new ATOM 0 HA LEU A 76 -2.091 -2.338 9.775 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.597 -0.634 9.968 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -4.175 -1.719 11.278 1.00 25.00 H new ATOM 0 HG LEU A 76 -3.633 0.553 11.775 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -1.224 0.212 12.441 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -2.218 -1.230 12.756 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -1.144 -1.182 11.338 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -1.798 1.785 10.697 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -1.708 0.525 9.444 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -3.181 1.509 9.612 1.00 25.00 H new ATOM 1041 N ASP A 77 -4.973 -3.256 8.559 1.00 25.00 N ATOM 1042 CA ASP A 77 -5.941 -4.343 8.391 1.00 25.00 C ATOM 1043 C ASP A 77 -6.221 -4.471 6.907 1.00 25.00 C ATOM 1044 O ASP A 77 -6.675 -3.506 6.272 1.00 25.00 O ATOM 1045 CB ASP A 77 -7.257 -4.024 9.104 1.00 25.00 C ATOM 1046 CG ASP A 77 -7.164 -4.177 10.611 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -6.983 -5.315 11.086 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -7.369 -3.169 11.319 1.00 25.00 O ATOM 0 H ASP A 77 -5.151 -2.450 7.960 1.00 25.00 H new ATOM 0 HA ASP A 77 -5.534 -5.261 8.814 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -7.556 -3.003 8.865 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -8.039 -4.682 8.725 1.00 25.00 H new ATOM 1053 N PHE A 78 -5.930 -5.636 6.343 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.132 -5.874 4.915 1.00 25.00 C ATOM 1055 C PHE A 78 -6.700 -7.273 4.693 1.00 25.00 C ATOM 1056 O PHE A 78 -6.147 -8.266 5.175 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.810 -5.728 4.156 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.961 -5.839 2.666 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -4.884 -7.093 2.028 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -5.195 -4.691 1.889 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.044 -7.193 0.621 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -5.353 -4.784 0.487 1.00 25.00 C ATOM 1063 CZ PHE A 78 -5.284 -6.041 -0.144 1.00 25.00 C ATOM 0 H PHE A 78 -5.552 -6.435 6.852 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.839 -5.135 4.538 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.366 -4.762 4.398 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.115 -6.494 4.501 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -4.702 -7.983 2.613 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -5.255 -3.725 2.369 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -4.981 -8.157 0.138 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -5.526 -3.893 -0.099 1.00 25.00 H new ATOM 0 HZ PHE A 78 -5.415 -6.118 -1.213 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.799 -7.334 3.955 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.476 -8.594 3.662 1.00 25.00 C ATOM 1075 C ASP A 79 -8.060 -9.089 2.275 1.00 25.00 C ATOM 1076 O ASP A 79 -8.548 -8.577 1.277 1.00 25.00 O ATOM 1077 CB ASP A 79 -9.991 -8.401 3.643 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.536 -7.856 4.941 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -10.184 -8.372 6.009 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.320 -6.872 4.878 1.00 25.00 O ATOM 0 H ASP A 79 -8.247 -6.516 3.543 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.200 -9.311 4.435 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.254 -7.722 2.832 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.470 -9.356 3.427 1.00 25.00 H new ATOM 1085 N PRO A 80 -7.212 -10.124 2.181 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.840 -10.577 0.829 1.00 25.00 C ATOM 1087 C PRO A 80 -7.987 -11.252 0.067 1.00 25.00 C ATOM 1088 O PRO A 80 -7.879 -11.517 -1.116 1.00 25.00 O ATOM 1089 CB PRO A 80 -5.701 -11.559 1.105 1.00 25.00 C ATOM 1090 CG PRO A 80 -6.029 -12.113 2.428 1.00 25.00 C ATOM 1091 CD PRO A 80 -6.540 -10.935 3.212 1.00 25.00 C ATOM 0 HA PRO A 80 -6.565 -9.744 0.183 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -5.652 -12.339 0.345 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -4.733 -11.058 1.110 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -6.782 -12.898 2.354 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -5.153 -12.555 2.902 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -7.229 -11.241 3.999 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -5.730 -10.387 3.693 1.00 25.00 H new ATOM 1099 N SER A 81 -9.098 -11.486 0.753 1.00 25.00 N ATOM 1100 CA SER A 81 -10.286 -12.062 0.128 1.00 25.00 C ATOM 1101 C SER A 81 -11.228 -10.986 -0.429 1.00 25.00 C ATOM 1102 O SER A 81 -12.212 -11.318 -1.081 1.00 25.00 O ATOM 1103 CB SER A 81 -11.056 -12.890 1.166 1.00 25.00 C ATOM 1104 OG SER A 81 -12.211 -13.487 0.595 1.00 25.00 O ATOM 0 H SER A 81 -9.203 -11.285 1.747 1.00 25.00 H new ATOM 0 HA SER A 81 -9.948 -12.684 -0.701 1.00 25.00 H new ATOM 0 HB2 SER A 81 -10.406 -13.665 1.571 1.00 25.00 H new ATOM 0 HB3 SER A 81 -11.348 -12.251 2.000 1.00 25.00 H new ATOM 0 HG SER A 81 -12.487 -12.976 -0.194 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.989 -9.720 -0.097 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.950 -8.649 -0.426 1.00 25.00 C ATOM 1112 C GLN A 82 -11.312 -7.349 -0.932 1.00 25.00 C ATOM 1113 O GLN A 82 -11.964 -6.570 -1.611 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.756 -8.277 0.835 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.577 -9.409 1.472 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.824 -9.765 0.680 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.692 -8.935 0.474 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.935 -11.000 0.277 1.00 25.00 N ATOM 0 H GLN A 82 -10.152 -9.404 0.393 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.564 -9.059 -1.228 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -12.063 -7.893 1.584 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.434 -7.463 0.581 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -12.949 -10.295 1.566 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.867 -9.115 2.481 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -14.188 -11.668 0.467 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.769 -11.298 -0.229 1.00 25.00 H new ATOM 1127 N ASP A 83 -10.086 -7.072 -0.511 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.463 -5.761 -0.722 1.00 25.00 C ATOM 1129 C ASP A 83 -8.480 -5.760 -1.892 1.00 25.00 C ATOM 1130 O ASP A 83 -7.987 -6.805 -2.311 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.746 -5.316 0.566 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.704 -5.094 1.728 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.931 -5.020 1.520 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -9.248 -5.002 2.893 1.00 50.00 O ATOM 0 H ASP A 83 -9.494 -7.740 -0.017 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.258 -5.059 -0.972 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -8.011 -6.070 0.846 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -8.198 -4.394 0.371 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.215 -4.573 -2.430 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.378 -4.419 -3.625 1.00 25.00 C ATOM 1141 C LYS A 84 -6.321 -3.333 -3.439 1.00 25.00 C ATOM 1142 O LYS A 84 -6.553 -2.348 -2.741 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.295 -4.054 -4.806 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.711 -4.312 -6.184 1.00 25.00 C ATOM 1145 CD LYS A 84 -7.654 -5.799 -6.492 1.00 25.00 C ATOM 1146 CE LYS A 84 -7.021 -6.030 -7.843 1.00 25.00 C ATOM 1147 NZ LYS A 84 -6.902 -7.492 -8.139 1.00 25.00 N ATOM 0 H LYS A 84 -8.570 -3.693 -2.056 1.00 25.00 H new ATOM 0 HA LYS A 84 -6.852 -5.355 -3.813 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.223 -4.617 -4.712 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.554 -2.998 -4.731 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.315 -3.806 -6.937 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.708 -3.888 -6.241 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -7.081 -6.315 -5.721 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -8.660 -6.219 -6.477 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -7.619 -5.547 -8.616 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -6.034 -5.569 -7.869 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -6.624 -7.624 -9.133 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -6.181 -7.914 -7.519 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -7.818 -7.956 -7.971 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.174 -3.497 -4.085 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.104 -2.489 -4.044 1.00 25.00 C ATOM 1163 C ILE A 85 -3.739 -2.065 -5.472 1.00 25.00 C ATOM 1164 O ILE A 85 -3.238 -2.871 -6.262 1.00 25.00 O ATOM 1165 CB ILE A 85 -2.814 -3.019 -3.326 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.164 -3.623 -1.950 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -1.797 -1.860 -3.140 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -1.989 -4.319 -1.229 1.00 25.00 C ATOM 0 H ILE A 85 -4.953 -4.319 -4.647 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.482 -1.640 -3.474 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.371 -3.797 -3.948 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.547 -2.830 -1.308 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -3.970 -4.345 -2.080 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -0.904 -2.236 -2.641 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.524 -1.455 -4.115 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.248 -1.074 -2.534 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.331 -4.712 -0.271 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -1.618 -5.138 -1.845 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.188 -3.599 -1.061 1.00 25.00 H new ATOM 1180 N ASP A 86 -3.971 -0.803 -5.795 1.00 25.00 N ATOM 1181 CA ASP A 86 -3.663 -0.279 -7.119 1.00 25.00 C ATOM 1182 C ASP A 86 -2.285 0.363 -7.107 1.00 25.00 C ATOM 1183 O ASP A 86 -2.054 1.356 -6.417 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.706 0.747 -7.556 1.00 25.00 C ATOM 1185 CG ASP A 86 -6.019 0.111 -7.993 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -6.057 -1.111 -8.262 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -6.990 0.874 -8.170 1.00 25.00 O ATOM 0 H ASP A 86 -4.374 -0.118 -5.156 1.00 25.00 H new ATOM 0 HA ASP A 86 -3.676 -1.106 -7.829 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -4.898 1.435 -6.733 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -4.304 1.338 -8.378 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.376 -0.208 -7.888 1.00 25.00 N ATOM 1193 CA VAL A 87 0.016 0.265 -7.976 1.00 25.00 C ATOM 1194 C VAL A 87 0.361 0.575 -9.433 1.00 25.00 C ATOM 1195 O VAL A 87 1.511 0.491 -9.864 1.00 25.00 O ATOM 1196 CB VAL A 87 1.001 -0.794 -7.392 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.791 -0.938 -5.885 1.00 25.00 C ATOM 1198 CG2 VAL A 87 0.806 -2.167 -8.072 1.00 25.00 C ATOM 0 H VAL A 87 -1.575 -1.013 -8.482 1.00 25.00 H new ATOM 0 HA VAL A 87 0.116 1.175 -7.384 1.00 25.00 H new ATOM 0 HB VAL A 87 2.016 -0.449 -7.586 1.00 25.00 H new ATOM 0 HG11 VAL A 87 1.485 -1.680 -5.490 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.971 0.021 -5.399 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.232 -1.258 -5.689 1.00 25.00 H new ATOM 0 HG21 VAL A 87 1.505 -2.887 -7.646 1.00 25.00 H new ATOM 0 HG22 VAL A 87 -0.215 -2.512 -7.908 1.00 25.00 H new ATOM 0 HG23 VAL A 87 0.990 -2.072 -9.142 1.00 25.00 H new ATOM 1208 N SER A 88 -0.662 0.937 -10.193 1.00 25.00 N ATOM 1209 CA SER A 88 -0.546 1.211 -11.629 1.00 25.00 C ATOM 1210 C SER A 88 0.158 2.530 -11.984 1.00 25.00 C ATOM 1211 O SER A 88 -0.035 3.065 -13.066 1.00 25.00 O ATOM 1212 CB SER A 88 -1.957 1.239 -12.206 1.00 25.00 C ATOM 1213 OG SER A 88 -2.877 0.773 -11.231 1.00 25.00 O ATOM 0 H SER A 88 -1.609 1.052 -9.832 1.00 25.00 H new ATOM 0 HA SER A 88 0.078 0.423 -12.051 1.00 25.00 H new ATOM 0 HB2 SER A 88 -2.216 2.253 -12.511 1.00 25.00 H new ATOM 0 HB3 SER A 88 -2.009 0.615 -13.098 1.00 25.00 H new ATOM 0 HG SER A 88 -3.784 0.793 -11.601 1.00 25.00 H new ATOM 1219 N ALA A 89 0.955 3.057 -11.066 1.00 25.00 N ATOM 1220 CA ALA A 89 1.659 4.318 -11.282 1.00 25.00 C ATOM 1221 C ALA A 89 2.695 4.177 -12.392 1.00 25.00 C ATOM 1222 O ALA A 89 2.875 5.063 -13.216 1.00 25.00 O ATOM 1223 CB ALA A 89 2.343 4.748 -9.992 1.00 25.00 C ATOM 0 H ALA A 89 1.133 2.629 -10.157 1.00 25.00 H new ATOM 0 HA ALA A 89 0.933 5.074 -11.582 1.00 25.00 H new ATOM 0 HB1 ALA A 89 2.868 5.689 -10.155 1.00 25.00 H new ATOM 0 HB2 ALA A 89 1.595 4.880 -9.210 1.00 25.00 H new ATOM 0 HB3 ALA A 89 3.056 3.983 -9.686 1.00 25.00 H new ATOM 1229 N LEU A 90 3.372 3.038 -12.377 1.00 25.00 N ATOM 1230 CA LEU A 90 4.374 2.680 -13.392 1.00 25.00 C ATOM 1231 C LEU A 90 4.021 1.273 -13.831 1.00 25.00 C ATOM 1232 O LEU A 90 4.030 0.936 -15.010 1.00 25.00 O ATOM 1233 CB LEU A 90 5.799 2.662 -12.798 1.00 25.00 C ATOM 1234 CG LEU A 90 6.218 3.846 -11.917 1.00 25.00 C ATOM 1235 CD1 LEU A 90 7.546 3.531 -11.237 1.00 25.00 C ATOM 1236 CD2 LEU A 90 6.349 5.155 -12.709 1.00 25.00 C ATOM 0 H LEU A 90 3.246 2.325 -11.658 1.00 25.00 H new ATOM 0 HA LEU A 90 4.365 3.403 -14.207 1.00 25.00 H new ATOM 0 HB2 LEU A 90 5.906 1.751 -12.209 1.00 25.00 H new ATOM 0 HB3 LEU A 90 6.506 2.592 -13.624 1.00 25.00 H new ATOM 0 HG LEU A 90 5.432 3.991 -11.176 1.00 25.00 H new ATOM 0 HD11 LEU A 90 7.843 4.373 -10.611 1.00 25.00 H new ATOM 0 HD12 LEU A 90 7.436 2.640 -10.619 1.00 25.00 H new ATOM 0 HD13 LEU A 90 8.310 3.355 -11.994 1.00 25.00 H new ATOM 0 HD21 LEU A 90 6.648 5.959 -12.036 1.00 25.00 H new ATOM 0 HD22 LEU A 90 7.102 5.035 -13.488 1.00 25.00 H new ATOM 0 HD23 LEU A 90 5.391 5.401 -13.166 1.00 25.00 H new ATOM 1248 N GLY A 91 3.690 0.468 -12.833 1.00 25.00 N ATOM 1249 CA GLY A 91 3.362 -0.925 -13.045 1.00 25.00 C ATOM 1250 C GLY A 91 4.597 -1.754 -12.778 1.00 25.00 C ATOM 1251 O GLY A 91 5.682 -1.203 -12.641 1.00 25.00 O ATOM 0 H GLY A 91 3.643 0.765 -11.858 1.00 25.00 H new ATOM 0 HA2 GLY A 91 2.551 -1.228 -12.382 1.00 25.00 H new ATOM 0 HA3 GLY A 91 3.014 -1.081 -14.066 1.00 25.00 H new ATOM 1327 N ASN A 97 10.963 -10.972 -8.388 1.00 25.00 N ATOM 1328 CA ASN A 97 12.404 -10.699 -8.189 1.00 25.00 C ATOM 1329 C ASN A 97 12.746 -9.432 -7.394 1.00 25.00 C ATOM 1330 O ASN A 97 13.805 -9.358 -6.787 1.00 25.00 O ATOM 1331 CB ASN A 97 13.111 -10.645 -9.546 1.00 25.00 C ATOM 1332 CG ASN A 97 12.869 -11.875 -10.367 1.00 25.00 C ATOM 1333 OD1 ASN A 97 11.973 -11.914 -11.199 1.00 25.00 O ATOM 1334 ND2 ASN A 97 13.649 -12.894 -10.136 1.00 25.00 N ATOM 0 HA ASN A 97 12.757 -11.527 -7.574 1.00 25.00 H new ATOM 0 HB2 ASN A 97 12.766 -9.770 -10.097 1.00 25.00 H new ATOM 0 HB3 ASN A 97 14.183 -10.521 -9.389 1.00 25.00 H new ATOM 0 HD21 ASN A 97 13.523 -13.762 -10.657 1.00 25.00 H new ATOM 0 HD22 ASN A 97 14.386 -12.824 -9.434 1.00 25.00 H new ATOM 1341 N GLY A 98 11.869 -8.439 -7.400 1.00 25.00 N ATOM 1342 CA GLY A 98 12.107 -7.220 -6.633 1.00 25.00 C ATOM 1343 C GLY A 98 13.086 -6.234 -7.252 1.00 25.00 C ATOM 1344 O GLY A 98 13.424 -5.231 -6.624 1.00 25.00 O ATOM 0 H GLY A 98 10.993 -8.450 -7.922 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.153 -6.713 -6.485 1.00 25.00 H new ATOM 0 HA3 GLY A 98 12.476 -7.499 -5.646 1.00 25.00 H new ATOM 1348 N TYR A 99 13.555 -6.517 -8.458 1.00 25.00 N ATOM 1349 CA TYR A 99 14.520 -5.661 -9.164 1.00 25.00 C ATOM 1350 C TYR A 99 14.105 -5.627 -10.627 1.00 25.00 C ATOM 1351 O TYR A 99 13.289 -6.446 -11.037 1.00 25.00 O ATOM 1352 CB TYR A 99 15.942 -6.235 -9.061 1.00 25.00 C ATOM 1353 CG TYR A 99 16.529 -6.230 -7.662 1.00 25.00 C ATOM 1354 CD1 TYR A 99 17.199 -5.092 -7.163 1.00 25.00 C ATOM 1355 CD2 TYR A 99 16.440 -7.367 -6.837 1.00 25.00 C ATOM 1356 CE1 TYR A 99 17.779 -5.099 -5.863 1.00 25.00 C ATOM 1357 CE2 TYR A 99 17.008 -7.376 -5.534 1.00 25.00 C ATOM 1358 CZ TYR A 99 17.678 -6.243 -5.067 1.00 25.00 C ATOM 1359 OH TYR A 99 18.227 -6.251 -3.808 1.00 25.00 O ATOM 0 H TYR A 99 13.281 -7.347 -8.983 1.00 25.00 H new ATOM 0 HA TYR A 99 14.524 -4.665 -8.721 1.00 25.00 H new ATOM 0 HB2 TYR A 99 15.933 -7.260 -9.433 1.00 25.00 H new ATOM 0 HB3 TYR A 99 16.598 -5.663 -9.717 1.00 25.00 H new ATOM 0 HD1 TYR A 99 17.272 -4.205 -7.775 1.00 25.00 H new ATOM 0 HD2 TYR A 99 15.931 -8.248 -7.200 1.00 25.00 H new ATOM 0 HE1 TYR A 99 18.294 -4.225 -5.494 1.00 25.00 H new ATOM 0 HE2 TYR A 99 16.922 -8.253 -4.909 1.00 25.00 H new ATOM 0 HH TYR A 99 18.068 -7.122 -3.387 1.00 25.00 H new ATOM 1369 N ALA A 100 14.683 -4.719 -11.408 1.00 25.00 N ATOM 1370 CA ALA A 100 14.413 -4.604 -12.851 1.00 25.00 C ATOM 1371 C ALA A 100 12.917 -4.464 -13.152 1.00 25.00 C ATOM 1372 O ALA A 100 12.377 -5.118 -14.040 1.00 25.00 O ATOM 1373 CB ALA A 100 15.024 -5.809 -13.610 1.00 25.00 C ATOM 0 H ALA A 100 15.357 -4.035 -11.063 1.00 25.00 H new ATOM 0 HA ALA A 100 14.890 -3.689 -13.203 1.00 25.00 H new ATOM 0 HB1 ALA A 100 14.817 -5.711 -14.676 1.00 25.00 H new ATOM 0 HB2 ALA A 100 16.102 -5.831 -13.451 1.00 25.00 H new ATOM 0 HB3 ALA A 100 14.584 -6.734 -13.238 1.00 25.00 H new ATOM 1379 N GLY A 101 12.249 -3.621 -12.382 1.00 25.00 N ATOM 1380 CA GLY A 101 10.842 -3.348 -12.615 1.00 25.00 C ATOM 1381 C GLY A 101 9.901 -4.439 -12.148 1.00 25.00 C ATOM 1382 O GLY A 101 8.757 -4.496 -12.594 1.00 25.00 O ATOM 0 H GLY A 101 12.656 -3.117 -11.594 1.00 25.00 H new ATOM 0 HA2 GLY A 101 10.578 -2.418 -12.111 1.00 25.00 H new ATOM 0 HA3 GLY A 101 10.689 -3.187 -13.682 1.00 25.00 H new ATOM 1386 N THR A 102 10.351 -5.312 -11.260 1.00 25.00 N ATOM 1387 CA THR A 102 9.492 -6.374 -10.731 1.00 25.00 C ATOM 1388 C THR A 102 9.298 -6.196 -9.231 1.00 25.00 C ATOM 1389 O THR A 102 10.105 -5.533 -8.569 1.00 25.00 O ATOM 1390 CB THR A 102 10.088 -7.783 -10.963 1.00 25.00 C ATOM 1391 OG1 THR A 102 11.288 -7.914 -10.210 1.00 25.00 O ATOM 1392 CG2 THR A 102 10.420 -8.029 -12.424 1.00 25.00 C ATOM 0 H THR A 102 11.301 -5.311 -10.888 1.00 25.00 H new ATOM 0 HA THR A 102 8.544 -6.297 -11.263 1.00 25.00 H new ATOM 0 HB THR A 102 9.339 -8.510 -10.650 1.00 25.00 H new ATOM 0 HG1 THR A 102 12.040 -7.559 -10.729 1.00 25.00 H new ATOM 0 HG21 THR A 102 10.836 -9.030 -12.539 1.00 25.00 H new ATOM 0 HG22 THR A 102 9.513 -7.941 -13.023 1.00 25.00 H new ATOM 0 HG23 THR A 102 11.150 -7.292 -12.760 1.00 25.00 H new ATOM 1400 N LEU A 103 8.230 -6.774 -8.709 1.00 25.00 N ATOM 1401 CA LEU A 103 7.914 -6.746 -7.284 1.00 25.00 C ATOM 1402 C LEU A 103 8.512 -7.991 -6.636 1.00 25.00 C ATOM 1403 O LEU A 103 8.975 -8.879 -7.337 1.00 25.00 O ATOM 1404 CB LEU A 103 6.391 -6.757 -7.100 1.00 25.00 C ATOM 1405 CG LEU A 103 5.745 -5.497 -6.501 1.00 25.00 C ATOM 1406 CD1 LEU A 103 4.223 -5.601 -6.606 1.00 25.00 C ATOM 1407 CD2 LEU A 103 6.144 -5.298 -5.040 1.00 25.00 C ATOM 0 H LEU A 103 7.546 -7.284 -9.268 1.00 25.00 H new ATOM 0 HA LEU A 103 8.324 -5.847 -6.824 1.00 25.00 H new ATOM 0 HB2 LEU A 103 5.935 -6.940 -8.073 1.00 25.00 H new ATOM 0 HB3 LEU A 103 6.134 -7.603 -6.463 1.00 25.00 H new ATOM 0 HG LEU A 103 6.102 -4.637 -7.067 1.00 25.00 H new ATOM 0 HD11 LEU A 103 3.767 -4.707 -6.181 1.00 25.00 H new ATOM 0 HD12 LEU A 103 3.936 -5.692 -7.654 1.00 25.00 H new ATOM 0 HD13 LEU A 103 3.880 -6.479 -6.058 1.00 25.00 H new ATOM 0 HD21 LEU A 103 5.668 -4.398 -4.652 1.00 25.00 H new ATOM 0 HD22 LEU A 103 5.823 -6.159 -4.455 1.00 25.00 H new ATOM 0 HD23 LEU A 103 7.227 -5.195 -4.969 1.00 25.00 H new ATOM 1419 N ALA A 104 8.449 -8.047 -5.316 1.00 25.00 N ATOM 1420 CA ALA A 104 8.831 -9.211 -4.509 1.00 25.00 C ATOM 1421 C ALA A 104 8.104 -8.986 -3.184 1.00 25.00 C ATOM 1422 O ALA A 104 7.712 -7.843 -2.890 1.00 25.00 O ATOM 1423 CB ALA A 104 10.345 -9.263 -4.283 1.00 25.00 C ATOM 0 H ALA A 104 8.121 -7.263 -4.752 1.00 25.00 H new ATOM 0 HA ALA A 104 8.569 -10.153 -4.991 1.00 25.00 H new ATOM 0 HB1 ALA A 104 10.593 -10.138 -3.682 1.00 25.00 H new ATOM 0 HB2 ALA A 104 10.854 -9.327 -5.244 1.00 25.00 H new ATOM 0 HB3 ALA A 104 10.666 -8.361 -3.762 1.00 25.00 H new ATOM 1429 N VAL A 105 7.915 -10.034 -2.395 1.00 25.00 N ATOM 1430 CA VAL A 105 7.192 -9.930 -1.135 1.00 25.00 C ATOM 1431 C VAL A 105 7.835 -10.801 -0.044 1.00 25.00 C ATOM 1432 O VAL A 105 8.496 -11.794 -0.332 1.00 25.00 O ATOM 1433 CB VAL A 105 5.689 -10.316 -1.377 1.00 25.00 C ATOM 1434 CG1 VAL A 105 5.507 -11.836 -1.528 1.00 25.00 C ATOM 1435 CG2 VAL A 105 4.772 -9.765 -0.280 1.00 25.00 C ATOM 0 H VAL A 105 8.255 -10.972 -2.607 1.00 25.00 H new ATOM 0 HA VAL A 105 7.241 -8.902 -0.775 1.00 25.00 H new ATOM 0 HB VAL A 105 5.396 -9.850 -2.318 1.00 25.00 H new ATOM 0 HG11 VAL A 105 4.454 -12.062 -1.694 1.00 25.00 H new ATOM 0 HG12 VAL A 105 6.092 -12.190 -2.377 1.00 25.00 H new ATOM 0 HG13 VAL A 105 5.846 -12.335 -0.620 1.00 25.00 H new ATOM 0 HG21 VAL A 105 3.742 -10.055 -0.487 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.076 -10.169 0.685 1.00 25.00 H new ATOM 0 HG23 VAL A 105 4.845 -8.678 -0.257 1.00 25.00 H new ATOM 1445 N SER A 106 7.608 -10.425 1.204 1.00 25.00 N ATOM 1446 CA SER A 106 7.995 -11.209 2.377 1.00 25.00 C ATOM 1447 C SER A 106 6.770 -11.029 3.255 1.00 25.00 C ATOM 1448 O SER A 106 6.113 -10.004 3.129 1.00 25.00 O ATOM 1449 CB SER A 106 9.258 -10.643 3.017 1.00 25.00 C ATOM 1450 OG SER A 106 9.114 -9.248 3.230 1.00 25.00 O ATOM 0 H SER A 106 7.141 -9.550 1.440 1.00 25.00 H new ATOM 0 HA SER A 106 8.242 -12.252 2.177 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.451 -11.145 3.965 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.117 -10.834 2.374 1.00 25.00 H new ATOM 0 HG SER A 106 9.929 -8.894 3.643 1.00 25.00 H new ATOM 1456 N LEU A 107 6.373 -12.040 4.022 1.00 25.00 N ATOM 1457 CA LEU A 107 5.037 -12.029 4.652 1.00 25.00 C ATOM 1458 C LEU A 107 4.952 -12.264 6.157 1.00 25.00 C ATOM 1459 O LEU A 107 5.747 -12.996 6.747 1.00 25.00 O ATOM 1460 CB LEU A 107 4.166 -13.101 3.981 1.00 25.00 C ATOM 1461 CG LEU A 107 3.813 -12.848 2.506 1.00 25.00 C ATOM 1462 CD1 LEU A 107 4.267 -14.015 1.638 1.00 25.00 C ATOM 1463 CD2 LEU A 107 2.300 -12.642 2.374 1.00 25.00 C ATOM 0 H LEU A 107 6.936 -12.866 4.226 1.00 25.00 H new ATOM 0 HA LEU A 107 4.701 -11.003 4.505 1.00 25.00 H new ATOM 0 HB2 LEU A 107 4.682 -14.059 4.053 1.00 25.00 H new ATOM 0 HB3 LEU A 107 3.239 -13.195 4.546 1.00 25.00 H new ATOM 0 HG LEU A 107 4.331 -11.952 2.164 1.00 25.00 H new ATOM 0 HD11 LEU A 107 4.008 -13.817 0.598 1.00 25.00 H new ATOM 0 HD12 LEU A 107 5.347 -14.136 1.727 1.00 25.00 H new ATOM 0 HD13 LEU A 107 3.771 -14.928 1.968 1.00 25.00 H new ATOM 0 HD21 LEU A 107 2.047 -12.462 1.329 1.00 25.00 H new ATOM 0 HD22 LEU A 107 1.779 -13.533 2.725 1.00 25.00 H new ATOM 0 HD23 LEU A 107 1.996 -11.784 2.974 1.00 25.00 H new ATOM 1534 N ARG A 113 4.810 -9.286 9.776 1.00 25.00 N ATOM 1535 CA ARG A 113 4.509 -8.070 8.970 1.00 25.00 C ATOM 1536 C ARG A 113 4.900 -8.392 7.532 1.00 25.00 C ATOM 1537 O ARG A 113 5.854 -9.125 7.284 1.00 25.00 O ATOM 1538 CB ARG A 113 5.214 -6.795 9.453 1.00 25.00 C ATOM 1539 CG ARG A 113 4.999 -6.489 10.935 1.00 25.00 C ATOM 1540 CD ARG A 113 5.881 -5.335 11.373 1.00 25.00 C ATOM 1541 NE ARG A 113 5.805 -5.125 12.828 1.00 25.00 N ATOM 1542 CZ ARG A 113 4.938 -4.329 13.441 1.00 25.00 C ATOM 1543 NH1 ARG A 113 4.041 -3.628 12.797 1.00 25.00 N ATOM 1544 NH2 ARG A 113 4.979 -4.236 14.742 1.00 25.00 N ATOM 0 HA ARG A 113 3.448 -7.842 9.071 1.00 25.00 H new ATOM 0 HB2 ARG A 113 6.283 -6.889 9.263 1.00 25.00 H new ATOM 0 HB3 ARG A 113 4.859 -5.950 8.863 1.00 25.00 H new ATOM 0 HG2 ARG A 113 3.952 -6.242 11.113 1.00 25.00 H new ATOM 0 HG3 ARG A 113 5.224 -7.373 11.531 1.00 25.00 H new ATOM 0 HD2 ARG A 113 6.913 -5.534 11.086 1.00 25.00 H new ATOM 0 HD3 ARG A 113 5.576 -4.425 10.856 1.00 25.00 H new ATOM 0 HE ARG A 113 6.471 -5.631 13.411 1.00 25.00 H new ATOM 0 HH11 ARG A 113 3.987 -3.680 11.780 1.00 25.00 H new ATOM 0 HH12 ARG A 113 3.395 -3.030 13.312 1.00 25.00 H new ATOM 0 HH21 ARG A 113 5.669 -4.770 15.270 1.00 25.00 H new ATOM 0 HH22 ARG A 113 4.321 -3.629 15.231 1.00 25.00 H new ATOM 1558 N THR A 114 4.111 -7.914 6.589 1.00 25.00 N ATOM 1559 CA THR A 114 4.323 -8.211 5.181 1.00 25.00 C ATOM 1560 C THR A 114 4.933 -6.977 4.555 1.00 25.00 C ATOM 1561 O THR A 114 4.457 -5.866 4.769 1.00 25.00 O ATOM 1562 CB THR A 114 2.981 -8.546 4.497 1.00 25.00 C ATOM 1563 OG1 THR A 114 2.418 -9.720 5.098 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.115 -8.803 3.010 1.00 25.00 C ATOM 0 H THR A 114 3.309 -7.312 6.773 1.00 25.00 H new ATOM 0 HA THR A 114 4.980 -9.073 5.062 1.00 25.00 H new ATOM 0 HB THR A 114 2.341 -7.674 4.632 1.00 25.00 H new ATOM 0 HG1 THR A 114 1.542 -9.903 4.700 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.135 -9.033 2.591 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.520 -7.916 2.522 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.787 -9.646 2.845 1.00 25.00 H new ATOM 1572 N TYR A 115 5.984 -7.176 3.782 1.00 25.00 N ATOM 1573 CA TYR A 115 6.652 -6.083 3.092 1.00 25.00 C ATOM 1574 C TYR A 115 6.671 -6.390 1.610 1.00 25.00 C ATOM 1575 O TYR A 115 6.978 -7.507 1.203 1.00 25.00 O ATOM 1576 CB TYR A 115 8.084 -5.905 3.597 1.00 25.00 C ATOM 1577 CG TYR A 115 8.199 -5.843 5.106 1.00 25.00 C ATOM 1578 CD1 TYR A 115 7.662 -4.761 5.836 1.00 25.00 C ATOM 1579 CD2 TYR A 115 8.844 -6.878 5.814 1.00 25.00 C ATOM 1580 CE1 TYR A 115 7.779 -4.715 7.256 1.00 25.00 C ATOM 1581 CE2 TYR A 115 8.956 -6.835 7.221 1.00 25.00 C ATOM 1582 CZ TYR A 115 8.429 -5.754 7.930 1.00 25.00 C ATOM 1583 OH TYR A 115 8.557 -5.712 9.292 1.00 25.00 O ATOM 0 H TYR A 115 6.398 -8.093 3.614 1.00 25.00 H new ATOM 0 HA TYR A 115 6.110 -5.157 3.285 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.694 -6.730 3.230 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.497 -4.990 3.173 1.00 25.00 H new ATOM 0 HD1 TYR A 115 7.158 -3.961 5.314 1.00 25.00 H new ATOM 0 HD2 TYR A 115 9.258 -7.716 5.272 1.00 25.00 H new ATOM 0 HE1 TYR A 115 7.368 -3.883 7.808 1.00 25.00 H new ATOM 0 HE2 TYR A 115 9.449 -7.638 7.748 1.00 25.00 H new ATOM 0 HH TYR A 115 9.033 -6.511 9.601 1.00 25.00 H new ATOM 1593 N LEU A 116 6.331 -5.396 0.810 1.00 25.00 N ATOM 1594 CA LEU A 116 6.321 -5.518 -0.641 1.00 25.00 C ATOM 1595 C LEU A 116 7.468 -4.645 -1.109 1.00 25.00 C ATOM 1596 O LEU A 116 7.544 -3.490 -0.710 1.00 25.00 O ATOM 1597 CB LEU A 116 4.998 -5.000 -1.236 1.00 25.00 C ATOM 1598 CG LEU A 116 3.691 -5.780 -0.972 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.133 -5.577 0.444 1.00 25.00 C ATOM 1600 CD2 LEU A 116 2.631 -5.324 -1.986 1.00 25.00 C ATOM 0 H LEU A 116 6.052 -4.475 1.148 1.00 25.00 H new ATOM 0 HA LEU A 116 6.420 -6.557 -0.955 1.00 25.00 H new ATOM 0 HB2 LEU A 116 4.851 -3.983 -0.872 1.00 25.00 H new ATOM 0 HB3 LEU A 116 5.128 -4.936 -2.316 1.00 25.00 H new ATOM 0 HG LEU A 116 3.926 -6.839 -1.075 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.215 -6.153 0.559 1.00 25.00 H new ATOM 0 HD12 LEU A 116 3.867 -5.913 1.176 1.00 25.00 H new ATOM 0 HD13 LEU A 116 2.920 -4.520 0.603 1.00 25.00 H new ATOM 0 HD21 LEU A 116 1.702 -5.867 -1.811 1.00 25.00 H new ATOM 0 HD22 LEU A 116 2.453 -4.255 -1.871 1.00 25.00 H new ATOM 0 HD23 LEU A 116 2.984 -5.526 -2.997 1.00 25.00 H new ATOM 1612 N LYS A 117 8.371 -5.190 -1.912 1.00 25.00 N ATOM 1613 CA LYS A 117 9.555 -4.445 -2.352 1.00 25.00 C ATOM 1614 C LYS A 117 9.736 -4.534 -3.855 1.00 25.00 C ATOM 1615 O LYS A 117 9.699 -5.612 -4.419 1.00 25.00 O ATOM 1616 CB LYS A 117 10.805 -4.992 -1.639 1.00 25.00 C ATOM 1617 CG LYS A 117 12.080 -4.180 -1.884 1.00 25.00 C ATOM 1618 CD LYS A 117 12.961 -4.778 -2.984 1.00 25.00 C ATOM 1619 CE LYS A 117 14.110 -3.835 -3.306 1.00 25.00 C ATOM 1620 NZ LYS A 117 14.985 -4.420 -4.370 1.00 25.00 N ATOM 0 H LYS A 117 8.312 -6.142 -2.274 1.00 25.00 H new ATOM 0 HA LYS A 117 9.414 -3.396 -2.093 1.00 25.00 H new ATOM 0 HB2 LYS A 117 10.611 -5.026 -0.567 1.00 25.00 H new ATOM 0 HB3 LYS A 117 10.974 -6.018 -1.965 1.00 25.00 H new ATOM 0 HG2 LYS A 117 11.809 -3.160 -2.156 1.00 25.00 H new ATOM 0 HG3 LYS A 117 12.652 -4.122 -0.958 1.00 25.00 H new ATOM 0 HD2 LYS A 117 13.352 -5.743 -2.662 1.00 25.00 H new ATOM 0 HD3 LYS A 117 12.366 -4.957 -3.880 1.00 25.00 H new ATOM 0 HE2 LYS A 117 13.717 -2.874 -3.637 1.00 25.00 H new ATOM 0 HE3 LYS A 117 14.697 -3.647 -2.407 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 15.649 -3.696 -4.710 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 15.518 -5.223 -3.979 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 14.396 -4.749 -5.162 1.00 25.00 H new ATOM 1634 N SER A 118 9.982 -3.398 -4.482 1.00 25.00 N ATOM 1635 CA SER A 118 10.265 -3.356 -5.906 1.00 25.00 C ATOM 1636 C SER A 118 11.340 -2.320 -6.147 1.00 25.00 C ATOM 1637 O SER A 118 11.495 -1.386 -5.363 1.00 25.00 O ATOM 1638 CB SER A 118 9.011 -2.977 -6.687 1.00 25.00 C ATOM 1639 OG SER A 118 9.266 -3.027 -8.077 1.00 25.00 O ATOM 0 H SER A 118 9.992 -2.486 -4.024 1.00 25.00 H new ATOM 0 HA SER A 118 10.598 -4.338 -6.242 1.00 25.00 H new ATOM 0 HB2 SER A 118 8.198 -3.657 -6.435 1.00 25.00 H new ATOM 0 HB3 SER A 118 8.688 -1.975 -6.405 1.00 25.00 H new ATOM 0 HG SER A 118 9.837 -3.798 -8.277 1.00 25.00 H new ATOM 1645 N TYR A 119 12.073 -2.477 -7.235 1.00 25.00 N ATOM 1646 CA TYR A 119 13.088 -1.518 -7.647 1.00 25.00 C ATOM 1647 C TYR A 119 13.047 -1.407 -9.163 1.00 25.00 C ATOM 1648 O TYR A 119 13.145 -2.410 -9.878 1.00 25.00 O ATOM 1649 CB TYR A 119 14.478 -1.958 -7.181 1.00 25.00 C ATOM 1650 CG TYR A 119 15.581 -1.078 -7.724 1.00 25.00 C ATOM 1651 CD1 TYR A 119 15.791 0.223 -7.213 1.00 25.00 C ATOM 1652 CD2 TYR A 119 16.417 -1.533 -8.767 1.00 25.00 C ATOM 1653 CE1 TYR A 119 16.818 1.055 -7.743 1.00 25.00 C ATOM 1654 CE2 TYR A 119 17.443 -0.704 -9.291 1.00 25.00 C ATOM 1655 CZ TYR A 119 17.629 0.585 -8.777 1.00 25.00 C ATOM 1656 OH TYR A 119 18.617 1.383 -9.293 1.00 25.00 O ATOM 0 H TYR A 119 11.982 -3.276 -7.862 1.00 25.00 H new ATOM 0 HA TYR A 119 12.884 -0.549 -7.192 1.00 25.00 H new ATOM 0 HB2 TYR A 119 14.512 -1.946 -6.092 1.00 25.00 H new ATOM 0 HB3 TYR A 119 14.653 -2.987 -7.494 1.00 25.00 H new ATOM 0 HD1 TYR A 119 15.166 0.590 -6.412 1.00 25.00 H new ATOM 0 HD2 TYR A 119 16.274 -2.524 -9.171 1.00 25.00 H new ATOM 0 HE1 TYR A 119 16.969 2.048 -7.346 1.00 25.00 H new ATOM 0 HE2 TYR A 119 18.079 -1.067 -10.085 1.00 25.00 H new ATOM 0 HH TYR A 119 19.088 0.902 -10.005 1.00 25.00 H new ATOM 1758 N SER A 127 13.392 2.782 -5.585 1.00 25.00 N ATOM 1759 CA SER A 127 12.687 1.701 -4.892 1.00 25.00 C ATOM 1760 C SER A 127 11.276 2.141 -4.528 1.00 25.00 C ATOM 1761 O SER A 127 11.065 3.237 -3.998 1.00 25.00 O ATOM 1762 CB SER A 127 13.431 1.317 -3.614 1.00 25.00 C ATOM 1763 OG SER A 127 14.762 0.925 -3.908 1.00 25.00 O ATOM 0 HA SER A 127 12.641 0.841 -5.560 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.439 2.161 -2.924 1.00 25.00 H new ATOM 0 HB3 SER A 127 12.908 0.502 -3.114 1.00 25.00 H new ATOM 0 HG SER A 127 15.223 0.684 -3.077 1.00 25.00 H new ATOM 1769 N PHE A 128 10.315 1.278 -4.787 1.00 25.00 N ATOM 1770 CA PHE A 128 8.918 1.540 -4.468 1.00 25.00 C ATOM 1771 C PHE A 128 8.454 0.364 -3.627 1.00 25.00 C ATOM 1772 O PHE A 128 8.620 -0.792 -4.016 1.00 25.00 O ATOM 1773 CB PHE A 128 8.099 1.698 -5.745 1.00 25.00 C ATOM 1774 CG PHE A 128 8.562 2.844 -6.614 1.00 25.00 C ATOM 1775 CD1 PHE A 128 8.107 4.154 -6.365 1.00 25.00 C ATOM 1776 CD2 PHE A 128 9.472 2.628 -7.677 1.00 25.00 C ATOM 1777 CE1 PHE A 128 8.554 5.237 -7.162 1.00 25.00 C ATOM 1778 CE2 PHE A 128 9.925 3.703 -8.482 1.00 25.00 C ATOM 1779 CZ PHE A 128 9.464 5.010 -8.221 1.00 25.00 C ATOM 0 H PHE A 128 10.477 0.371 -5.226 1.00 25.00 H new ATOM 0 HA PHE A 128 8.790 2.472 -3.918 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.151 0.772 -6.318 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.053 1.851 -5.481 1.00 25.00 H new ATOM 0 HD1 PHE A 128 7.411 4.334 -5.559 1.00 25.00 H new ATOM 0 HD2 PHE A 128 9.827 1.628 -7.878 1.00 25.00 H new ATOM 0 HE1 PHE A 128 8.199 6.237 -6.961 1.00 25.00 H new ATOM 0 HE2 PHE A 128 10.619 3.522 -9.290 1.00 25.00 H new ATOM 0 HZ PHE A 128 9.805 5.836 -8.828 1.00 25.00 H new ATOM 1789 N GLU A 129 8.039 0.657 -2.400 1.00 25.00 N ATOM 1790 CA GLU A 129 7.827 -0.383 -1.394 1.00 25.00 C ATOM 1791 C GLU A 129 6.582 -0.057 -0.567 1.00 25.00 C ATOM 1792 O GLU A 129 6.230 1.113 -0.421 1.00 25.00 O ATOM 1793 CB GLU A 129 9.064 -0.466 -0.481 1.00 25.00 C ATOM 1794 CG GLU A 129 10.386 -0.693 -1.246 1.00 25.00 C ATOM 1795 CD GLU A 129 11.594 -0.852 -0.334 1.00 25.00 C ATOM 1796 OE1 GLU A 129 11.529 -1.641 0.633 1.00 25.00 O ATOM 1797 OE2 GLU A 129 12.602 -0.159 -0.566 1.00 25.00 O ATOM 0 H GLU A 129 7.842 1.604 -2.076 1.00 25.00 H new ATOM 0 HA GLU A 129 7.678 -1.344 -1.886 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.142 0.456 0.095 1.00 25.00 H new ATOM 0 HB3 GLU A 129 8.924 -1.277 0.233 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.289 -1.584 -1.867 1.00 25.00 H new ATOM 0 HG3 GLU A 129 10.556 0.147 -1.919 1.00 25.00 H new ATOM 1804 N LEU A 130 5.927 -1.082 -0.035 1.00 25.00 N ATOM 1805 CA LEU A 130 4.707 -0.931 0.774 1.00 25.00 C ATOM 1806 C LEU A 130 4.771 -1.923 1.929 1.00 25.00 C ATOM 1807 O LEU A 130 5.588 -2.842 1.894 1.00 25.00 O ATOM 1808 CB LEU A 130 3.451 -1.231 -0.060 1.00 25.00 C ATOM 1809 CG LEU A 130 3.125 -0.275 -1.215 1.00 25.00 C ATOM 1810 CD1 LEU A 130 3.578 -0.848 -2.565 1.00 25.00 C ATOM 1811 CD2 LEU A 130 1.622 -0.003 -1.244 1.00 25.00 C ATOM 0 H LEU A 130 6.223 -2.051 -0.149 1.00 25.00 H new ATOM 0 HA LEU A 130 4.649 0.096 1.136 1.00 25.00 H new ATOM 0 HB2 LEU A 130 3.552 -2.235 -0.472 1.00 25.00 H new ATOM 0 HB3 LEU A 130 2.595 -1.248 0.615 1.00 25.00 H new ATOM 0 HG LEU A 130 3.667 0.656 -1.049 1.00 25.00 H new ATOM 0 HD11 LEU A 130 3.331 -0.144 -3.360 1.00 25.00 H new ATOM 0 HD12 LEU A 130 4.655 -1.012 -2.547 1.00 25.00 H new ATOM 0 HD13 LEU A 130 3.070 -1.795 -2.747 1.00 25.00 H new ATOM 0 HD21 LEU A 130 1.391 0.676 -2.065 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.085 -0.941 -1.387 1.00 25.00 H new ATOM 0 HD23 LEU A 130 1.316 0.450 -0.301 1.00 25.00 H new ATOM 1823 N ALA A 131 3.907 -1.776 2.924 1.00 25.00 N ATOM 1824 CA ALA A 131 3.849 -2.729 4.032 1.00 25.00 C ATOM 1825 C ALA A 131 2.401 -3.030 4.441 1.00 25.00 C ATOM 1826 O ALA A 131 1.522 -2.175 4.333 1.00 25.00 O ATOM 1827 CB ALA A 131 4.638 -2.179 5.223 1.00 25.00 C ATOM 0 H ALA A 131 3.237 -1.010 2.990 1.00 25.00 H new ATOM 0 HA ALA A 131 4.296 -3.667 3.702 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.594 -2.890 6.048 1.00 25.00 H new ATOM 0 HB2 ALA A 131 5.677 -2.025 4.931 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.206 -1.230 5.539 1.00 25.00 H new ATOM 1833 N LEU A 132 2.176 -4.242 4.929 1.00 25.00 N ATOM 1834 CA LEU A 132 0.881 -4.664 5.457 1.00 25.00 C ATOM 1835 C LEU A 132 1.131 -5.313 6.818 1.00 25.00 C ATOM 1836 O LEU A 132 1.762 -6.369 6.912 1.00 25.00 O ATOM 1837 CB LEU A 132 0.190 -5.679 4.530 1.00 25.00 C ATOM 1838 CG LEU A 132 0.024 -5.339 3.041 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.480 -6.572 2.283 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.934 -4.198 2.828 1.00 25.00 C ATOM 0 H LEU A 132 2.891 -4.968 4.971 1.00 25.00 H new ATOM 0 HA LEU A 132 0.226 -3.797 5.537 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.747 -6.614 4.593 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.803 -5.871 4.936 1.00 25.00 H new ATOM 0 HG LEU A 132 1.000 -5.034 2.662 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.597 -6.327 1.227 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.239 -7.384 2.390 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.441 -6.883 2.692 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -1.022 -3.991 1.761 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.912 -4.465 3.228 1.00 25.00 H new ATOM 0 HD23 LEU A 132 -0.563 -3.311 3.341 1.00 25.00 H new ATOM 1852 N ASP A 133 0.659 -4.676 7.871 1.00 25.00 N ATOM 1853 CA ASP A 133 0.778 -5.219 9.222 1.00 25.00 C ATOM 1854 C ASP A 133 -0.510 -6.006 9.425 1.00 25.00 C ATOM 1855 O ASP A 133 -1.483 -5.764 8.721 1.00 25.00 O ATOM 1856 CB ASP A 133 0.847 -4.082 10.255 1.00 25.00 C ATOM 1857 CG ASP A 133 2.139 -3.285 10.169 1.00 25.00 C ATOM 1858 OD1 ASP A 133 3.221 -3.907 10.076 1.00 25.00 O ATOM 1859 OD2 ASP A 133 2.094 -2.042 10.299 1.00 25.00 O ATOM 0 H ASP A 133 0.185 -3.774 7.822 1.00 25.00 H new ATOM 0 HA ASP A 133 1.676 -5.824 9.344 1.00 25.00 H new ATOM 0 HB2 ASP A 133 0.001 -3.411 10.107 1.00 25.00 H new ATOM 0 HB3 ASP A 133 0.750 -4.501 11.257 1.00 25.00 H new ATOM 1864 N GLY A 134 -0.503 -6.970 10.346 1.00 25.00 N ATOM 1865 CA GLY A 134 -1.704 -7.761 10.623 1.00 25.00 C ATOM 1866 C GLY A 134 -2.233 -8.521 9.411 1.00 25.00 C ATOM 1867 O GLY A 134 -3.385 -8.919 9.354 1.00 25.00 O ATOM 0 H GLY A 134 0.311 -7.221 10.908 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -1.484 -8.473 11.419 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -2.486 -7.099 10.995 1.00 25.00 H new ATOM 1871 N ASN A 135 -1.382 -8.676 8.414 1.00 25.00 N ATOM 1872 CA ASN A 135 -1.778 -9.267 7.157 1.00 25.00 C ATOM 1873 C ASN A 135 -2.129 -10.747 7.312 1.00 25.00 C ATOM 1874 O ASN A 135 -1.377 -11.511 7.905 1.00 25.00 O ATOM 1875 CB ASN A 135 -0.631 -9.100 6.163 1.00 25.00 C ATOM 1876 CG ASN A 135 -0.992 -9.532 4.767 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -0.212 -10.201 4.105 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -2.152 -9.145 4.306 1.00 25.00 N ATOM 0 H ASN A 135 -0.402 -8.396 8.456 1.00 25.00 H new ATOM 0 HA ASN A 135 -2.674 -8.761 6.796 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -0.323 -8.055 6.145 1.00 25.00 H new ATOM 0 HB3 ASN A 135 0.226 -9.679 6.506 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -2.436 -9.401 3.360 1.00 25.00 H new ATOM 0 HD22 ASN A 135 -2.773 -8.587 4.892 1.00 25.00 H new ATOM 1885 N HIS A 136 -3.252 -11.141 6.726 1.00 25.00 N ATOM 1886 CA HIS A 136 -3.698 -12.534 6.706 1.00 25.00 C ATOM 1887 C HIS A 136 -2.851 -13.369 5.745 1.00 25.00 C ATOM 1888 O HIS A 136 -3.315 -13.766 4.683 1.00 25.00 O ATOM 1889 CB HIS A 136 -5.166 -12.617 6.281 1.00 25.00 C ATOM 1890 CG HIS A 136 -6.107 -11.897 7.196 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -6.564 -10.618 7.001 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -6.715 -12.315 8.334 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -7.404 -10.318 7.989 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -7.540 -11.323 8.833 1.00 25.00 N ATOM 0 H HIS A 136 -3.886 -10.501 6.247 1.00 25.00 H new ATOM 0 HA HIS A 136 -3.585 -12.932 7.714 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -5.266 -12.206 5.277 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -5.459 -13.665 6.227 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -6.304 -10.002 6.230 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -6.575 -13.285 8.787 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -7.911 -9.370 8.088 1.00 25.00 H new ATOM 1902 N ALA A 137 -1.616 -13.652 6.132 1.00 25.00 N ATOM 1903 CA ALA A 137 -0.728 -14.483 5.329 1.00 25.00 C ATOM 1904 C ALA A 137 -1.280 -15.908 5.256 1.00 25.00 C ATOM 1905 O ALA A 137 -1.042 -16.624 4.298 1.00 25.00 O ATOM 1906 CB ALA A 137 0.669 -14.473 5.941 1.00 25.00 C ATOM 0 H ALA A 137 -1.203 -13.317 7.002 1.00 25.00 H new ATOM 0 HA ALA A 137 -0.667 -14.086 4.316 1.00 25.00 H new ATOM 0 HB1 ALA A 137 1.334 -15.094 5.341 1.00 25.00 H new ATOM 0 HB2 ALA A 137 1.049 -13.452 5.963 1.00 25.00 H new ATOM 0 HB3 ALA A 137 0.624 -14.866 6.957 1.00 25.00 H new ATOM 1912 N ALA A 138 -2.067 -16.284 6.255 1.00 25.00 N ATOM 1913 CA ALA A 138 -2.712 -17.592 6.280 1.00 25.00 C ATOM 1914 C ALA A 138 -3.670 -17.774 5.096 1.00 25.00 C ATOM 1915 O ALA A 138 -3.937 -18.892 4.681 1.00 25.00 O ATOM 1916 CB ALA A 138 -3.474 -17.762 7.605 1.00 25.00 C ATOM 0 H ALA A 138 -2.276 -15.699 7.064 1.00 25.00 H new ATOM 0 HA ALA A 138 -1.938 -18.355 6.197 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -3.956 -18.739 7.625 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -2.776 -17.685 8.439 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -4.231 -16.982 7.692 1.00 25.00 H new ATOM 1922 N THR A 139 -4.187 -16.671 4.569 1.00 25.00 N ATOM 1923 CA THR A 139 -5.095 -16.707 3.416 1.00 25.00 C ATOM 1924 C THR A 139 -4.583 -15.772 2.325 1.00 25.00 C ATOM 1925 O THR A 139 -5.367 -15.099 1.642 1.00 25.00 O ATOM 1926 CB THR A 139 -6.534 -16.303 3.826 1.00 25.00 C ATOM 1927 OG1 THR A 139 -6.516 -15.027 4.472 1.00 25.00 O ATOM 1928 CG2 THR A 139 -7.131 -17.307 4.809 1.00 25.00 C ATOM 0 H THR A 139 -3.995 -15.733 4.920 1.00 25.00 H new ATOM 0 HA THR A 139 -5.124 -17.728 3.036 1.00 25.00 H new ATOM 0 HB THR A 139 -7.135 -16.274 2.917 1.00 25.00 H new ATOM 0 HG1 THR A 139 -7.428 -14.777 4.727 1.00 25.00 H new ATOM 0 HG21 THR A 139 -8.141 -16.997 5.078 1.00 25.00 H new ATOM 0 HG22 THR A 139 -7.166 -18.293 4.346 1.00 25.00 H new ATOM 0 HG23 THR A 139 -6.513 -17.349 5.706 1.00 25.00 H new ATOM 1936 N LEU A 140 -3.262 -15.712 2.180 1.00 25.00 N ATOM 1937 CA LEU A 140 -2.634 -14.812 1.213 1.00 25.00 C ATOM 1938 C LEU A 140 -3.098 -15.086 -0.216 1.00 25.00 C ATOM 1939 O LEU A 140 -3.542 -16.180 -0.556 1.00 25.00 O ATOM 1940 CB LEU A 140 -1.092 -14.912 1.298 1.00 25.00 C ATOM 1941 CG LEU A 140 -0.385 -16.200 0.805 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.101 -16.185 -0.717 1.00 25.00 C ATOM 1943 CD2 LEU A 140 0.951 -16.350 1.532 1.00 25.00 C ATOM 0 H LEU A 140 -2.604 -16.275 2.719 1.00 25.00 H new ATOM 0 HA LEU A 140 -2.944 -13.800 1.472 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -0.678 -14.076 0.734 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -0.812 -14.764 2.341 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.058 -17.031 1.017 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.395 -17.112 -1.004 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -1.041 -16.093 -1.262 1.00 25.00 H new ATOM 0 HD13 LEU A 140 0.543 -15.339 -0.959 1.00 25.00 H new ATOM 0 HD21 LEU A 140 1.452 -17.255 1.189 1.00 25.00 H new ATOM 0 HD22 LEU A 140 1.579 -15.485 1.321 1.00 25.00 H new ATOM 0 HD23 LEU A 140 0.775 -16.418 2.606 1.00 25.00 H new ATOM 1955 N SER A 141 -2.922 -14.090 -1.068 1.00 25.00 N ATOM 1956 CA SER A 141 -3.178 -14.233 -2.492 1.00 25.00 C ATOM 1957 C SER A 141 -2.208 -13.329 -3.210 1.00 25.00 C ATOM 1958 O SER A 141 -1.875 -12.251 -2.719 1.00 25.00 O ATOM 1959 CB SER A 141 -4.610 -13.840 -2.843 1.00 25.00 C ATOM 1960 OG SER A 141 -4.828 -13.925 -4.243 1.00 25.00 O ATOM 0 H SER A 141 -2.599 -13.162 -0.794 1.00 25.00 H new ATOM 0 HA SER A 141 -3.048 -15.274 -2.790 1.00 25.00 H new ATOM 0 HB2 SER A 141 -5.309 -14.493 -2.321 1.00 25.00 H new ATOM 0 HB3 SER A 141 -4.807 -12.824 -2.501 1.00 25.00 H new ATOM 0 HG SER A 141 -5.752 -13.671 -4.446 1.00 25.00 H new ATOM 1966 N ALA A 142 -1.744 -13.763 -4.364 1.00 25.00 N ATOM 1967 CA ALA A 142 -0.821 -12.961 -5.148 1.00 25.00 C ATOM 1968 C ALA A 142 -1.609 -11.959 -5.997 1.00 25.00 C ATOM 1969 O ALA A 142 -1.063 -10.991 -6.508 1.00 25.00 O ATOM 1970 CB ALA A 142 0.042 -13.877 -6.023 1.00 25.00 C ATOM 0 H ALA A 142 -1.988 -14.662 -4.780 1.00 25.00 H new ATOM 0 HA ALA A 142 -0.159 -12.402 -4.487 1.00 25.00 H new ATOM 0 HB1 ALA A 142 0.734 -13.273 -6.610 1.00 25.00 H new ATOM 0 HB2 ALA A 142 0.606 -14.561 -5.388 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -0.599 -14.449 -6.693 1.00 25.00 H new ATOM 1976 N GLY A 143 -2.904 -12.204 -6.128 1.00 25.00 N ATOM 1977 CA GLY A 143 -3.758 -11.390 -6.982 1.00 25.00 C ATOM 1978 C GLY A 143 -4.302 -10.112 -6.364 1.00 25.00 C ATOM 1979 O GLY A 143 -5.161 -9.472 -6.966 1.00 25.00 O ATOM 0 H GLY A 143 -3.389 -12.964 -5.651 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -3.195 -11.125 -7.877 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -4.601 -12.000 -7.305 1.00 25.00 H new ATOM 1983 N ASN A 144 -3.814 -9.719 -5.195 1.00 25.00 N ATOM 1984 CA ASN A 144 -4.288 -8.492 -4.536 1.00 25.00 C ATOM 1985 C ASN A 144 -3.902 -7.231 -5.311 1.00 25.00 C ATOM 1986 O ASN A 144 -4.525 -6.183 -5.159 1.00 25.00 O ATOM 1987 CB ASN A 144 -3.712 -8.387 -3.125 1.00 25.00 C ATOM 1988 CG ASN A 144 -4.310 -9.382 -2.186 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -5.506 -9.492 -2.077 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -3.482 -10.121 -1.503 1.00 25.00 N ATOM 0 H ASN A 144 -3.093 -10.224 -4.679 1.00 25.00 H new ATOM 0 HA ASN A 144 -5.375 -8.560 -4.501 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -2.633 -8.534 -3.165 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -3.883 -7.381 -2.741 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -3.840 -10.819 -0.851 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -2.476 -10.001 -1.620 1.00 25.00 H new ATOM 1997 N ILE A 145 -2.871 -7.331 -6.133 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.418 -6.199 -6.934 1.00 25.00 C ATOM 1999 C ILE A 145 -3.306 -6.004 -8.169 1.00 25.00 C ATOM 2000 O ILE A 145 -3.992 -6.925 -8.619 1.00 25.00 O ATOM 2001 CB ILE A 145 -0.920 -6.344 -7.390 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -0.487 -7.818 -7.579 1.00 25.00 C ATOM 2003 CG2 ILE A 145 0.006 -5.690 -6.338 1.00 25.00 C ATOM 2004 CD1 ILE A 145 -1.183 -8.577 -8.723 1.00 25.00 C ATOM 0 H ILE A 145 -2.329 -8.185 -6.265 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.492 -5.324 -6.289 1.00 25.00 H new ATOM 0 HB ILE A 145 -0.836 -5.846 -8.356 1.00 25.00 H new ATOM 0 HG12 ILE A 145 0.589 -7.842 -7.754 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -0.671 -8.354 -6.648 1.00 25.00 H new ATOM 0 HG21 ILE A 145 1.044 -5.791 -6.654 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -0.243 -4.633 -6.241 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -0.130 -6.185 -5.376 1.00 25.00 H new ATOM 0 HD11 ILE A 145 -0.805 -9.598 -8.765 1.00 25.00 H new ATOM 0 HD12 ILE A 145 -2.258 -8.595 -8.546 1.00 25.00 H new ATOM 0 HD13 ILE A 145 -0.979 -8.076 -9.669 1.00 25.00 H new ATOM 2016 N VAL A 146 -3.267 -4.796 -8.717 1.00 25.00 N ATOM 2017 CA VAL A 146 -4.080 -4.410 -9.882 1.00 25.00 C ATOM 2018 C VAL A 146 -3.876 -5.299 -11.121 1.00 25.00 C ATOM 2019 O VAL A 146 -4.780 -5.435 -11.943 1.00 25.00 O ATOM 2020 CB VAL A 146 -3.788 -2.910 -10.240 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -2.365 -2.731 -10.808 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -4.835 -2.344 -11.204 1.00 25.00 C ATOM 0 H VAL A 146 -2.669 -4.046 -8.369 1.00 25.00 H new ATOM 0 HA VAL A 146 -5.122 -4.548 -9.592 1.00 25.00 H new ATOM 0 HB VAL A 146 -3.852 -2.343 -9.311 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -2.197 -1.680 -11.045 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -1.634 -3.057 -10.068 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -2.257 -3.329 -11.713 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -4.599 -1.304 -11.428 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -4.831 -2.924 -12.127 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -5.822 -2.401 -10.744 1.00 25.00 H new ATOM 2032 N PHE A 147 -2.720 -5.940 -11.240 1.00 25.00 N ATOM 2033 CA PHE A 147 -2.433 -6.766 -12.410 1.00 25.00 C ATOM 2034 C PHE A 147 -3.252 -8.059 -12.413 1.00 25.00 C ATOM 2035 O PHE A 147 -3.487 -8.635 -13.468 1.00 25.00 O ATOM 2036 CB PHE A 147 -0.937 -7.092 -12.460 1.00 25.00 C ATOM 2037 CG PHE A 147 -0.056 -5.934 -12.070 1.00 25.00 C ATOM 2038 CD1 PHE A 147 0.036 -4.790 -12.883 1.00 25.00 C ATOM 2039 CD2 PHE A 147 0.679 -5.975 -10.872 1.00 25.00 C ATOM 2040 CE1 PHE A 147 0.845 -3.691 -12.496 1.00 25.00 C ATOM 2041 CE2 PHE A 147 1.488 -4.890 -10.479 1.00 25.00 C ATOM 2042 CZ PHE A 147 1.566 -3.742 -11.290 1.00 25.00 C ATOM 0 H PHE A 147 -1.971 -5.906 -10.549 1.00 25.00 H new ATOM 0 HA PHE A 147 -2.716 -6.197 -13.296 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -0.734 -7.932 -11.796 1.00 25.00 H new ATOM 0 HB3 PHE A 147 -0.677 -7.413 -13.469 1.00 25.00 H new ATOM 0 HD1 PHE A 147 -0.515 -4.748 -13.811 1.00 25.00 H new ATOM 0 HD2 PHE A 147 0.623 -6.851 -10.243 1.00 25.00 H new ATOM 0 HE1 PHE A 147 0.907 -2.816 -13.127 1.00 25.00 H new ATOM 0 HE2 PHE A 147 2.048 -4.939 -9.557 1.00 25.00 H new ATOM 0 HZ PHE A 147 2.177 -2.904 -10.987 1.00 25.00 H new