USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 943 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 63 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0.0389 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= -0.0993 USER MOD Single : A 51 THR OG1 : rot 79:sc= 2.19 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 104:sc= 0.557 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= 0.132 K(o=0.13,f=-6.4!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 170:sc= 0.0155 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -140:sc= 0.832 USER MOD Single : A 103 LYS NZ :NH3+ -111:sc= 0.0529 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0412 USER MOD Single : A 105 ASN : amide:sc= -0.387 K(o=-0.39,f=-2.9!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.0621 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.0199 USER MOD Single : A 114 LYS NZ :NH3+ 138:sc= 1.08 (180deg=-0.254) USER MOD Single : A 115 SER OG : rot 145:sc= 1.46 USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 6:sc= 0.778 USER MOD Single : A 141 ASN : amide:sc= 0.241 K(o=0.24,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -21.667 7.767 0.938 1.00 0.00 N ATOM 32 CA GLY A 4 -20.354 8.344 1.113 1.00 0.00 C ATOM 33 C GLY A 4 -20.365 9.810 0.685 1.00 0.00 C ATOM 34 O GLY A 4 -21.309 10.258 0.023 1.00 0.00 O ATOM 0 HA2 GLY A 4 -20.049 8.264 2.156 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.623 7.790 0.524 1.00 0.00 H new ATOM 38 N GLU A 5 -19.291 10.533 0.979 1.00 0.00 N ATOM 39 CA GLU A 5 -19.038 11.944 0.697 1.00 0.00 C ATOM 40 C GLU A 5 -17.543 12.070 0.347 1.00 0.00 C ATOM 41 O GLU A 5 -16.717 11.428 1.007 1.00 0.00 O ATOM 42 CB GLU A 5 -19.414 12.725 1.957 1.00 0.00 C ATOM 43 CG GLU A 5 -19.305 14.246 1.836 1.00 0.00 C ATOM 44 CD GLU A 5 -19.598 14.911 3.183 1.00 0.00 C ATOM 45 OE1 GLU A 5 -20.544 14.471 3.893 1.00 0.00 O ATOM 46 OE2 GLU A 5 -18.888 15.845 3.585 1.00 0.00 O ATOM 0 H GLU A 5 -18.501 10.109 1.466 1.00 0.00 H new ATOM 0 HA GLU A 5 -19.620 12.338 -0.136 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.438 12.471 2.231 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.774 12.395 2.775 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.305 14.520 1.498 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -20.006 14.609 1.084 1.00 0.00 H new ATOM 53 N PRO A 6 -17.150 12.775 -0.725 1.00 0.00 N ATOM 54 CA PRO A 6 -15.745 12.908 -1.113 1.00 0.00 C ATOM 55 C PRO A 6 -14.983 13.883 -0.207 1.00 0.00 C ATOM 56 O PRO A 6 -15.572 14.818 0.339 1.00 0.00 O ATOM 57 CB PRO A 6 -15.803 13.450 -2.536 1.00 0.00 C ATOM 58 CG PRO A 6 -17.046 14.330 -2.515 1.00 0.00 C ATOM 59 CD PRO A 6 -18.000 13.567 -1.602 1.00 0.00 C ATOM 0 HA PRO A 6 -15.216 11.958 -1.031 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -14.909 14.020 -2.788 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -15.888 12.649 -3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -16.828 15.325 -2.128 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -17.463 14.461 -3.513 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -18.626 14.251 -1.029 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -18.670 12.930 -2.179 1.00 0.00 H new ATOM 67 N LEU A 7 -13.674 13.679 -0.038 1.00 0.00 N ATOM 68 CA LEU A 7 -12.785 14.491 0.753 1.00 0.00 C ATOM 69 C LEU A 7 -11.666 14.850 -0.215 1.00 0.00 C ATOM 70 O LEU A 7 -11.193 14.002 -0.979 1.00 0.00 O ATOM 71 CB LEU A 7 -12.278 13.687 1.963 1.00 0.00 C ATOM 72 CG LEU A 7 -11.837 14.511 3.191 1.00 0.00 C ATOM 73 CD1 LEU A 7 -11.170 13.548 4.178 1.00 0.00 C ATOM 74 CD2 LEU A 7 -10.874 15.666 2.898 1.00 0.00 C ATOM 0 H LEU A 7 -13.193 12.896 -0.480 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.254 15.382 1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -13.067 13.003 2.275 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -11.435 13.076 1.640 1.00 0.00 H new ATOM 0 HG LEU A 7 -12.736 14.983 3.587 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -10.845 14.099 5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.883 12.778 4.473 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -10.307 13.081 3.704 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -10.628 16.179 3.828 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -9.962 15.274 2.447 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -11.346 16.368 2.210 1.00 0.00 H new ATOM 86 N VAL A 8 -11.284 16.106 -0.211 1.00 0.00 N ATOM 87 CA VAL A 8 -10.225 16.691 -1.014 1.00 0.00 C ATOM 88 C VAL A 8 -9.341 17.403 0.005 1.00 0.00 C ATOM 89 O VAL A 8 -9.847 18.177 0.825 1.00 0.00 O ATOM 90 CB VAL A 8 -10.798 17.632 -2.091 1.00 0.00 C ATOM 91 CG1 VAL A 8 -9.685 18.215 -2.973 1.00 0.00 C ATOM 92 CG2 VAL A 8 -11.806 16.899 -2.990 1.00 0.00 C ATOM 0 H VAL A 8 -11.732 16.796 0.392 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.656 15.956 -1.583 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.303 18.442 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.123 18.874 -3.723 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.989 18.781 -2.354 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.152 17.404 -3.470 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.193 17.589 -3.740 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.311 16.064 -3.486 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.630 16.524 -2.383 1.00 0.00 H new ATOM 102 N GLY A 9 -8.046 17.109 -0.025 1.00 0.00 N ATOM 103 CA GLY A 9 -7.027 17.651 0.851 1.00 0.00 C ATOM 104 C GLY A 9 -6.981 19.167 0.875 1.00 0.00 C ATOM 105 O GLY A 9 -7.569 19.848 0.028 1.00 0.00 O ATOM 0 H GLY A 9 -7.663 16.448 -0.701 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -7.200 17.286 1.863 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -6.054 17.273 0.538 1.00 0.00 H new ATOM 109 N GLY A 10 -6.250 19.702 1.850 1.00 0.00 N ATOM 110 CA GLY A 10 -6.100 21.133 2.040 1.00 0.00 C ATOM 111 C GLY A 10 -5.111 21.782 1.082 1.00 0.00 C ATOM 112 O GLY A 10 -4.926 22.997 1.185 1.00 0.00 O ATOM 0 H GLY A 10 -5.741 19.143 2.535 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.073 21.609 1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.777 21.322 3.064 1.00 0.00 H new ATOM 116 N ASP A 11 -4.511 21.028 0.150 1.00 0.00 N ATOM 117 CA ASP A 11 -3.498 21.492 -0.816 1.00 0.00 C ATOM 118 C ASP A 11 -2.336 22.158 -0.044 1.00 0.00 C ATOM 119 O ASP A 11 -1.682 23.113 -0.472 1.00 0.00 O ATOM 120 CB ASP A 11 -4.116 22.364 -1.903 1.00 0.00 C ATOM 121 CG ASP A 11 -4.543 21.609 -3.161 1.00 0.00 C ATOM 122 OD1 ASP A 11 -3.712 21.351 -4.055 1.00 0.00 O ATOM 123 OD2 ASP A 11 -5.761 21.322 -3.288 1.00 0.00 O ATOM 0 H ASP A 11 -4.725 20.037 0.042 1.00 0.00 H new ATOM 0 HA ASP A 11 -3.079 20.645 -1.359 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.986 22.875 -1.489 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -3.398 23.134 -2.184 1.00 0.00 H new ATOM 128 N THR A 12 -2.157 21.636 1.161 1.00 0.00 N ATOM 129 CA THR A 12 -1.230 21.919 2.241 1.00 0.00 C ATOM 130 C THR A 12 -0.897 20.559 2.882 1.00 0.00 C ATOM 131 O THR A 12 -0.663 19.598 2.148 1.00 0.00 O ATOM 132 CB THR A 12 -1.840 22.991 3.169 1.00 0.00 C ATOM 133 OG1 THR A 12 -3.218 22.780 3.399 1.00 0.00 O ATOM 134 CG2 THR A 12 -1.707 24.404 2.597 1.00 0.00 C ATOM 0 H THR A 12 -2.769 20.872 1.445 1.00 0.00 H new ATOM 0 HA THR A 12 -0.285 22.362 1.925 1.00 0.00 H new ATOM 0 HB THR A 12 -1.276 22.900 4.097 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.562 23.480 3.992 1.00 0.00 H new ATOM 0 HG21 THR A 12 -2.152 25.120 3.288 1.00 0.00 H new ATOM 0 HG22 THR A 12 -0.653 24.642 2.457 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.222 24.458 1.638 1.00 0.00 H new ATOM 142 N ASP A 13 -0.767 20.471 4.202 1.00 0.00 N ATOM 143 CA ASP A 13 -0.457 19.252 4.956 1.00 0.00 C ATOM 144 C ASP A 13 -1.326 19.242 6.199 1.00 0.00 C ATOM 145 O ASP A 13 -1.510 20.271 6.860 1.00 0.00 O ATOM 146 CB ASP A 13 1.021 19.209 5.339 1.00 0.00 C ATOM 147 CG ASP A 13 1.359 18.415 6.610 1.00 0.00 C ATOM 148 OD1 ASP A 13 1.008 17.230 6.780 1.00 0.00 O ATOM 149 OD2 ASP A 13 2.033 19.010 7.485 1.00 0.00 O ATOM 0 H ASP A 13 -0.879 21.284 4.808 1.00 0.00 H new ATOM 0 HA ASP A 13 -0.659 18.374 4.343 1.00 0.00 H new ATOM 0 HB2 ASP A 13 1.580 18.782 4.507 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.374 20.232 5.468 1.00 0.00 H new ATOM 154 N ASP A 14 -1.890 18.071 6.435 1.00 0.00 N ATOM 155 CA ASP A 14 -2.793 17.664 7.511 1.00 0.00 C ATOM 156 C ASP A 14 -2.868 16.131 7.412 1.00 0.00 C ATOM 157 O ASP A 14 -1.961 15.511 6.859 1.00 0.00 O ATOM 158 CB ASP A 14 -4.188 18.333 7.360 1.00 0.00 C ATOM 159 CG ASP A 14 -4.338 19.666 8.114 1.00 0.00 C ATOM 160 OD1 ASP A 14 -3.782 19.810 9.233 1.00 0.00 O ATOM 161 OD2 ASP A 14 -5.134 20.536 7.695 1.00 0.00 O ATOM 0 H ASP A 14 -1.708 17.288 5.807 1.00 0.00 H new ATOM 0 HA ASP A 14 -2.434 17.979 8.491 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -4.383 18.504 6.301 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -4.950 17.640 7.716 1.00 0.00 H new ATOM 166 N GLN A 15 -3.847 15.476 8.049 1.00 0.00 N ATOM 167 CA GLN A 15 -4.048 14.044 7.991 1.00 0.00 C ATOM 168 C GLN A 15 -5.523 13.822 7.615 1.00 0.00 C ATOM 169 O GLN A 15 -6.407 14.545 8.088 1.00 0.00 O ATOM 170 CB GLN A 15 -3.727 13.374 9.331 1.00 0.00 C ATOM 171 CG GLN A 15 -2.258 13.223 9.744 1.00 0.00 C ATOM 172 CD GLN A 15 -2.072 13.168 11.254 1.00 0.00 C ATOM 173 OE1 GLN A 15 -1.463 14.060 11.849 1.00 0.00 O ATOM 174 NE2 GLN A 15 -2.579 12.128 11.897 1.00 0.00 N ATOM 0 H GLN A 15 -4.535 15.952 8.633 1.00 0.00 H new ATOM 0 HA GLN A 15 -3.379 13.597 7.256 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.234 13.939 10.113 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -4.171 12.379 9.318 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.852 12.314 9.299 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -1.685 14.058 9.342 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.079 11.404 11.381 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -2.470 12.051 12.908 1.00 0.00 H new ATOM 183 N LEU A 16 -5.807 12.789 6.822 1.00 0.00 N ATOM 184 CA LEU A 16 -7.122 12.389 6.324 1.00 0.00 C ATOM 185 C LEU A 16 -7.335 10.950 6.772 1.00 0.00 C ATOM 186 O LEU A 16 -6.571 10.079 6.356 1.00 0.00 O ATOM 187 CB LEU A 16 -7.243 12.564 4.805 1.00 0.00 C ATOM 188 CG LEU A 16 -6.898 13.940 4.198 1.00 0.00 C ATOM 189 CD1 LEU A 16 -5.401 14.202 4.184 1.00 0.00 C ATOM 190 CD2 LEU A 16 -7.370 13.950 2.734 1.00 0.00 C ATOM 0 H LEU A 16 -5.072 12.166 6.487 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.904 13.030 6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.600 11.821 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.268 12.324 4.523 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.385 14.703 4.806 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.207 15.182 3.748 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.018 14.176 5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.903 13.436 3.590 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.137 14.914 2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.862 13.159 2.182 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.447 13.784 2.698 1.00 0.00 H new ATOM 202 N GLN A 17 -8.293 10.682 7.661 1.00 0.00 N ATOM 203 CA GLN A 17 -8.562 9.333 8.154 1.00 0.00 C ATOM 204 C GLN A 17 -10.030 9.003 7.919 1.00 0.00 C ATOM 205 O GLN A 17 -10.899 9.548 8.608 1.00 0.00 O ATOM 206 CB GLN A 17 -8.238 9.229 9.654 1.00 0.00 C ATOM 207 CG GLN A 17 -6.740 9.314 9.997 1.00 0.00 C ATOM 208 CD GLN A 17 -6.444 8.822 11.418 1.00 0.00 C ATOM 209 OE1 GLN A 17 -5.872 9.508 12.263 1.00 0.00 O ATOM 210 NE2 GLN A 17 -6.808 7.589 11.724 1.00 0.00 N ATOM 0 H GLN A 17 -8.904 11.396 8.059 1.00 0.00 H new ATOM 0 HA GLN A 17 -7.931 8.624 7.618 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.763 10.026 10.181 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -8.630 8.285 10.032 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -6.171 8.720 9.282 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.403 10.345 9.894 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -7.283 7.011 11.031 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.614 7.216 12.653 1.00 0.00 H new ATOM 219 N GLY A 18 -10.319 8.091 6.993 1.00 0.00 N ATOM 220 CA GLY A 18 -11.690 7.706 6.697 1.00 0.00 C ATOM 221 C GLY A 18 -12.283 6.871 7.822 1.00 0.00 C ATOM 222 O GLY A 18 -13.385 7.150 8.296 1.00 0.00 O ATOM 0 H GLY A 18 -9.617 7.606 6.435 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -12.296 8.599 6.545 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.718 7.139 5.766 1.00 0.00 H new ATOM 226 N GLY A 19 -11.534 5.880 8.305 1.00 0.00 N ATOM 227 CA GLY A 19 -11.983 5.002 9.372 1.00 0.00 C ATOM 228 C GLY A 19 -12.783 3.849 8.783 1.00 0.00 C ATOM 229 O GLY A 19 -12.335 2.708 8.867 1.00 0.00 O ATOM 0 H GLY A 19 -10.597 5.667 7.963 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.126 4.618 9.925 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -12.596 5.559 10.081 1.00 0.00 H new ATOM 233 N SER A 20 -13.946 4.111 8.181 1.00 0.00 N ATOM 234 CA SER A 20 -14.774 3.068 7.578 1.00 0.00 C ATOM 235 C SER A 20 -15.671 3.608 6.459 1.00 0.00 C ATOM 236 O SER A 20 -15.675 4.812 6.194 1.00 0.00 O ATOM 237 CB SER A 20 -15.555 2.312 8.667 1.00 0.00 C ATOM 238 OG SER A 20 -16.171 3.181 9.605 1.00 0.00 O ATOM 0 H SER A 20 -14.338 5.049 8.099 1.00 0.00 H new ATOM 0 HA SER A 20 -14.115 2.349 7.090 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.319 1.693 8.196 1.00 0.00 H new ATOM 0 HB3 SER A 20 -14.878 1.639 9.192 1.00 0.00 H new ATOM 0 HG SER A 20 -16.655 2.651 10.273 1.00 0.00 H new ATOM 244 N GLY A 21 -16.458 2.721 5.842 1.00 0.00 N ATOM 245 CA GLY A 21 -17.363 3.028 4.756 1.00 0.00 C ATOM 246 C GLY A 21 -16.581 3.181 3.456 1.00 0.00 C ATOM 247 O GLY A 21 -15.419 2.784 3.369 1.00 0.00 O ATOM 0 H GLY A 21 -16.475 1.735 6.103 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -18.104 2.235 4.654 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -17.907 3.947 4.973 1.00 0.00 H new ATOM 251 N ALA A 22 -17.236 3.666 2.401 1.00 0.00 N ATOM 252 CA ALA A 22 -16.597 3.884 1.115 1.00 0.00 C ATOM 253 C ALA A 22 -16.678 5.376 0.859 1.00 0.00 C ATOM 254 O ALA A 22 -17.666 5.891 0.324 1.00 0.00 O ATOM 255 CB ALA A 22 -17.246 3.066 0.000 1.00 0.00 C ATOM 0 H ALA A 22 -18.224 3.917 2.420 1.00 0.00 H new ATOM 0 HA ALA A 22 -15.561 3.547 1.130 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -16.733 3.263 -0.942 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.173 2.005 0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -18.295 3.346 -0.093 1.00 0.00 H new ATOM 261 N ASP A 23 -15.610 6.070 1.218 1.00 0.00 N ATOM 262 CA ASP A 23 -15.466 7.503 1.057 1.00 0.00 C ATOM 263 C ASP A 23 -14.189 7.679 0.274 1.00 0.00 C ATOM 264 O ASP A 23 -13.195 7.058 0.624 1.00 0.00 O ATOM 265 CB ASP A 23 -15.374 8.221 2.398 1.00 0.00 C ATOM 266 CG ASP A 23 -16.730 8.382 3.076 1.00 0.00 C ATOM 267 OD1 ASP A 23 -17.699 8.800 2.421 1.00 0.00 O ATOM 268 OD2 ASP A 23 -16.870 8.037 4.278 1.00 0.00 O ATOM 0 H ASP A 23 -14.793 5.633 1.644 1.00 0.00 H new ATOM 0 HA ASP A 23 -16.331 7.932 0.552 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.707 7.666 3.057 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.928 9.205 2.249 1.00 0.00 H new ATOM 273 N ARG A 24 -14.226 8.471 -0.797 1.00 0.00 N ATOM 274 CA ARG A 24 -13.066 8.703 -1.641 1.00 0.00 C ATOM 275 C ARG A 24 -12.327 9.930 -1.137 1.00 0.00 C ATOM 276 O ARG A 24 -12.892 11.032 -1.186 1.00 0.00 O ATOM 277 CB ARG A 24 -13.487 8.851 -3.101 1.00 0.00 C ATOM 278 CG ARG A 24 -12.322 9.425 -3.912 1.00 0.00 C ATOM 279 CD ARG A 24 -12.311 8.957 -5.359 1.00 0.00 C ATOM 280 NE ARG A 24 -11.546 9.876 -6.210 1.00 0.00 N ATOM 281 CZ ARG A 24 -10.298 10.318 -6.018 1.00 0.00 C ATOM 282 NH1 ARG A 24 -9.488 9.785 -5.112 1.00 0.00 N ATOM 283 NH2 ARG A 24 -9.873 11.331 -6.750 1.00 0.00 N ATOM 0 H ARG A 24 -15.064 8.968 -1.100 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.392 7.848 -1.591 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -13.783 7.883 -3.505 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.354 9.507 -3.176 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -12.374 10.514 -3.889 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -11.383 9.141 -3.438 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.878 7.958 -5.417 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -13.334 8.883 -5.727 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.021 10.218 -7.045 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.811 9.010 -4.532 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.543 10.150 -4.995 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.492 11.756 -7.441 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -8.926 11.689 -6.625 1.00 0.00 H new ATOM 297 N LEU A 25 -11.093 9.748 -0.671 1.00 0.00 N ATOM 298 CA LEU A 25 -10.269 10.843 -0.181 1.00 0.00 C ATOM 299 C LEU A 25 -9.162 11.087 -1.205 1.00 0.00 C ATOM 300 O LEU A 25 -8.663 10.147 -1.831 1.00 0.00 O ATOM 301 CB LEU A 25 -9.863 10.649 1.292 1.00 0.00 C ATOM 302 CG LEU A 25 -8.660 9.755 1.632 1.00 0.00 C ATOM 303 CD1 LEU A 25 -8.617 9.581 3.162 1.00 0.00 C ATOM 304 CD2 LEU A 25 -8.686 8.371 0.981 1.00 0.00 C ATOM 0 H LEU A 25 -10.639 8.836 -0.624 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.820 11.781 -0.115 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -9.665 11.636 1.709 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -10.728 10.248 1.820 1.00 0.00 H new ATOM 0 HG LEU A 25 -7.776 10.254 1.235 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.771 8.949 3.433 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.508 10.556 3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.542 9.114 3.501 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.798 7.812 1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.578 7.834 1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -8.700 8.479 -0.104 1.00 0.00 H new ATOM 316 N ASP A 26 -8.790 12.349 -1.395 1.00 0.00 N ATOM 317 CA ASP A 26 -7.764 12.740 -2.367 1.00 0.00 C ATOM 318 C ASP A 26 -6.800 13.744 -1.755 1.00 0.00 C ATOM 319 O ASP A 26 -7.241 14.793 -1.294 1.00 0.00 O ATOM 320 CB ASP A 26 -8.500 13.294 -3.605 1.00 0.00 C ATOM 321 CG ASP A 26 -7.654 13.502 -4.867 1.00 0.00 C ATOM 322 OD1 ASP A 26 -7.187 14.631 -5.108 1.00 0.00 O ATOM 323 OD2 ASP A 26 -7.663 12.588 -5.739 1.00 0.00 O ATOM 0 H ASP A 26 -9.190 13.134 -0.880 1.00 0.00 H new ATOM 0 HA ASP A 26 -7.151 11.889 -2.664 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -9.316 12.614 -3.849 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -8.951 14.249 -3.335 1.00 0.00 H new ATOM 328 N GLY A 27 -5.516 13.384 -1.706 1.00 0.00 N ATOM 329 CA GLY A 27 -4.415 14.168 -1.151 1.00 0.00 C ATOM 330 C GLY A 27 -4.285 15.571 -1.742 1.00 0.00 C ATOM 331 O GLY A 27 -4.296 16.556 -1.004 1.00 0.00 O ATOM 0 H GLY A 27 -5.201 12.486 -2.074 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.551 14.251 -0.073 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.482 13.629 -1.314 1.00 0.00 H new ATOM 335 N GLY A 28 -4.228 15.709 -3.062 1.00 0.00 N ATOM 336 CA GLY A 28 -4.095 17.006 -3.712 1.00 0.00 C ATOM 337 C GLY A 28 -2.635 17.472 -3.697 1.00 0.00 C ATOM 338 O GLY A 28 -2.041 17.571 -4.781 1.00 0.00 O ATOM 0 H GLY A 28 -4.273 14.924 -3.711 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -4.451 16.941 -4.740 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -4.721 17.739 -3.204 1.00 0.00 H new ATOM 342 N ALA A 29 -2.101 17.846 -2.525 1.00 0.00 N ATOM 343 CA ALA A 29 -0.713 18.276 -2.328 1.00 0.00 C ATOM 344 C ALA A 29 0.030 17.216 -1.502 1.00 0.00 C ATOM 345 O ALA A 29 -0.597 16.448 -0.775 1.00 0.00 O ATOM 346 CB ALA A 29 -0.648 19.637 -1.634 1.00 0.00 C ATOM 0 H ALA A 29 -2.643 17.857 -1.661 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.236 18.382 -3.302 1.00 0.00 H new ATOM 0 HB1 ALA A 29 0.394 19.929 -1.502 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -1.159 20.382 -2.245 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.133 19.572 -0.660 1.00 0.00 H new ATOM 352 N GLY A 30 1.365 17.234 -1.585 1.00 0.00 N ATOM 353 CA GLY A 30 2.253 16.303 -0.908 1.00 0.00 C ATOM 354 C GLY A 30 2.516 16.596 0.560 1.00 0.00 C ATOM 355 O GLY A 30 1.934 17.492 1.164 1.00 0.00 O ATOM 0 H GLY A 30 1.866 17.923 -2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.831 15.301 -0.990 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.207 16.291 -1.434 1.00 0.00 H new ATOM 359 N ASP A 31 3.421 15.797 1.135 1.00 0.00 N ATOM 360 CA ASP A 31 3.898 15.799 2.515 1.00 0.00 C ATOM 361 C ASP A 31 2.753 15.908 3.526 1.00 0.00 C ATOM 362 O ASP A 31 2.850 16.507 4.596 1.00 0.00 O ATOM 363 CB ASP A 31 5.041 16.802 2.555 1.00 0.00 C ATOM 364 CG ASP A 31 5.484 17.285 3.938 1.00 0.00 C ATOM 365 OD1 ASP A 31 6.132 16.473 4.651 1.00 0.00 O ATOM 366 OD2 ASP A 31 5.447 18.501 4.233 1.00 0.00 O ATOM 0 H ASP A 31 3.879 15.065 0.592 1.00 0.00 H new ATOM 0 HA ASP A 31 4.318 14.851 2.851 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.903 16.356 2.058 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.750 17.673 1.968 1.00 0.00 H new ATOM 371 N ASP A 32 1.693 15.200 3.155 1.00 0.00 N ATOM 372 CA ASP A 32 0.374 14.977 3.739 1.00 0.00 C ATOM 373 C ASP A 32 0.238 13.485 3.970 1.00 0.00 C ATOM 374 O ASP A 32 1.121 12.673 3.653 1.00 0.00 O ATOM 375 CB ASP A 32 -0.728 15.548 2.881 1.00 0.00 C ATOM 376 CG ASP A 32 -2.149 15.371 3.371 1.00 0.00 C ATOM 377 OD1 ASP A 32 -2.635 16.238 4.135 1.00 0.00 O ATOM 378 OD2 ASP A 32 -2.792 14.417 2.892 1.00 0.00 O ATOM 0 H ASP A 32 1.755 14.678 2.281 1.00 0.00 H new ATOM 0 HA ASP A 32 0.277 15.504 4.688 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.543 16.615 2.760 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.653 15.097 1.891 1.00 0.00 H new ATOM 383 N ILE A 33 -0.781 13.170 4.735 1.00 0.00 N ATOM 384 CA ILE A 33 -1.062 11.787 5.158 1.00 0.00 C ATOM 385 C ILE A 33 -2.533 11.345 5.116 1.00 0.00 C ATOM 386 O ILE A 33 -3.336 11.713 5.974 1.00 0.00 O ATOM 387 CB ILE A 33 -0.359 11.560 6.533 1.00 0.00 C ATOM 388 CG1 ILE A 33 -0.878 10.343 7.320 1.00 0.00 C ATOM 389 CG2 ILE A 33 -0.219 12.833 7.365 1.00 0.00 C ATOM 390 CD1 ILE A 33 0.095 9.882 8.409 1.00 0.00 C ATOM 0 H ILE A 33 -1.449 13.854 5.090 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.643 11.117 4.407 1.00 0.00 H new ATOM 0 HB ILE A 33 0.663 11.283 6.276 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -1.836 10.593 7.777 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -1.060 9.520 6.629 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.278 12.599 8.307 1.00 0.00 H new ATOM 0 HG22 ILE A 33 0.372 13.565 6.814 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.207 13.245 7.569 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.324 9.021 8.931 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.045 9.603 7.954 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.257 10.693 9.119 1.00 0.00 H new ATOM 402 N LEU A 34 -2.895 10.468 4.173 1.00 0.00 N ATOM 403 CA LEU A 34 -4.250 9.937 4.001 1.00 0.00 C ATOM 404 C LEU A 34 -4.313 8.427 4.321 1.00 0.00 C ATOM 405 O LEU A 34 -3.360 7.680 4.107 1.00 0.00 O ATOM 406 CB LEU A 34 -4.876 10.350 2.648 1.00 0.00 C ATOM 407 CG LEU A 34 -4.050 9.914 1.447 1.00 0.00 C ATOM 408 CD1 LEU A 34 -4.985 9.490 0.310 1.00 0.00 C ATOM 409 CD2 LEU A 34 -3.128 11.036 0.957 1.00 0.00 C ATOM 0 H LEU A 34 -2.234 10.098 3.490 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.896 10.406 4.743 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.874 9.919 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.994 11.433 2.625 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.426 9.075 1.755 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.393 9.178 -0.550 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.609 8.660 0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.619 10.330 0.028 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.554 10.687 0.098 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.727 11.899 0.666 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.445 11.322 1.757 1.00 0.00 H new ATOM 421 N ASP A 35 -5.449 7.975 4.859 1.00 0.00 N ATOM 422 CA ASP A 35 -5.789 6.600 5.251 1.00 0.00 C ATOM 423 C ASP A 35 -7.239 6.408 4.830 1.00 0.00 C ATOM 424 O ASP A 35 -8.140 6.992 5.445 1.00 0.00 O ATOM 425 CB ASP A 35 -5.612 6.355 6.762 1.00 0.00 C ATOM 426 CG ASP A 35 -6.129 4.996 7.281 1.00 0.00 C ATOM 427 OD1 ASP A 35 -6.587 4.114 6.525 1.00 0.00 O ATOM 428 OD2 ASP A 35 -6.095 4.794 8.525 1.00 0.00 O ATOM 0 H ASP A 35 -6.221 8.614 5.048 1.00 0.00 H new ATOM 0 HA ASP A 35 -5.122 5.885 4.770 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.552 6.437 7.004 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.125 7.150 7.304 1.00 0.00 H new ATOM 433 N GLY A 36 -7.452 5.662 3.746 1.00 0.00 N ATOM 434 CA GLY A 36 -8.763 5.374 3.177 1.00 0.00 C ATOM 435 C GLY A 36 -9.744 4.743 4.163 1.00 0.00 C ATOM 436 O GLY A 36 -10.954 4.955 4.033 1.00 0.00 O ATOM 0 H GLY A 36 -6.690 5.229 3.225 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.193 6.300 2.795 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.639 4.705 2.325 1.00 0.00 H new ATOM 440 N GLY A 37 -9.245 4.030 5.176 1.00 0.00 N ATOM 441 CA GLY A 37 -10.049 3.366 6.182 1.00 0.00 C ATOM 442 C GLY A 37 -10.510 1.985 5.722 1.00 0.00 C ATOM 443 O GLY A 37 -10.143 1.495 4.652 1.00 0.00 O ATOM 0 H GLY A 37 -8.243 3.901 5.315 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.472 3.268 7.102 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.919 3.980 6.415 1.00 0.00 H new ATOM 447 N ALA A 38 -11.292 1.330 6.579 1.00 0.00 N ATOM 448 CA ALA A 38 -11.852 0.011 6.347 1.00 0.00 C ATOM 449 C ALA A 38 -13.024 0.105 5.367 1.00 0.00 C ATOM 450 O ALA A 38 -14.138 0.456 5.766 1.00 0.00 O ATOM 451 CB ALA A 38 -12.360 -0.515 7.695 1.00 0.00 C ATOM 0 H ALA A 38 -11.559 1.721 7.483 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.098 -0.654 5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -12.789 -1.508 7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -11.530 -0.571 8.400 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.122 0.160 8.085 1.00 0.00 H new ATOM 457 N GLY A 39 -12.843 -0.359 4.138 1.00 0.00 N ATOM 458 CA GLY A 39 -13.831 -0.356 3.091 1.00 0.00 C ATOM 459 C GLY A 39 -13.165 -0.169 1.737 1.00 0.00 C ATOM 460 O GLY A 39 -11.984 0.165 1.646 1.00 0.00 O ATOM 0 H GLY A 39 -11.957 -0.766 3.839 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -14.387 -1.293 3.104 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.551 0.444 3.263 1.00 0.00 H new ATOM 464 N ARG A 40 -13.907 -0.434 0.658 1.00 0.00 N ATOM 465 CA ARG A 40 -13.356 -0.282 -0.676 1.00 0.00 C ATOM 466 C ARG A 40 -13.447 1.177 -1.106 1.00 0.00 C ATOM 467 O ARG A 40 -14.473 1.631 -1.630 1.00 0.00 O ATOM 468 CB ARG A 40 -14.008 -1.275 -1.642 1.00 0.00 C ATOM 469 CG ARG A 40 -15.543 -1.364 -1.670 1.00 0.00 C ATOM 470 CD ARG A 40 -16.044 -2.647 -0.986 1.00 0.00 C ATOM 471 NE ARG A 40 -17.307 -3.105 -1.578 1.00 0.00 N ATOM 472 CZ ARG A 40 -17.416 -3.779 -2.729 1.00 0.00 C ATOM 473 NH1 ARG A 40 -16.338 -4.240 -3.367 1.00 0.00 N ATOM 474 NH2 ARG A 40 -18.617 -3.973 -3.259 1.00 0.00 N ATOM 0 H ARG A 40 -14.876 -0.750 0.688 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.295 -0.532 -0.683 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.671 -1.029 -2.649 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.622 -2.267 -1.410 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -15.968 -0.494 -1.170 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -15.891 -1.341 -2.703 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -15.291 -3.430 -1.079 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.184 -2.464 0.079 1.00 0.00 H new ATOM 0 HE ARG A 40 -18.168 -2.893 -1.073 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -15.408 -4.081 -2.978 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -16.444 -4.751 -4.243 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -19.446 -3.610 -2.789 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.711 -4.485 -4.136 1.00 0.00 H new ATOM 488 N ASP A 41 -12.343 1.884 -0.925 1.00 0.00 N ATOM 489 CA ASP A 41 -12.102 3.286 -1.238 1.00 0.00 C ATOM 490 C ASP A 41 -11.165 3.337 -2.434 1.00 0.00 C ATOM 491 O ASP A 41 -10.668 2.317 -2.927 1.00 0.00 O ATOM 492 CB ASP A 41 -11.558 4.078 -0.029 1.00 0.00 C ATOM 493 CG ASP A 41 -10.559 5.200 -0.357 1.00 0.00 C ATOM 494 OD1 ASP A 41 -10.990 6.210 -0.982 1.00 0.00 O ATOM 495 OD2 ASP A 41 -9.365 5.027 -0.094 1.00 0.00 O ATOM 0 H ASP A 41 -11.514 1.451 -0.517 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.045 3.774 -1.486 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.402 4.514 0.505 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.077 3.377 0.653 1.00 0.00 H new ATOM 500 N ARG A 42 -11.156 4.503 -3.054 1.00 0.00 N ATOM 501 CA ARG A 42 -10.321 4.820 -4.173 1.00 0.00 C ATOM 502 C ARG A 42 -9.517 6.036 -3.740 1.00 0.00 C ATOM 503 O ARG A 42 -9.953 7.177 -3.944 1.00 0.00 O ATOM 504 CB ARG A 42 -11.258 5.088 -5.332 1.00 0.00 C ATOM 505 CG ARG A 42 -10.479 5.273 -6.643 1.00 0.00 C ATOM 506 CD ARG A 42 -11.427 5.538 -7.812 1.00 0.00 C ATOM 507 NE ARG A 42 -12.448 4.485 -7.904 1.00 0.00 N ATOM 508 CZ ARG A 42 -13.571 4.548 -8.612 1.00 0.00 C ATOM 509 NH1 ARG A 42 -13.814 5.557 -9.432 1.00 0.00 N ATOM 510 NH2 ARG A 42 -14.476 3.587 -8.489 1.00 0.00 N ATOM 0 H ARG A 42 -11.757 5.277 -2.773 1.00 0.00 H new ATOM 0 HA ARG A 42 -9.626 4.040 -4.484 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.959 4.260 -5.436 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.848 5.981 -5.127 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -9.781 6.104 -6.541 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -9.886 4.381 -6.846 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.908 6.507 -7.683 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -10.861 5.584 -8.742 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.280 3.628 -7.377 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.132 6.309 -9.531 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.683 5.583 -9.965 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -14.308 2.806 -7.854 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -15.340 3.628 -9.029 1.00 0.00 H new ATOM 524 N LEU A 43 -8.288 5.803 -3.305 1.00 0.00 N ATOM 525 CA LEU A 43 -7.406 6.849 -2.845 1.00 0.00 C ATOM 526 C LEU A 43 -6.498 7.312 -3.965 1.00 0.00 C ATOM 527 O LEU A 43 -6.223 6.582 -4.921 1.00 0.00 O ATOM 528 CB LEU A 43 -6.571 6.324 -1.677 1.00 0.00 C ATOM 529 CG LEU A 43 -5.643 5.127 -1.948 1.00 0.00 C ATOM 530 CD1 LEU A 43 -4.183 5.593 -2.070 1.00 0.00 C ATOM 531 CD2 LEU A 43 -5.763 4.122 -0.804 1.00 0.00 C ATOM 0 H LEU A 43 -7.877 4.871 -3.264 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.003 7.700 -2.517 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.960 7.146 -1.305 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.254 6.045 -0.874 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.940 4.658 -2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.541 4.733 -2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.095 6.302 -2.893 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.876 6.075 -1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.106 3.273 -0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.475 4.600 0.132 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.793 3.774 -0.732 1.00 0.00 H new ATOM 543 N SER A 44 -6.105 8.574 -3.910 1.00 0.00 N ATOM 544 CA SER A 44 -5.206 9.192 -4.868 1.00 0.00 C ATOM 545 C SER A 44 -4.477 10.273 -4.103 1.00 0.00 C ATOM 546 O SER A 44 -5.132 11.137 -3.518 1.00 0.00 O ATOM 547 CB SER A 44 -5.965 9.738 -6.079 1.00 0.00 C ATOM 548 OG SER A 44 -6.995 8.847 -6.470 1.00 0.00 O ATOM 0 H SER A 44 -6.412 9.214 -3.177 1.00 0.00 H new ATOM 0 HA SER A 44 -4.501 8.472 -5.285 1.00 0.00 H new ATOM 0 HB2 SER A 44 -6.392 10.711 -5.838 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.275 9.890 -6.909 1.00 0.00 H new ATOM 0 HG SER A 44 -7.469 9.215 -7.245 1.00 0.00 H new ATOM 554 N GLY A 45 -3.160 10.171 -4.009 1.00 0.00 N ATOM 555 CA GLY A 45 -2.383 11.182 -3.331 1.00 0.00 C ATOM 556 C GLY A 45 -2.330 12.379 -4.263 1.00 0.00 C ATOM 557 O GLY A 45 -2.967 13.406 -4.028 1.00 0.00 O ATOM 0 H GLY A 45 -2.614 9.400 -4.394 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.842 11.451 -2.379 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.380 10.817 -3.110 1.00 0.00 H new ATOM 561 N GLY A 46 -1.720 12.157 -5.425 1.00 0.00 N ATOM 562 CA GLY A 46 -1.525 13.174 -6.443 1.00 0.00 C ATOM 563 C GLY A 46 -0.026 13.394 -6.585 1.00 0.00 C ATOM 564 O GLY A 46 0.775 12.507 -6.292 1.00 0.00 O ATOM 0 H GLY A 46 -1.342 11.246 -5.686 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.958 12.856 -7.391 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.024 14.101 -6.160 1.00 0.00 H new ATOM 568 N ALA A 47 0.355 14.546 -7.121 1.00 0.00 N ATOM 569 CA ALA A 47 1.756 14.890 -7.288 1.00 0.00 C ATOM 570 C ALA A 47 2.300 15.342 -5.929 1.00 0.00 C ATOM 571 O ALA A 47 2.085 16.491 -5.523 1.00 0.00 O ATOM 572 CB ALA A 47 1.890 15.985 -8.352 1.00 0.00 C ATOM 0 H ALA A 47 -0.294 15.261 -7.449 1.00 0.00 H new ATOM 0 HA ALA A 47 2.336 14.032 -7.630 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.941 16.244 -8.478 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.490 15.623 -9.299 1.00 0.00 H new ATOM 0 HB3 ALA A 47 1.334 16.868 -8.037 1.00 0.00 H new ATOM 578 N GLY A 48 3.070 14.491 -5.252 1.00 0.00 N ATOM 579 CA GLY A 48 3.630 14.820 -3.958 1.00 0.00 C ATOM 580 C GLY A 48 4.201 13.604 -3.242 1.00 0.00 C ATOM 581 O GLY A 48 4.225 12.494 -3.763 1.00 0.00 O ATOM 0 H GLY A 48 3.318 13.561 -5.590 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.416 15.565 -4.085 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.858 15.274 -3.337 1.00 0.00 H new ATOM 585 N ALA A 49 4.775 13.847 -2.062 1.00 0.00 N ATOM 586 CA ALA A 49 5.353 12.827 -1.203 1.00 0.00 C ATOM 587 C ALA A 49 4.265 12.521 -0.175 1.00 0.00 C ATOM 588 O ALA A 49 4.399 12.853 1.005 1.00 0.00 O ATOM 589 CB ALA A 49 6.649 13.344 -0.564 1.00 0.00 C ATOM 0 H ALA A 49 4.850 14.787 -1.672 1.00 0.00 H new ATOM 0 HA ALA A 49 5.639 11.923 -1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.072 12.571 0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.364 13.598 -1.346 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.432 14.231 0.032 1.00 0.00 H new ATOM 595 N ASP A 50 3.165 11.943 -0.636 1.00 0.00 N ATOM 596 CA ASP A 50 2.015 11.601 0.193 1.00 0.00 C ATOM 597 C ASP A 50 2.325 10.351 0.999 1.00 0.00 C ATOM 598 O ASP A 50 3.284 9.625 0.732 1.00 0.00 O ATOM 599 CB ASP A 50 0.752 11.357 -0.629 1.00 0.00 C ATOM 600 CG ASP A 50 0.185 12.584 -1.335 1.00 0.00 C ATOM 601 OD1 ASP A 50 0.968 13.322 -1.976 1.00 0.00 O ATOM 602 OD2 ASP A 50 -1.053 12.730 -1.241 1.00 0.00 O ATOM 0 H ASP A 50 3.043 11.693 -1.617 1.00 0.00 H new ATOM 0 HA ASP A 50 1.827 12.451 0.848 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.968 10.595 -1.378 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.016 10.949 0.028 1.00 0.00 H new ATOM 607 N THR A 51 1.516 10.082 2.012 1.00 0.00 N ATOM 608 CA THR A 51 1.685 8.944 2.906 1.00 0.00 C ATOM 609 C THR A 51 0.374 8.152 2.947 1.00 0.00 C ATOM 610 O THR A 51 -0.590 8.627 3.545 1.00 0.00 O ATOM 611 CB THR A 51 2.090 9.472 4.301 1.00 0.00 C ATOM 612 OG1 THR A 51 2.837 10.671 4.226 1.00 0.00 O ATOM 613 CG2 THR A 51 2.960 8.466 5.050 1.00 0.00 C ATOM 0 H THR A 51 0.707 10.659 2.241 1.00 0.00 H new ATOM 0 HA THR A 51 2.470 8.274 2.557 1.00 0.00 H new ATOM 0 HB THR A 51 1.149 9.644 4.824 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.231 11.424 4.064 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.226 8.871 6.027 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.409 7.535 5.181 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.868 8.273 4.478 1.00 0.00 H new ATOM 621 N PHE A 52 0.298 6.974 2.315 1.00 0.00 N ATOM 622 CA PHE A 52 -0.902 6.142 2.297 1.00 0.00 C ATOM 623 C PHE A 52 -0.791 5.157 3.460 1.00 0.00 C ATOM 624 O PHE A 52 -0.013 4.201 3.412 1.00 0.00 O ATOM 625 CB PHE A 52 -1.072 5.436 0.939 1.00 0.00 C ATOM 626 CG PHE A 52 -0.859 6.296 -0.295 1.00 0.00 C ATOM 627 CD1 PHE A 52 -1.272 7.643 -0.320 1.00 0.00 C ATOM 628 CD2 PHE A 52 -0.205 5.753 -1.418 1.00 0.00 C ATOM 629 CE1 PHE A 52 -0.974 8.449 -1.429 1.00 0.00 C ATOM 630 CE2 PHE A 52 0.097 6.564 -2.521 1.00 0.00 C ATOM 631 CZ PHE A 52 -0.267 7.917 -2.520 1.00 0.00 C ATOM 0 H PHE A 52 1.079 6.571 1.797 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.797 6.751 2.421 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.375 4.599 0.898 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.077 5.016 0.895 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.818 8.055 0.515 1.00 0.00 H new ATOM 0 HD2 PHE A 52 0.065 4.707 -1.429 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -1.289 9.482 -1.444 1.00 0.00 H new ATOM 0 HE2 PHE A 52 0.611 6.145 -3.373 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.005 8.549 -3.356 1.00 0.00 H new ATOM 641 N VAL A 53 -1.468 5.430 4.569 1.00 0.00 N ATOM 642 CA VAL A 53 -1.430 4.559 5.741 1.00 0.00 C ATOM 643 C VAL A 53 -2.535 3.503 5.589 1.00 0.00 C ATOM 644 O VAL A 53 -3.648 3.835 5.183 1.00 0.00 O ATOM 645 CB VAL A 53 -1.625 5.418 7.005 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.641 4.573 8.289 1.00 0.00 C ATOM 647 CG2 VAL A 53 -0.517 6.475 7.131 1.00 0.00 C ATOM 0 H VAL A 53 -2.056 6.256 4.683 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.472 4.047 5.830 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.594 5.904 6.893 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.781 5.224 9.152 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.459 3.854 8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.695 4.041 8.386 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.680 7.067 8.032 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.452 5.980 7.192 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -0.537 7.129 6.259 1.00 0.00 H new ATOM 657 N PHE A 54 -2.261 2.245 5.944 1.00 0.00 N ATOM 658 CA PHE A 54 -3.208 1.134 5.882 1.00 0.00 C ATOM 659 C PHE A 54 -3.028 0.353 7.178 1.00 0.00 C ATOM 660 O PHE A 54 -2.001 -0.314 7.349 1.00 0.00 O ATOM 661 CB PHE A 54 -2.956 0.229 4.669 1.00 0.00 C ATOM 662 CG PHE A 54 -3.091 0.904 3.322 1.00 0.00 C ATOM 663 CD1 PHE A 54 -4.332 0.930 2.658 1.00 0.00 C ATOM 664 CD2 PHE A 54 -1.964 1.491 2.721 1.00 0.00 C ATOM 665 CE1 PHE A 54 -4.445 1.551 1.403 1.00 0.00 C ATOM 666 CE2 PHE A 54 -2.076 2.093 1.458 1.00 0.00 C ATOM 667 CZ PHE A 54 -3.315 2.133 0.805 1.00 0.00 C ATOM 0 H PHE A 54 -1.344 1.965 6.293 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.226 1.508 5.770 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.952 -0.188 4.749 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.653 -0.608 4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -5.198 0.472 3.114 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -1.012 1.479 3.231 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -5.399 1.581 0.899 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -1.205 2.526 0.989 1.00 0.00 H new ATOM 0 HZ PHE A 54 -3.401 2.612 -0.159 1.00 0.00 H new ATOM 677 N SER A 55 -3.954 0.476 8.133 1.00 0.00 N ATOM 678 CA SER A 55 -3.817 -0.244 9.387 1.00 0.00 C ATOM 679 C SER A 55 -5.137 -0.529 10.102 1.00 0.00 C ATOM 680 O SER A 55 -5.393 0.036 11.176 1.00 0.00 O ATOM 681 CB SER A 55 -2.728 0.389 10.281 1.00 0.00 C ATOM 682 OG SER A 55 -2.659 1.809 10.256 1.00 0.00 O ATOM 0 H SER A 55 -4.789 1.057 8.059 1.00 0.00 H new ATOM 0 HA SER A 55 -3.465 -1.244 9.132 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.897 0.070 11.309 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.759 -0.009 9.979 1.00 0.00 H new ATOM 0 HG SER A 55 -1.943 2.112 10.853 1.00 0.00 H new ATOM 688 N ALA A 56 -5.986 -1.392 9.521 1.00 0.00 N ATOM 689 CA ALA A 56 -7.236 -1.775 10.143 1.00 0.00 C ATOM 690 C ALA A 56 -7.506 -3.261 9.938 1.00 0.00 C ATOM 691 O ALA A 56 -7.040 -3.889 8.980 1.00 0.00 O ATOM 692 CB ALA A 56 -8.394 -0.896 9.663 1.00 0.00 C ATOM 0 H ALA A 56 -5.816 -1.832 8.617 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.150 -1.608 11.217 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -9.317 -1.212 10.150 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.189 0.145 9.914 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.502 -0.995 8.583 1.00 0.00 H new ATOM 698 N ARG A 57 -8.300 -3.829 10.848 1.00 0.00 N ATOM 699 CA ARG A 57 -8.673 -5.241 10.832 1.00 0.00 C ATOM 700 C ARG A 57 -9.439 -5.543 9.560 1.00 0.00 C ATOM 701 O ARG A 57 -9.086 -6.477 8.843 1.00 0.00 O ATOM 702 CB ARG A 57 -9.483 -5.584 12.085 1.00 0.00 C ATOM 703 CG ARG A 57 -8.575 -5.595 13.327 1.00 0.00 C ATOM 704 CD ARG A 57 -9.396 -5.595 14.613 1.00 0.00 C ATOM 705 NE ARG A 57 -10.114 -4.324 14.799 1.00 0.00 N ATOM 706 CZ ARG A 57 -10.870 -3.978 15.842 1.00 0.00 C ATOM 707 NH1 ARG A 57 -11.083 -4.843 16.832 1.00 0.00 N ATOM 708 NH2 ARG A 57 -11.406 -2.765 15.874 1.00 0.00 N ATOM 0 H ARG A 57 -8.707 -3.312 11.627 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.779 -5.864 10.844 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -10.283 -4.856 12.219 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.956 -6.559 11.964 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.933 -6.475 13.303 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.921 -4.723 13.310 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -10.111 -6.417 14.588 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.739 -5.770 15.465 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.024 -3.635 14.052 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.667 -5.774 16.794 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.662 -4.575 17.628 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.238 -2.113 15.108 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.987 -2.485 16.664 1.00 0.00 H new ATOM 722 N GLU A 58 -10.469 -4.769 9.241 1.00 0.00 N ATOM 723 CA GLU A 58 -11.221 -4.999 8.027 1.00 0.00 C ATOM 724 C GLU A 58 -10.366 -4.706 6.787 1.00 0.00 C ATOM 725 O GLU A 58 -10.525 -5.408 5.791 1.00 0.00 O ATOM 726 CB GLU A 58 -12.450 -4.093 8.008 1.00 0.00 C ATOM 727 CG GLU A 58 -13.545 -4.440 9.024 1.00 0.00 C ATOM 728 CD GLU A 58 -13.536 -3.499 10.229 1.00 0.00 C ATOM 729 OE1 GLU A 58 -12.502 -3.468 10.939 1.00 0.00 O ATOM 730 OE2 GLU A 58 -14.552 -2.809 10.475 1.00 0.00 O ATOM 0 H GLU A 58 -10.796 -3.984 9.805 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.523 -6.046 8.006 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.126 -3.068 8.186 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -12.884 -4.121 7.009 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -14.519 -4.393 8.536 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -13.409 -5.466 9.366 1.00 0.00 H new ATOM 737 N ASP A 59 -9.423 -3.752 6.852 1.00 0.00 N ATOM 738 CA ASP A 59 -8.578 -3.362 5.716 1.00 0.00 C ATOM 739 C ASP A 59 -7.453 -4.336 5.373 1.00 0.00 C ATOM 740 O ASP A 59 -6.606 -4.127 4.510 1.00 0.00 O ATOM 741 CB ASP A 59 -8.060 -1.942 5.990 1.00 0.00 C ATOM 742 CG ASP A 59 -7.437 -1.229 4.791 1.00 0.00 C ATOM 743 OD1 ASP A 59 -7.737 -1.597 3.633 1.00 0.00 O ATOM 744 OD2 ASP A 59 -6.701 -0.250 5.036 1.00 0.00 O ATOM 0 H ASP A 59 -9.225 -3.226 7.703 1.00 0.00 H new ATOM 0 HA ASP A 59 -9.194 -3.388 4.817 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -8.887 -1.337 6.361 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.318 -1.992 6.787 1.00 0.00 H new ATOM 749 N SER A 60 -7.442 -5.440 6.088 1.00 0.00 N ATOM 750 CA SER A 60 -6.472 -6.493 5.956 1.00 0.00 C ATOM 751 C SER A 60 -6.652 -7.335 4.691 1.00 0.00 C ATOM 752 O SER A 60 -5.651 -7.704 4.081 1.00 0.00 O ATOM 753 CB SER A 60 -6.588 -7.372 7.196 1.00 0.00 C ATOM 754 OG SER A 60 -6.270 -6.659 8.390 1.00 0.00 O ATOM 0 H SER A 60 -8.141 -5.631 6.806 1.00 0.00 H new ATOM 0 HA SER A 60 -5.483 -6.044 5.866 1.00 0.00 H new ATOM 0 HB2 SER A 60 -7.602 -7.765 7.268 1.00 0.00 H new ATOM 0 HB3 SER A 60 -5.921 -8.228 7.097 1.00 0.00 H new ATOM 0 HG SER A 60 -7.096 -6.437 8.869 1.00 0.00 H new ATOM 760 N TYR A 61 -7.874 -7.753 4.348 1.00 0.00 N ATOM 761 CA TYR A 61 -8.146 -8.591 3.184 1.00 0.00 C ATOM 762 C TYR A 61 -9.638 -8.595 2.868 1.00 0.00 C ATOM 763 O TYR A 61 -10.437 -7.912 3.508 1.00 0.00 O ATOM 764 CB TYR A 61 -7.648 -10.027 3.483 1.00 0.00 C ATOM 765 CG TYR A 61 -7.988 -10.596 4.850 1.00 0.00 C ATOM 766 CD1 TYR A 61 -9.309 -10.972 5.150 1.00 0.00 C ATOM 767 CD2 TYR A 61 -6.969 -10.809 5.799 1.00 0.00 C ATOM 768 CE1 TYR A 61 -9.610 -11.581 6.379 1.00 0.00 C ATOM 769 CE2 TYR A 61 -7.264 -11.417 7.033 1.00 0.00 C ATOM 770 CZ TYR A 61 -8.586 -11.819 7.322 1.00 0.00 C ATOM 771 OH TYR A 61 -8.858 -12.486 8.476 1.00 0.00 O ATOM 0 H TYR A 61 -8.711 -7.514 4.880 1.00 0.00 H new ATOM 0 HA TYR A 61 -7.623 -8.196 2.313 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -8.058 -10.694 2.725 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -6.564 -10.042 3.368 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -10.096 -10.792 4.432 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -5.957 -10.504 5.578 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -10.627 -11.868 6.604 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -6.480 -11.576 7.758 1.00 0.00 H new ATOM 0 HH TYR A 61 -8.040 -12.563 9.010 1.00 0.00 H new ATOM 781 N ARG A 62 -10.004 -9.353 1.831 1.00 0.00 N ATOM 782 CA ARG A 62 -11.368 -9.533 1.358 1.00 0.00 C ATOM 783 C ARG A 62 -11.741 -11.002 1.486 1.00 0.00 C ATOM 784 O ARG A 62 -10.868 -11.874 1.414 1.00 0.00 O ATOM 785 CB ARG A 62 -11.533 -8.975 -0.062 1.00 0.00 C ATOM 786 CG ARG A 62 -10.452 -9.301 -1.112 1.00 0.00 C ATOM 787 CD ARG A 62 -10.872 -10.383 -2.111 1.00 0.00 C ATOM 788 NE ARG A 62 -11.138 -11.689 -1.483 1.00 0.00 N ATOM 789 CZ ARG A 62 -12.042 -12.582 -1.910 1.00 0.00 C ATOM 790 NH1 ARG A 62 -12.743 -12.368 -3.018 1.00 0.00 N ATOM 791 NH2 ARG A 62 -12.252 -13.698 -1.227 1.00 0.00 N ATOM 0 H ARG A 62 -9.325 -9.877 1.279 1.00 0.00 H new ATOM 0 HA ARG A 62 -12.065 -8.963 1.973 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -12.488 -9.330 -0.449 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -11.604 -7.890 0.015 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.202 -8.391 -1.658 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.546 -9.624 -0.600 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.767 -10.053 -2.638 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.088 -10.501 -2.859 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.591 -11.933 -0.658 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.597 -11.514 -3.557 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -13.427 -13.057 -3.330 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.725 -13.880 -0.373 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.941 -14.375 -1.555 1.00 0.00 H new ATOM 805 N THR A 63 -13.030 -11.283 1.609 1.00 0.00 N ATOM 806 CA THR A 63 -13.565 -12.631 1.770 1.00 0.00 C ATOM 807 C THR A 63 -14.853 -12.816 0.967 1.00 0.00 C ATOM 808 O THR A 63 -15.267 -11.955 0.185 1.00 0.00 O ATOM 809 CB THR A 63 -13.765 -12.934 3.273 1.00 0.00 C ATOM 810 OG1 THR A 63 -14.370 -11.847 3.955 1.00 0.00 O ATOM 811 CG2 THR A 63 -12.440 -13.306 3.943 1.00 0.00 C ATOM 0 H THR A 63 -13.753 -10.563 1.600 1.00 0.00 H new ATOM 0 HA THR A 63 -12.849 -13.349 1.372 1.00 0.00 H new ATOM 0 HB THR A 63 -14.440 -13.788 3.337 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.482 -12.076 4.901 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.612 -13.514 4.999 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.025 -14.192 3.462 1.00 0.00 H new ATOM 0 HG23 THR A 63 -11.738 -12.478 3.846 1.00 0.00 H new ATOM 819 N ASP A 64 -15.421 -14.014 1.070 1.00 0.00 N ATOM 820 CA ASP A 64 -16.666 -14.442 0.451 1.00 0.00 C ATOM 821 C ASP A 64 -17.798 -13.569 0.998 1.00 0.00 C ATOM 822 O ASP A 64 -18.546 -12.983 0.217 1.00 0.00 O ATOM 823 CB ASP A 64 -16.913 -15.939 0.733 1.00 0.00 C ATOM 824 CG ASP A 64 -17.110 -16.270 2.217 1.00 0.00 C ATOM 825 OD1 ASP A 64 -16.335 -15.750 3.051 1.00 0.00 O ATOM 826 OD2 ASP A 64 -18.038 -17.038 2.562 1.00 0.00 O ATOM 0 H ASP A 64 -14.995 -14.757 1.624 1.00 0.00 H new ATOM 0 HA ASP A 64 -16.617 -14.324 -0.631 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -17.795 -16.262 0.179 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.069 -16.514 0.352 1.00 0.00 H new ATOM 831 N THR A 65 -17.871 -13.392 2.318 1.00 0.00 N ATOM 832 CA THR A 65 -18.890 -12.603 2.995 1.00 0.00 C ATOM 833 C THR A 65 -18.747 -11.094 2.799 1.00 0.00 C ATOM 834 O THR A 65 -19.763 -10.402 2.822 1.00 0.00 O ATOM 835 CB THR A 65 -18.873 -12.935 4.487 1.00 0.00 C ATOM 836 OG1 THR A 65 -17.547 -12.940 5.007 1.00 0.00 O ATOM 837 CG2 THR A 65 -19.516 -14.295 4.761 1.00 0.00 C ATOM 0 H THR A 65 -17.199 -13.809 2.962 1.00 0.00 H new ATOM 0 HA THR A 65 -19.844 -12.873 2.541 1.00 0.00 H new ATOM 0 HB THR A 65 -19.449 -12.155 4.985 1.00 0.00 H new ATOM 0 HG1 THR A 65 -17.571 -13.154 5.963 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.488 -14.502 5.831 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.551 -14.283 4.421 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.967 -15.071 4.227 1.00 0.00 H new ATOM 845 N ALA A 66 -17.529 -10.557 2.651 1.00 0.00 N ATOM 846 CA ALA A 66 -17.340 -9.122 2.480 1.00 0.00 C ATOM 847 C ALA A 66 -15.992 -8.819 1.837 1.00 0.00 C ATOM 848 O ALA A 66 -14.981 -9.415 2.201 1.00 0.00 O ATOM 849 CB ALA A 66 -17.404 -8.455 3.859 1.00 0.00 C ATOM 0 H ALA A 66 -16.665 -11.099 2.647 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.123 -8.737 1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.264 -7.380 3.750 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.375 -8.650 4.313 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -16.618 -8.860 4.496 1.00 0.00 H new ATOM 855 N VAL A 67 -15.962 -7.861 0.917 1.00 0.00 N ATOM 856 CA VAL A 67 -14.778 -7.423 0.194 1.00 0.00 C ATOM 857 C VAL A 67 -14.438 -6.001 0.636 1.00 0.00 C ATOM 858 O VAL A 67 -15.310 -5.138 0.683 1.00 0.00 O ATOM 859 CB VAL A 67 -15.027 -7.496 -1.332 1.00 0.00 C ATOM 860 CG1 VAL A 67 -13.782 -7.211 -2.182 1.00 0.00 C ATOM 861 CG2 VAL A 67 -15.553 -8.876 -1.767 1.00 0.00 C ATOM 0 H VAL A 67 -16.800 -7.347 0.644 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.935 -8.076 0.418 1.00 0.00 H new ATOM 0 HB VAL A 67 -15.768 -6.716 -1.507 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.039 -7.282 -3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.414 -6.208 -1.964 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -13.007 -7.941 -1.948 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.713 -8.881 -2.845 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.824 -9.642 -1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -16.495 -9.083 -1.259 1.00 0.00 H new ATOM 871 N PHE A 68 -13.158 -5.759 0.908 1.00 0.00 N ATOM 872 CA PHE A 68 -12.605 -4.474 1.325 1.00 0.00 C ATOM 873 C PHE A 68 -11.418 -4.207 0.384 1.00 0.00 C ATOM 874 O PHE A 68 -10.279 -4.041 0.808 1.00 0.00 O ATOM 875 CB PHE A 68 -12.213 -4.543 2.816 1.00 0.00 C ATOM 876 CG PHE A 68 -13.294 -5.058 3.755 1.00 0.00 C ATOM 877 CD1 PHE A 68 -13.475 -6.445 3.924 1.00 0.00 C ATOM 878 CD2 PHE A 68 -14.112 -4.165 4.471 1.00 0.00 C ATOM 879 CE1 PHE A 68 -14.461 -6.936 4.793 1.00 0.00 C ATOM 880 CE2 PHE A 68 -15.108 -4.655 5.335 1.00 0.00 C ATOM 881 CZ PHE A 68 -15.283 -6.040 5.496 1.00 0.00 C ATOM 0 H PHE A 68 -12.446 -6.487 0.841 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.314 -3.650 1.250 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.336 -5.183 2.914 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.918 -3.546 3.142 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -12.849 -7.137 3.380 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -13.975 -3.100 4.357 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -14.588 -8.001 4.921 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.739 -3.965 5.876 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.048 -6.415 6.159 1.00 0.00 H new ATOM 891 N ASN A 69 -11.666 -4.318 -0.925 1.00 0.00 N ATOM 892 CA ASN A 69 -10.684 -4.125 -1.967 1.00 0.00 C ATOM 893 C ASN A 69 -10.348 -2.652 -2.211 1.00 0.00 C ATOM 894 O ASN A 69 -11.213 -1.875 -2.597 1.00 0.00 O ATOM 895 CB ASN A 69 -11.112 -4.810 -3.274 1.00 0.00 C ATOM 896 CG ASN A 69 -12.315 -4.156 -3.950 1.00 0.00 C ATOM 897 OD1 ASN A 69 -13.446 -4.259 -3.464 1.00 0.00 O ATOM 898 ND2 ASN A 69 -12.094 -3.540 -5.096 1.00 0.00 N ATOM 0 H ASN A 69 -12.590 -4.553 -1.288 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.770 -4.599 -1.610 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -10.271 -4.805 -3.967 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.348 -5.854 -3.066 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -12.872 -3.129 -5.612 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -11.146 -3.475 -5.466 1.00 0.00 H new ATOM 905 N ASP A 70 -9.092 -2.280 -1.999 1.00 0.00 N ATOM 906 CA ASP A 70 -8.572 -0.923 -2.199 1.00 0.00 C ATOM 907 C ASP A 70 -8.168 -0.751 -3.675 1.00 0.00 C ATOM 908 O ASP A 70 -7.910 -1.741 -4.386 1.00 0.00 O ATOM 909 CB ASP A 70 -7.400 -0.725 -1.216 1.00 0.00 C ATOM 910 CG ASP A 70 -6.353 0.331 -1.598 1.00 0.00 C ATOM 911 OD1 ASP A 70 -6.714 1.391 -2.149 1.00 0.00 O ATOM 912 OD2 ASP A 70 -5.160 0.038 -1.370 1.00 0.00 O ATOM 0 H ASP A 70 -8.379 -2.932 -1.672 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.319 -0.157 -1.992 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -7.813 -0.459 -0.243 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.891 -1.681 -1.096 1.00 0.00 H new ATOM 917 N LEU A 71 -8.230 0.482 -4.182 1.00 0.00 N ATOM 918 CA LEU A 71 -7.869 0.877 -5.540 1.00 0.00 C ATOM 919 C LEU A 71 -7.087 2.194 -5.470 1.00 0.00 C ATOM 920 O LEU A 71 -7.689 3.251 -5.294 1.00 0.00 O ATOM 921 CB LEU A 71 -9.123 0.993 -6.425 1.00 0.00 C ATOM 922 CG LEU A 71 -8.855 1.619 -7.816 1.00 0.00 C ATOM 923 CD1 LEU A 71 -7.841 0.853 -8.672 1.00 0.00 C ATOM 924 CD2 LEU A 71 -10.173 1.691 -8.595 1.00 0.00 C ATOM 0 H LEU A 71 -8.551 1.273 -3.624 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.237 0.117 -5.999 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.553 0.000 -6.561 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.868 1.594 -5.905 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.429 2.603 -7.622 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.714 1.361 -9.628 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.883 0.813 -8.153 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.203 -0.161 -8.845 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.992 2.131 -9.576 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -10.579 0.687 -8.717 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.886 2.307 -8.047 1.00 0.00 H new ATOM 936 N ILE A 72 -5.766 2.153 -5.656 1.00 0.00 N ATOM 937 CA ILE A 72 -4.924 3.346 -5.623 1.00 0.00 C ATOM 938 C ILE A 72 -4.890 3.900 -7.047 1.00 0.00 C ATOM 939 O ILE A 72 -4.623 3.145 -7.990 1.00 0.00 O ATOM 940 CB ILE A 72 -3.477 3.004 -5.195 1.00 0.00 C ATOM 941 CG1 ILE A 72 -3.397 2.400 -3.776 1.00 0.00 C ATOM 942 CG2 ILE A 72 -2.563 4.247 -5.267 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.343 0.874 -3.782 1.00 0.00 C ATOM 0 H ILE A 72 -5.252 1.290 -5.834 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.327 4.061 -4.906 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.131 2.250 -5.902 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.512 2.788 -3.271 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -4.262 2.726 -3.199 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.553 3.974 -4.960 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.542 4.625 -6.289 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -2.948 5.020 -4.602 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.288 0.508 -2.757 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.240 0.480 -4.260 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.463 0.543 -4.333 1.00 0.00 H new ATOM 955 N LEU A 73 -5.243 5.169 -7.211 1.00 0.00 N ATOM 956 CA LEU A 73 -5.219 5.916 -8.465 1.00 0.00 C ATOM 957 C LEU A 73 -4.050 6.908 -8.352 1.00 0.00 C ATOM 958 O LEU A 73 -3.608 7.189 -7.241 1.00 0.00 O ATOM 959 CB LEU A 73 -6.555 6.663 -8.685 1.00 0.00 C ATOM 960 CG LEU A 73 -7.397 6.223 -9.891 1.00 0.00 C ATOM 961 CD1 LEU A 73 -6.677 6.440 -11.228 1.00 0.00 C ATOM 962 CD2 LEU A 73 -7.864 4.770 -9.743 1.00 0.00 C ATOM 0 H LEU A 73 -5.572 5.737 -6.430 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.089 5.250 -9.318 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.161 6.549 -7.786 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.338 7.726 -8.790 1.00 0.00 H new ATOM 0 HG LEU A 73 -8.278 6.865 -9.904 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.319 6.111 -12.045 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.448 7.499 -11.350 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -5.751 5.865 -11.240 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.458 4.488 -10.613 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.996 4.115 -9.668 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.471 4.673 -8.843 1.00 0.00 H new ATOM 974 N ASP A 74 -3.593 7.466 -9.473 1.00 0.00 N ATOM 975 CA ASP A 74 -2.513 8.463 -9.583 1.00 0.00 C ATOM 976 C ASP A 74 -1.287 8.111 -8.715 1.00 0.00 C ATOM 977 O ASP A 74 -0.993 8.803 -7.742 1.00 0.00 O ATOM 978 CB ASP A 74 -3.077 9.863 -9.241 1.00 0.00 C ATOM 979 CG ASP A 74 -4.276 10.293 -10.088 1.00 0.00 C ATOM 980 OD1 ASP A 74 -4.278 10.067 -11.320 1.00 0.00 O ATOM 981 OD2 ASP A 74 -5.231 10.911 -9.559 1.00 0.00 O ATOM 0 H ASP A 74 -3.985 7.225 -10.383 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.151 8.463 -10.611 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.368 9.876 -8.191 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.282 10.599 -9.361 1.00 0.00 H new ATOM 986 N PHE A 75 -0.590 7.012 -9.022 1.00 0.00 N ATOM 987 CA PHE A 75 0.577 6.550 -8.262 1.00 0.00 C ATOM 988 C PHE A 75 1.949 6.965 -8.819 1.00 0.00 C ATOM 989 O PHE A 75 2.284 6.626 -9.967 1.00 0.00 O ATOM 990 CB PHE A 75 0.494 5.020 -8.157 1.00 0.00 C ATOM 991 CG PHE A 75 1.481 4.389 -7.190 1.00 0.00 C ATOM 992 CD1 PHE A 75 1.373 4.658 -5.814 1.00 0.00 C ATOM 993 CD2 PHE A 75 2.475 3.501 -7.646 1.00 0.00 C ATOM 994 CE1 PHE A 75 2.241 4.041 -4.897 1.00 0.00 C ATOM 995 CE2 PHE A 75 3.315 2.851 -6.724 1.00 0.00 C ATOM 996 CZ PHE A 75 3.208 3.127 -5.349 1.00 0.00 C ATOM 0 H PHE A 75 -0.822 6.412 -9.813 1.00 0.00 H new ATOM 0 HA PHE A 75 0.526 7.042 -7.291 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.516 4.746 -7.852 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.655 4.594 -9.147 1.00 0.00 H new ATOM 0 HD1 PHE A 75 0.618 5.344 -5.459 1.00 0.00 H new ATOM 0 HD2 PHE A 75 2.592 3.319 -8.704 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.165 4.269 -3.844 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.046 2.137 -7.073 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.865 2.639 -4.644 1.00 0.00 H new ATOM 1006 N GLU A 76 2.771 7.622 -7.999 1.00 0.00 N ATOM 1007 CA GLU A 76 4.119 8.070 -8.280 1.00 0.00 C ATOM 1008 C GLU A 76 5.027 7.600 -7.142 1.00 0.00 C ATOM 1009 O GLU A 76 5.341 8.342 -6.207 1.00 0.00 O ATOM 1010 CB GLU A 76 4.217 9.586 -8.521 1.00 0.00 C ATOM 1011 CG GLU A 76 5.681 9.928 -8.897 1.00 0.00 C ATOM 1012 CD GLU A 76 5.998 11.348 -9.373 1.00 0.00 C ATOM 1013 OE1 GLU A 76 5.107 12.234 -9.407 1.00 0.00 O ATOM 1014 OE2 GLU A 76 7.185 11.564 -9.704 1.00 0.00 O ATOM 0 H GLU A 76 2.482 7.869 -7.053 1.00 0.00 H new ATOM 0 HA GLU A 76 4.448 7.626 -9.220 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.540 9.887 -9.320 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.918 10.132 -7.627 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.304 9.723 -8.026 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.992 9.238 -9.681 1.00 0.00 H new ATOM 1021 N ALA A 77 5.550 6.372 -7.243 1.00 0.00 N ATOM 1022 CA ALA A 77 6.440 5.858 -6.205 1.00 0.00 C ATOM 1023 C ALA A 77 7.753 6.654 -6.099 1.00 0.00 C ATOM 1024 O ALA A 77 8.597 6.319 -5.263 1.00 0.00 O ATOM 1025 CB ALA A 77 6.695 4.364 -6.381 1.00 0.00 C ATOM 0 H ALA A 77 5.375 5.731 -8.017 1.00 0.00 H new ATOM 0 HA ALA A 77 5.924 5.996 -5.255 1.00 0.00 H new ATOM 0 HB1 ALA A 77 7.361 4.013 -5.593 1.00 0.00 H new ATOM 0 HB2 ALA A 77 5.750 3.824 -6.324 1.00 0.00 H new ATOM 0 HB3 ALA A 77 7.157 4.186 -7.352 1.00 0.00 H new ATOM 1031 N SER A 78 8.004 7.635 -6.980 1.00 0.00 N ATOM 1032 CA SER A 78 9.213 8.443 -6.890 1.00 0.00 C ATOM 1033 C SER A 78 9.148 9.293 -5.600 1.00 0.00 C ATOM 1034 O SER A 78 10.200 9.734 -5.121 1.00 0.00 O ATOM 1035 CB SER A 78 9.404 9.293 -8.155 1.00 0.00 C ATOM 1036 OG SER A 78 10.759 9.243 -8.589 1.00 0.00 O ATOM 0 H SER A 78 7.387 7.880 -7.754 1.00 0.00 H new ATOM 0 HA SER A 78 10.090 7.799 -6.830 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.749 8.930 -8.947 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.118 10.325 -7.953 1.00 0.00 H new ATOM 0 HG SER A 78 10.864 9.788 -9.397 1.00 0.00 H new ATOM 1042 N GLU A 79 7.959 9.502 -5.014 1.00 0.00 N ATOM 1043 CA GLU A 79 7.761 10.260 -3.782 1.00 0.00 C ATOM 1044 C GLU A 79 6.686 9.668 -2.867 1.00 0.00 C ATOM 1045 O GLU A 79 6.850 9.821 -1.656 1.00 0.00 O ATOM 1046 CB GLU A 79 7.593 11.770 -4.025 1.00 0.00 C ATOM 1047 CG GLU A 79 6.970 12.251 -5.341 1.00 0.00 C ATOM 1048 CD GLU A 79 6.931 13.787 -5.421 1.00 0.00 C ATOM 1049 OE1 GLU A 79 7.701 14.476 -4.687 1.00 0.00 O ATOM 1050 OE2 GLU A 79 6.283 14.355 -6.316 1.00 0.00 O ATOM 0 H GLU A 79 7.089 9.136 -5.400 1.00 0.00 H new ATOM 0 HA GLU A 79 8.692 10.156 -3.225 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.988 12.168 -3.211 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.579 12.227 -3.942 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.542 11.857 -6.181 1.00 0.00 H new ATOM 0 HG3 GLU A 79 5.958 11.856 -5.431 1.00 0.00 H new ATOM 1057 N ASP A 80 5.703 8.912 -3.370 1.00 0.00 N ATOM 1058 CA ASP A 80 4.643 8.327 -2.538 1.00 0.00 C ATOM 1059 C ASP A 80 5.201 7.365 -1.488 1.00 0.00 C ATOM 1060 O ASP A 80 6.134 6.594 -1.760 1.00 0.00 O ATOM 1061 CB ASP A 80 3.653 7.469 -3.358 1.00 0.00 C ATOM 1062 CG ASP A 80 2.682 8.219 -4.252 1.00 0.00 C ATOM 1063 OD1 ASP A 80 2.323 9.349 -3.892 1.00 0.00 O ATOM 1064 OD2 ASP A 80 2.272 7.591 -5.260 1.00 0.00 O ATOM 0 H ASP A 80 5.619 8.689 -4.362 1.00 0.00 H new ATOM 0 HA ASP A 80 4.153 9.190 -2.087 1.00 0.00 H new ATOM 0 HB2 ASP A 80 4.230 6.785 -3.980 1.00 0.00 H new ATOM 0 HB3 ASP A 80 3.075 6.859 -2.664 1.00 0.00 H new ATOM 1069 N ARG A 81 4.565 7.322 -0.314 1.00 0.00 N ATOM 1070 CA ARG A 81 4.930 6.449 0.801 1.00 0.00 C ATOM 1071 C ARG A 81 3.728 5.585 1.168 1.00 0.00 C ATOM 1072 O ARG A 81 2.585 5.984 0.947 1.00 0.00 O ATOM 1073 CB ARG A 81 5.392 7.223 2.042 1.00 0.00 C ATOM 1074 CG ARG A 81 6.612 8.132 1.893 1.00 0.00 C ATOM 1075 CD ARG A 81 6.314 9.514 1.313 1.00 0.00 C ATOM 1076 NE ARG A 81 5.592 10.369 2.263 1.00 0.00 N ATOM 1077 CZ ARG A 81 6.102 11.302 3.068 1.00 0.00 C ATOM 1078 NH1 ARG A 81 7.407 11.543 3.101 1.00 0.00 N ATOM 1079 NH2 ARG A 81 5.317 11.938 3.917 1.00 0.00 N ATOM 0 H ARG A 81 3.758 7.912 -0.109 1.00 0.00 H new ATOM 0 HA ARG A 81 5.771 5.838 0.473 1.00 0.00 H new ATOM 0 HB2 ARG A 81 4.558 7.834 2.387 1.00 0.00 H new ATOM 0 HB3 ARG A 81 5.605 6.500 2.829 1.00 0.00 H new ATOM 0 HG2 ARG A 81 7.077 8.256 2.871 1.00 0.00 H new ATOM 0 HG3 ARG A 81 7.342 7.635 1.254 1.00 0.00 H new ATOM 0 HD2 ARG A 81 7.249 9.997 1.030 1.00 0.00 H new ATOM 0 HD3 ARG A 81 5.724 9.405 0.403 1.00 0.00 H new ATOM 0 HE ARG A 81 4.582 10.234 2.313 1.00 0.00 H new ATOM 0 HH11 ARG A 81 8.039 11.010 2.504 1.00 0.00 H new ATOM 0 HH12 ARG A 81 7.777 12.261 3.724 1.00 0.00 H new ATOM 0 HH21 ARG A 81 4.322 11.716 3.957 1.00 0.00 H new ATOM 0 HH22 ARG A 81 5.705 12.652 4.534 1.00 0.00 H new ATOM 1093 N ILE A 82 3.961 4.406 1.745 1.00 0.00 N ATOM 1094 CA ILE A 82 2.915 3.469 2.137 1.00 0.00 C ATOM 1095 C ILE A 82 3.256 2.877 3.505 1.00 0.00 C ATOM 1096 O ILE A 82 4.241 2.145 3.634 1.00 0.00 O ATOM 1097 CB ILE A 82 2.705 2.363 1.068 1.00 0.00 C ATOM 1098 CG1 ILE A 82 2.212 2.866 -0.300 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.654 1.356 1.569 1.00 0.00 C ATOM 1100 CD1 ILE A 82 3.263 3.525 -1.198 1.00 0.00 C ATOM 0 H ILE A 82 4.901 4.072 1.956 1.00 0.00 H new ATOM 0 HA ILE A 82 1.969 4.006 2.211 1.00 0.00 H new ATOM 0 HB ILE A 82 3.693 1.925 0.926 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.781 2.023 -0.840 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.408 3.582 -0.132 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.507 0.580 0.818 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.999 0.902 2.498 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.711 1.873 1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.798 3.838 -2.133 1.00 0.00 H new ATOM 0 HD12 ILE A 82 3.681 4.395 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.059 2.812 -1.410 1.00 0.00 H new ATOM 1112 N ASP A 83 2.471 3.184 4.541 1.00 0.00 N ATOM 1113 CA ASP A 83 2.688 2.655 5.892 1.00 0.00 C ATOM 1114 C ASP A 83 1.697 1.520 6.121 1.00 0.00 C ATOM 1115 O ASP A 83 0.543 1.775 6.471 1.00 0.00 O ATOM 1116 CB ASP A 83 2.512 3.706 6.991 1.00 0.00 C ATOM 1117 CG ASP A 83 2.983 3.193 8.362 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.263 1.990 8.557 1.00 0.00 O ATOM 1119 OD2 ASP A 83 3.118 4.022 9.294 1.00 0.00 O ATOM 0 H ASP A 83 1.666 3.807 4.468 1.00 0.00 H new ATOM 0 HA ASP A 83 3.721 2.313 5.952 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.073 4.603 6.728 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.462 3.993 7.053 1.00 0.00 H new ATOM 1124 N LEU A 84 2.128 0.275 5.921 1.00 0.00 N ATOM 1125 CA LEU A 84 1.270 -0.901 6.094 1.00 0.00 C ATOM 1126 C LEU A 84 1.934 -2.030 6.886 1.00 0.00 C ATOM 1127 O LEU A 84 1.372 -3.119 6.974 1.00 0.00 O ATOM 1128 CB LEU A 84 0.720 -1.338 4.720 1.00 0.00 C ATOM 1129 CG LEU A 84 1.616 -2.264 3.878 1.00 0.00 C ATOM 1130 CD1 LEU A 84 1.017 -2.447 2.482 1.00 0.00 C ATOM 1131 CD2 LEU A 84 3.076 -1.812 3.742 1.00 0.00 C ATOM 0 H LEU A 84 3.081 0.051 5.635 1.00 0.00 H new ATOM 0 HA LEU A 84 0.423 -0.622 6.721 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.234 -1.841 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.513 -0.441 4.136 1.00 0.00 H new ATOM 0 HG LEU A 84 1.643 -3.205 4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 84 1.658 -3.104 1.894 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.025 -2.890 2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.941 -1.478 1.989 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.624 -2.530 3.132 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.111 -0.831 3.268 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.532 -1.753 4.730 1.00 0.00 H new ATOM 1143 N SER A 85 3.101 -1.790 7.500 1.00 0.00 N ATOM 1144 CA SER A 85 3.838 -2.791 8.279 1.00 0.00 C ATOM 1145 C SER A 85 2.992 -3.508 9.341 1.00 0.00 C ATOM 1146 O SER A 85 3.275 -4.656 9.688 1.00 0.00 O ATOM 1147 CB SER A 85 5.079 -2.156 8.919 1.00 0.00 C ATOM 1148 OG SER A 85 4.871 -0.818 9.358 1.00 0.00 O ATOM 0 H SER A 85 3.565 -0.882 7.468 1.00 0.00 H new ATOM 0 HA SER A 85 4.138 -3.563 7.570 1.00 0.00 H new ATOM 0 HB2 SER A 85 5.391 -2.764 9.768 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.897 -2.170 8.199 1.00 0.00 H new ATOM 0 HG SER A 85 5.637 -0.527 9.896 1.00 0.00 H new ATOM 1154 N ALA A 86 1.960 -2.840 9.858 1.00 0.00 N ATOM 1155 CA ALA A 86 1.060 -3.378 10.861 1.00 0.00 C ATOM 1156 C ALA A 86 0.257 -4.580 10.353 1.00 0.00 C ATOM 1157 O ALA A 86 -0.059 -5.465 11.146 1.00 0.00 O ATOM 1158 CB ALA A 86 0.092 -2.269 11.276 1.00 0.00 C ATOM 0 H ALA A 86 1.727 -1.887 9.579 1.00 0.00 H new ATOM 0 HA ALA A 86 1.660 -3.726 11.701 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -0.596 -2.650 12.031 1.00 0.00 H new ATOM 0 HB2 ALA A 86 0.654 -1.431 11.688 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -0.473 -1.935 10.406 1.00 0.00 H new ATOM 1164 N LEU A 87 -0.046 -4.641 9.051 1.00 0.00 N ATOM 1165 CA LEU A 87 -0.831 -5.702 8.414 1.00 0.00 C ATOM 1166 C LEU A 87 -0.079 -7.030 8.196 1.00 0.00 C ATOM 1167 O LEU A 87 -0.383 -7.785 7.272 1.00 0.00 O ATOM 1168 CB LEU A 87 -1.573 -5.125 7.180 1.00 0.00 C ATOM 1169 CG LEU A 87 -3.051 -4.750 7.464 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -3.262 -3.908 8.733 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -3.622 -3.958 6.282 1.00 0.00 C ATOM 0 H LEU A 87 0.260 -3.927 8.390 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.595 -6.031 9.118 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.043 -4.239 6.829 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.541 -5.856 6.372 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.563 -5.701 7.613 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.323 -3.692 8.854 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.903 -4.462 9.601 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.709 -2.973 8.645 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.660 -3.697 6.487 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.040 -3.047 6.139 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.572 -4.566 5.379 1.00 0.00 H new ATOM 1183 N GLY A 88 0.888 -7.363 9.054 1.00 0.00 N ATOM 1184 CA GLY A 88 1.665 -8.596 9.015 1.00 0.00 C ATOM 1185 C GLY A 88 2.952 -8.511 8.212 1.00 0.00 C ATOM 1186 O GLY A 88 3.022 -9.085 7.127 1.00 0.00 O ATOM 0 H GLY A 88 1.159 -6.753 9.825 1.00 0.00 H new ATOM 0 HA2 GLY A 88 1.909 -8.888 10.036 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.044 -9.388 8.597 1.00 0.00 H new ATOM 1190 N PHE A 89 3.975 -7.828 8.735 1.00 0.00 N ATOM 1191 CA PHE A 89 5.263 -7.700 8.066 1.00 0.00 C ATOM 1192 C PHE A 89 6.407 -7.976 9.027 1.00 0.00 C ATOM 1193 O PHE A 89 6.540 -7.350 10.082 1.00 0.00 O ATOM 1194 CB PHE A 89 5.508 -6.319 7.457 1.00 0.00 C ATOM 1195 CG PHE A 89 4.680 -5.981 6.238 1.00 0.00 C ATOM 1196 CD1 PHE A 89 3.289 -5.804 6.349 1.00 0.00 C ATOM 1197 CD2 PHE A 89 5.311 -5.810 4.991 1.00 0.00 C ATOM 1198 CE1 PHE A 89 2.528 -5.497 5.215 1.00 0.00 C ATOM 1199 CE2 PHE A 89 4.553 -5.471 3.860 1.00 0.00 C ATOM 1200 CZ PHE A 89 3.160 -5.325 3.973 1.00 0.00 C ATOM 0 H PHE A 89 3.928 -7.350 9.635 1.00 0.00 H new ATOM 0 HA PHE A 89 5.229 -8.435 7.262 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.318 -5.566 8.222 1.00 0.00 H new ATOM 0 HB3 PHE A 89 6.562 -6.242 7.190 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.808 -5.905 7.310 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.380 -5.940 4.905 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.456 -5.393 5.295 1.00 0.00 H new ATOM 0 HE2 PHE A 89 5.038 -5.323 2.907 1.00 0.00 H new ATOM 0 HZ PHE A 89 2.573 -5.079 3.101 1.00 0.00 H new ATOM 1210 N SER A 90 7.299 -8.841 8.572 1.00 0.00 N ATOM 1211 CA SER A 90 8.512 -9.299 9.223 1.00 0.00 C ATOM 1212 C SER A 90 9.687 -9.176 8.235 1.00 0.00 C ATOM 1213 O SER A 90 10.844 -9.107 8.660 1.00 0.00 O ATOM 1214 CB SER A 90 8.300 -10.748 9.684 1.00 0.00 C ATOM 1215 OG SER A 90 8.895 -10.987 10.948 1.00 0.00 O ATOM 0 H SER A 90 7.181 -9.277 7.658 1.00 0.00 H new ATOM 0 HA SER A 90 8.746 -8.692 10.098 1.00 0.00 H new ATOM 0 HB2 SER A 90 7.232 -10.960 9.738 1.00 0.00 H new ATOM 0 HB3 SER A 90 8.724 -11.430 8.947 1.00 0.00 H new ATOM 0 HG SER A 90 8.740 -11.918 11.212 1.00 0.00 H new ATOM 1221 N GLY A 91 9.416 -9.091 6.926 1.00 0.00 N ATOM 1222 CA GLY A 91 10.408 -8.981 5.868 1.00 0.00 C ATOM 1223 C GLY A 91 9.834 -9.542 4.572 1.00 0.00 C ATOM 1224 O GLY A 91 8.612 -9.637 4.423 1.00 0.00 O ATOM 0 H GLY A 91 8.460 -9.098 6.569 1.00 0.00 H new ATOM 0 HA2 GLY A 91 10.694 -7.938 5.730 1.00 0.00 H new ATOM 0 HA3 GLY A 91 11.311 -9.525 6.144 1.00 0.00 H new ATOM 1228 N LEU A 92 10.692 -9.819 3.586 1.00 0.00 N ATOM 1229 CA LEU A 92 10.238 -10.383 2.317 1.00 0.00 C ATOM 1230 C LEU A 92 10.021 -11.886 2.501 1.00 0.00 C ATOM 1231 O LEU A 92 10.511 -12.500 3.451 1.00 0.00 O ATOM 1232 CB LEU A 92 11.249 -10.172 1.177 1.00 0.00 C ATOM 1233 CG LEU A 92 11.415 -8.713 0.710 1.00 0.00 C ATOM 1234 CD1 LEU A 92 12.528 -7.995 1.475 1.00 0.00 C ATOM 1235 CD2 LEU A 92 11.752 -8.659 -0.784 1.00 0.00 C ATOM 0 H LEU A 92 11.698 -9.662 3.644 1.00 0.00 H new ATOM 0 HA LEU A 92 9.316 -9.871 2.041 1.00 0.00 H new ATOM 0 HB2 LEU A 92 12.220 -10.546 1.500 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.942 -10.777 0.324 1.00 0.00 H new ATOM 0 HG LEU A 92 10.466 -8.213 0.904 1.00 0.00 H new ATOM 0 HD11 LEU A 92 12.613 -6.969 1.116 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.292 -7.989 2.539 1.00 0.00 H new ATOM 0 HD13 LEU A 92 13.473 -8.515 1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.865 -7.620 -1.094 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.683 -9.196 -0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 92 10.948 -9.123 -1.355 1.00 0.00 H new ATOM 1247 N GLY A 93 9.317 -12.496 1.559 1.00 0.00 N ATOM 1248 CA GLY A 93 9.012 -13.920 1.534 1.00 0.00 C ATOM 1249 C GLY A 93 8.337 -14.278 0.227 1.00 0.00 C ATOM 1250 O GLY A 93 8.967 -14.980 -0.559 1.00 0.00 O ATOM 0 H GLY A 93 8.928 -11.994 0.761 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.928 -14.499 1.651 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.363 -14.177 2.371 1.00 0.00 H new ATOM 1254 N ASP A 94 7.107 -13.772 0.030 1.00 0.00 N ATOM 1255 CA ASP A 94 6.172 -13.885 -1.104 1.00 0.00 C ATOM 1256 C ASP A 94 4.707 -14.094 -0.656 1.00 0.00 C ATOM 1257 O ASP A 94 4.018 -15.000 -1.127 1.00 0.00 O ATOM 1258 CB ASP A 94 6.645 -14.865 -2.183 1.00 0.00 C ATOM 1259 CG ASP A 94 5.847 -14.778 -3.476 1.00 0.00 C ATOM 1260 OD1 ASP A 94 6.035 -13.779 -4.188 1.00 0.00 O ATOM 1261 OD2 ASP A 94 5.150 -15.757 -3.857 1.00 0.00 O ATOM 0 H ASP A 94 6.690 -13.197 0.762 1.00 0.00 H new ATOM 0 HA ASP A 94 6.178 -12.913 -1.598 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.696 -14.674 -2.401 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.580 -15.881 -1.793 1.00 0.00 H new ATOM 1266 N GLY A 95 4.218 -13.282 0.294 1.00 0.00 N ATOM 1267 CA GLY A 95 2.834 -13.344 0.785 1.00 0.00 C ATOM 1268 C GLY A 95 2.534 -14.478 1.751 1.00 0.00 C ATOM 1269 O GLY A 95 1.519 -15.159 1.611 1.00 0.00 O ATOM 0 H GLY A 95 4.777 -12.558 0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 95 2.598 -12.400 1.276 1.00 0.00 H new ATOM 0 HA3 GLY A 95 2.166 -13.433 -0.072 1.00 0.00 H new ATOM 1273 N TYR A 96 3.399 -14.670 2.738 1.00 0.00 N ATOM 1274 CA TYR A 96 3.272 -15.681 3.774 1.00 0.00 C ATOM 1275 C TYR A 96 3.181 -14.972 5.124 1.00 0.00 C ATOM 1276 O TYR A 96 2.934 -13.769 5.178 1.00 0.00 O ATOM 1277 CB TYR A 96 4.414 -16.703 3.692 1.00 0.00 C ATOM 1278 CG TYR A 96 4.041 -18.064 4.245 1.00 0.00 C ATOM 1279 CD1 TYR A 96 3.166 -18.885 3.512 1.00 0.00 C ATOM 1280 CD2 TYR A 96 4.540 -18.508 5.483 1.00 0.00 C ATOM 1281 CE1 TYR A 96 2.800 -20.149 3.997 1.00 0.00 C ATOM 1282 CE2 TYR A 96 4.166 -19.767 5.985 1.00 0.00 C ATOM 1283 CZ TYR A 96 3.302 -20.596 5.237 1.00 0.00 C ATOM 1284 OH TYR A 96 2.912 -21.795 5.732 1.00 0.00 O ATOM 0 H TYR A 96 4.240 -14.103 2.841 1.00 0.00 H new ATOM 0 HA TYR A 96 2.361 -16.264 3.636 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.720 -16.813 2.652 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.275 -16.320 4.239 1.00 0.00 H new ATOM 0 HD1 TYR A 96 2.772 -18.539 2.568 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.212 -17.880 6.049 1.00 0.00 H new ATOM 0 HE1 TYR A 96 2.136 -20.778 3.423 1.00 0.00 H new ATOM 0 HE2 TYR A 96 4.539 -20.100 6.942 1.00 0.00 H new ATOM 0 HH TYR A 96 3.351 -21.952 6.594 1.00 0.00 H new ATOM 1294 N GLY A 97 3.343 -15.736 6.198 1.00 0.00 N ATOM 1295 CA GLY A 97 3.308 -15.427 7.621 1.00 0.00 C ATOM 1296 C GLY A 97 4.257 -14.324 8.063 1.00 0.00 C ATOM 1297 O GLY A 97 5.176 -14.557 8.850 1.00 0.00 O ATOM 0 H GLY A 97 3.529 -16.731 6.069 1.00 0.00 H new ATOM 0 HA2 GLY A 97 2.291 -15.140 7.890 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.542 -16.333 8.180 1.00 0.00 H new ATOM 1301 N GLY A 98 3.974 -13.125 7.581 1.00 0.00 N ATOM 1302 CA GLY A 98 4.696 -11.891 7.828 1.00 0.00 C ATOM 1303 C GLY A 98 5.453 -11.420 6.587 1.00 0.00 C ATOM 1304 O GLY A 98 6.457 -10.721 6.735 1.00 0.00 O ATOM 0 H GLY A 98 3.176 -12.980 6.963 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.996 -11.117 8.143 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.398 -12.038 8.648 1.00 0.00 H new ATOM 1308 N THR A 99 5.048 -11.827 5.379 1.00 0.00 N ATOM 1309 CA THR A 99 5.722 -11.449 4.142 1.00 0.00 C ATOM 1310 C THR A 99 4.725 -10.955 3.085 1.00 0.00 C ATOM 1311 O THR A 99 3.510 -10.999 3.304 1.00 0.00 O ATOM 1312 CB THR A 99 6.685 -12.565 3.711 1.00 0.00 C ATOM 1313 OG1 THR A 99 6.016 -13.667 3.141 1.00 0.00 O ATOM 1314 CG2 THR A 99 7.573 -13.096 4.850 1.00 0.00 C ATOM 0 H THR A 99 4.239 -12.431 5.236 1.00 0.00 H new ATOM 0 HA THR A 99 6.358 -10.578 4.301 1.00 0.00 H new ATOM 0 HB THR A 99 7.318 -12.082 2.967 1.00 0.00 H new ATOM 0 HG1 THR A 99 6.434 -14.498 3.448 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.225 -13.881 4.467 1.00 0.00 H new ATOM 0 HG22 THR A 99 8.180 -12.282 5.248 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.944 -13.501 5.643 1.00 0.00 H new ATOM 1322 N LEU A 100 5.209 -10.497 1.919 1.00 0.00 N ATOM 1323 CA LEU A 100 4.330 -9.952 0.877 1.00 0.00 C ATOM 1324 C LEU A 100 4.811 -10.327 -0.521 1.00 0.00 C ATOM 1325 O LEU A 100 5.998 -10.566 -0.716 1.00 0.00 O ATOM 1326 CB LEU A 100 4.283 -8.424 1.111 1.00 0.00 C ATOM 1327 CG LEU A 100 3.563 -7.571 0.046 1.00 0.00 C ATOM 1328 CD1 LEU A 100 2.969 -6.303 0.657 1.00 0.00 C ATOM 1329 CD2 LEU A 100 4.530 -7.090 -1.033 1.00 0.00 C ATOM 0 H LEU A 100 6.200 -10.494 1.677 1.00 0.00 H new ATOM 0 HA LEU A 100 3.327 -10.373 0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.800 -8.244 2.072 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.308 -8.063 1.197 1.00 0.00 H new ATOM 0 HG LEU A 100 2.789 -8.215 -0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.469 -5.725 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 100 2.248 -6.574 1.428 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.766 -5.704 1.099 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.989 -6.492 -1.766 1.00 0.00 H new ATOM 0 HD22 LEU A 100 5.312 -6.483 -0.576 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.981 -7.951 -1.528 1.00 0.00 H new ATOM 1341 N LEU A 101 3.887 -10.421 -1.471 1.00 0.00 N ATOM 1342 CA LEU A 101 4.063 -10.737 -2.885 1.00 0.00 C ATOM 1343 C LEU A 101 3.687 -9.483 -3.667 1.00 0.00 C ATOM 1344 O LEU A 101 2.783 -8.754 -3.265 1.00 0.00 O ATOM 1345 CB LEU A 101 3.142 -11.915 -3.259 1.00 0.00 C ATOM 1346 CG LEU A 101 2.747 -11.993 -4.752 1.00 0.00 C ATOM 1347 CD1 LEU A 101 3.862 -12.356 -5.736 1.00 0.00 C ATOM 1348 CD2 LEU A 101 1.642 -13.025 -4.921 1.00 0.00 C ATOM 0 H LEU A 101 2.904 -10.263 -1.250 1.00 0.00 H new ATOM 0 HA LEU A 101 5.088 -11.029 -3.112 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.638 -12.845 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.233 -11.848 -2.662 1.00 0.00 H new ATOM 0 HG LEU A 101 2.444 -10.976 -5.001 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.460 -12.379 -6.749 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.656 -11.611 -5.677 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.265 -13.337 -5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.358 -13.085 -5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.999 -13.999 -4.585 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.776 -12.731 -4.328 1.00 0.00 H new ATOM 1360 N LEU A 102 4.365 -9.253 -4.786 1.00 0.00 N ATOM 1361 CA LEU A 102 4.185 -8.160 -5.724 1.00 0.00 C ATOM 1362 C LEU A 102 4.051 -8.815 -7.089 1.00 0.00 C ATOM 1363 O LEU A 102 4.849 -9.701 -7.410 1.00 0.00 O ATOM 1364 CB LEU A 102 5.359 -7.187 -5.695 1.00 0.00 C ATOM 1365 CG LEU A 102 5.476 -6.418 -4.373 1.00 0.00 C ATOM 1366 CD1 LEU A 102 6.682 -6.929 -3.580 1.00 0.00 C ATOM 1367 CD2 LEU A 102 5.610 -4.913 -4.607 1.00 0.00 C ATOM 0 H LEU A 102 5.114 -9.879 -5.081 1.00 0.00 H new ATOM 0 HA LEU A 102 3.307 -7.565 -5.470 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.283 -7.738 -5.870 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.252 -6.475 -6.513 1.00 0.00 H new ATOM 0 HG LEU A 102 4.562 -6.589 -3.804 1.00 0.00 H new ATOM 0 HD11 LEU A 102 6.760 -6.379 -2.642 1.00 0.00 H new ATOM 0 HD12 LEU A 102 6.555 -7.991 -3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 102 7.590 -6.781 -4.164 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.690 -4.401 -3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.503 -4.715 -5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 102 4.732 -4.548 -5.140 1.00 0.00 H new ATOM 1379 N LYS A 103 3.076 -8.417 -7.900 1.00 0.00 N ATOM 1380 CA LYS A 103 2.830 -8.993 -9.209 1.00 0.00 C ATOM 1381 C LYS A 103 2.307 -7.901 -10.140 1.00 0.00 C ATOM 1382 O LYS A 103 1.364 -7.184 -9.810 1.00 0.00 O ATOM 1383 CB LYS A 103 1.810 -10.137 -9.000 1.00 0.00 C ATOM 1384 CG LYS A 103 1.944 -11.332 -9.948 1.00 0.00 C ATOM 1385 CD LYS A 103 1.620 -10.962 -11.393 1.00 0.00 C ATOM 1386 CE LYS A 103 1.433 -12.221 -12.234 1.00 0.00 C ATOM 1387 NZ LYS A 103 1.000 -11.883 -13.601 1.00 0.00 N ATOM 0 H LYS A 103 2.425 -7.671 -7.657 1.00 0.00 H new ATOM 0 HA LYS A 103 3.731 -9.396 -9.672 1.00 0.00 H new ATOM 0 HB2 LYS A 103 1.903 -10.498 -7.976 1.00 0.00 H new ATOM 0 HB3 LYS A 103 0.806 -9.726 -9.104 1.00 0.00 H new ATOM 0 HG2 LYS A 103 2.960 -11.724 -9.894 1.00 0.00 H new ATOM 0 HG3 LYS A 103 1.277 -12.130 -9.621 1.00 0.00 H new ATOM 0 HD2 LYS A 103 0.714 -10.357 -11.426 1.00 0.00 H new ATOM 0 HD3 LYS A 103 2.424 -10.355 -11.809 1.00 0.00 H new ATOM 0 HE2 LYS A 103 2.368 -12.779 -12.273 1.00 0.00 H new ATOM 0 HE3 LYS A 103 0.694 -12.870 -11.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 0.017 -12.192 -13.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 1.063 -10.854 -13.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 1.615 -12.364 -14.289 1.00 0.00 H new ATOM 1401 N THR A 104 2.866 -7.768 -11.334 1.00 0.00 N ATOM 1402 CA THR A 104 2.409 -6.760 -12.275 1.00 0.00 C ATOM 1403 C THR A 104 1.353 -7.400 -13.184 1.00 0.00 C ATOM 1404 O THR A 104 1.302 -8.627 -13.361 1.00 0.00 O ATOM 1405 CB THR A 104 3.623 -6.219 -13.052 1.00 0.00 C ATOM 1406 OG1 THR A 104 4.491 -7.266 -13.443 1.00 0.00 O ATOM 1407 CG2 THR A 104 4.430 -5.239 -12.194 1.00 0.00 C ATOM 0 H THR A 104 3.636 -8.345 -11.672 1.00 0.00 H new ATOM 0 HA THR A 104 1.946 -5.911 -11.772 1.00 0.00 H new ATOM 0 HB THR A 104 3.230 -5.714 -13.934 1.00 0.00 H new ATOM 0 HG1 THR A 104 5.252 -6.893 -13.936 1.00 0.00 H new ATOM 0 HG21 THR A 104 5.282 -4.871 -12.766 1.00 0.00 H new ATOM 0 HG22 THR A 104 3.796 -4.400 -11.907 1.00 0.00 H new ATOM 0 HG23 THR A 104 4.786 -5.748 -11.298 1.00 0.00 H new ATOM 1415 N ASN A 105 0.448 -6.584 -13.735 1.00 0.00 N ATOM 1416 CA ASN A 105 -0.583 -7.083 -14.647 1.00 0.00 C ATOM 1417 C ASN A 105 0.084 -7.680 -15.897 1.00 0.00 C ATOM 1418 O ASN A 105 1.279 -7.464 -16.103 1.00 0.00 O ATOM 1419 CB ASN A 105 -1.624 -6.035 -14.955 1.00 0.00 C ATOM 1420 CG ASN A 105 -2.728 -6.543 -15.873 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -3.199 -7.663 -15.697 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -3.112 -5.821 -16.902 1.00 0.00 N ATOM 0 H ASN A 105 0.410 -5.579 -13.565 1.00 0.00 H new ATOM 0 HA ASN A 105 -1.138 -7.884 -14.159 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -2.067 -5.686 -14.022 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.140 -5.176 -15.419 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.802 -6.191 -17.556 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -2.720 -4.891 -17.047 1.00 0.00 H new ATOM 1429 N ALA A 106 -0.653 -8.386 -16.762 1.00 0.00 N ATOM 1430 CA ALA A 106 -0.115 -8.981 -17.986 1.00 0.00 C ATOM 1431 C ALA A 106 0.701 -7.953 -18.783 1.00 0.00 C ATOM 1432 O ALA A 106 1.768 -8.284 -19.298 1.00 0.00 O ATOM 1433 CB ALA A 106 -1.258 -9.555 -18.829 1.00 0.00 C ATOM 0 H ALA A 106 -1.649 -8.561 -16.629 1.00 0.00 H new ATOM 0 HA ALA A 106 0.560 -9.793 -17.716 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -0.852 -9.997 -19.739 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -1.783 -10.320 -18.257 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -1.953 -8.757 -19.091 1.00 0.00 H new ATOM 1439 N GLU A 107 0.219 -6.711 -18.867 1.00 0.00 N ATOM 1440 CA GLU A 107 0.902 -5.628 -19.572 1.00 0.00 C ATOM 1441 C GLU A 107 1.756 -4.778 -18.620 1.00 0.00 C ATOM 1442 O GLU A 107 2.737 -4.170 -19.039 1.00 0.00 O ATOM 1443 CB GLU A 107 -0.157 -4.804 -20.307 1.00 0.00 C ATOM 1444 CG GLU A 107 0.479 -3.915 -21.380 1.00 0.00 C ATOM 1445 CD GLU A 107 -0.499 -3.624 -22.512 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -1.029 -4.582 -23.132 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -0.736 -2.431 -22.804 1.00 0.00 O ATOM 0 H GLU A 107 -0.665 -6.428 -18.443 1.00 0.00 H new ATOM 0 HA GLU A 107 1.605 -6.037 -20.297 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -0.885 -5.471 -20.768 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.700 -4.185 -19.593 1.00 0.00 H new ATOM 0 HG2 GLU A 107 0.807 -2.978 -20.931 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.367 -4.404 -21.781 1.00 0.00 H new ATOM 1454 N GLY A 108 1.407 -4.746 -17.331 1.00 0.00 N ATOM 1455 CA GLY A 108 2.122 -4.004 -16.299 1.00 0.00 C ATOM 1456 C GLY A 108 1.540 -2.629 -15.975 1.00 0.00 C ATOM 1457 O GLY A 108 1.997 -2.021 -15.007 1.00 0.00 O ATOM 0 H GLY A 108 0.597 -5.250 -16.971 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.136 -4.601 -15.387 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.158 -3.879 -16.614 1.00 0.00 H new ATOM 1461 N THR A 109 0.521 -2.169 -16.707 1.00 0.00 N ATOM 1462 CA THR A 109 -0.153 -0.880 -16.523 1.00 0.00 C ATOM 1463 C THR A 109 -0.804 -0.830 -15.133 1.00 0.00 C ATOM 1464 O THR A 109 -0.935 0.222 -14.509 1.00 0.00 O ATOM 1465 CB THR A 109 -1.189 -0.732 -17.653 1.00 0.00 C ATOM 1466 OG1 THR A 109 -0.659 -1.241 -18.868 1.00 0.00 O ATOM 1467 CG2 THR A 109 -1.657 0.704 -17.864 1.00 0.00 C ATOM 0 H THR A 109 0.126 -2.708 -17.478 1.00 0.00 H new ATOM 0 HA THR A 109 0.551 -0.050 -16.574 1.00 0.00 H new ATOM 0 HB THR A 109 -2.062 -1.307 -17.345 1.00 0.00 H new ATOM 0 HG1 THR A 109 -1.324 -1.145 -19.581 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.385 0.734 -18.675 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.118 1.075 -16.948 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.803 1.331 -18.120 1.00 0.00 H new ATOM 1475 N ARG A 110 -1.232 -1.995 -14.642 1.00 0.00 N ATOM 1476 CA ARG A 110 -1.833 -2.167 -13.326 1.00 0.00 C ATOM 1477 C ARG A 110 -0.888 -3.059 -12.545 1.00 0.00 C ATOM 1478 O ARG A 110 -0.221 -3.919 -13.132 1.00 0.00 O ATOM 1479 CB ARG A 110 -3.244 -2.776 -13.388 1.00 0.00 C ATOM 1480 CG ARG A 110 -4.330 -1.692 -13.442 1.00 0.00 C ATOM 1481 CD ARG A 110 -5.758 -2.275 -13.397 1.00 0.00 C ATOM 1482 NE ARG A 110 -6.010 -3.303 -14.430 1.00 0.00 N ATOM 1483 CZ ARG A 110 -5.949 -3.120 -15.753 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -5.798 -1.910 -16.271 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -6.036 -4.165 -16.563 1.00 0.00 N ATOM 0 H ARG A 110 -1.166 -2.867 -15.167 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.966 -1.197 -12.846 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -3.325 -3.416 -14.266 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -3.405 -3.409 -12.516 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.195 -1.007 -12.605 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.209 -1.108 -14.354 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -5.933 -2.710 -12.413 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.476 -1.465 -13.520 1.00 0.00 H new ATOM 0 HE ARG A 110 -6.253 -4.238 -14.103 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -5.726 -1.098 -15.658 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -5.754 -1.790 -17.283 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -6.149 -5.102 -16.176 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -5.990 -4.032 -17.573 1.00 0.00 H new ATOM 1499 N THR A 111 -0.888 -2.906 -11.232 1.00 0.00 N ATOM 1500 CA THR A 111 -0.058 -3.670 -10.327 1.00 0.00 C ATOM 1501 C THR A 111 -0.976 -4.274 -9.256 1.00 0.00 C ATOM 1502 O THR A 111 -1.970 -3.660 -8.864 1.00 0.00 O ATOM 1503 CB THR A 111 1.043 -2.716 -9.841 1.00 0.00 C ATOM 1504 OG1 THR A 111 1.914 -2.396 -10.912 1.00 0.00 O ATOM 1505 CG2 THR A 111 1.921 -3.334 -8.770 1.00 0.00 C ATOM 0 H THR A 111 -1.483 -2.227 -10.757 1.00 0.00 H new ATOM 0 HA THR A 111 0.457 -4.524 -10.766 1.00 0.00 H new ATOM 0 HB THR A 111 0.525 -1.843 -9.443 1.00 0.00 H new ATOM 0 HG1 THR A 111 2.612 -1.786 -10.595 1.00 0.00 H new ATOM 0 HG21 THR A 111 2.681 -2.616 -8.464 1.00 0.00 H new ATOM 0 HG22 THR A 111 1.309 -3.604 -7.909 1.00 0.00 H new ATOM 0 HG23 THR A 111 2.404 -4.227 -9.166 1.00 0.00 H new ATOM 1513 N TYR A 112 -0.685 -5.503 -8.824 1.00 0.00 N ATOM 1514 CA TYR A 112 -1.428 -6.267 -7.825 1.00 0.00 C ATOM 1515 C TYR A 112 -0.423 -6.918 -6.876 1.00 0.00 C ATOM 1516 O TYR A 112 0.347 -7.784 -7.272 1.00 0.00 O ATOM 1517 CB TYR A 112 -2.225 -7.379 -8.542 1.00 0.00 C ATOM 1518 CG TYR A 112 -3.679 -7.052 -8.817 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -4.038 -5.994 -9.676 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -4.681 -7.798 -8.169 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -5.388 -5.633 -9.825 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -6.028 -7.436 -8.300 1.00 0.00 C ATOM 1523 CZ TYR A 112 -6.377 -6.328 -9.094 1.00 0.00 C ATOM 1524 OH TYR A 112 -7.671 -5.923 -9.134 1.00 0.00 O ATOM 0 H TYR A 112 0.119 -6.018 -9.182 1.00 0.00 H new ATOM 0 HA TYR A 112 -2.107 -5.616 -7.275 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -1.734 -7.604 -9.489 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -2.180 -8.284 -7.937 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -3.274 -5.459 -10.221 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -4.410 -8.653 -7.568 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -5.667 -4.831 -10.493 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -6.795 -8.004 -7.794 1.00 0.00 H new ATOM 0 HH TYR A 112 -8.216 -6.514 -8.574 1.00 0.00 H new ATOM 1534 N LEU A 113 -0.468 -6.555 -5.600 1.00 0.00 N ATOM 1535 CA LEU A 113 0.400 -7.109 -4.561 1.00 0.00 C ATOM 1536 C LEU A 113 -0.513 -7.737 -3.520 1.00 0.00 C ATOM 1537 O LEU A 113 -1.690 -7.373 -3.445 1.00 0.00 O ATOM 1538 CB LEU A 113 1.370 -6.077 -3.946 1.00 0.00 C ATOM 1539 CG LEU A 113 0.793 -4.675 -3.666 1.00 0.00 C ATOM 1540 CD1 LEU A 113 1.420 -4.077 -2.408 1.00 0.00 C ATOM 1541 CD2 LEU A 113 1.062 -3.732 -4.848 1.00 0.00 C ATOM 0 H LEU A 113 -1.120 -5.854 -5.249 1.00 0.00 H new ATOM 0 HA LEU A 113 1.065 -7.854 -4.999 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.751 -6.483 -3.009 1.00 0.00 H new ATOM 0 HB3 LEU A 113 2.223 -5.968 -4.616 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.282 -4.783 -3.523 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.000 -3.088 -2.227 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.210 -4.722 -1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.498 -3.994 -2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.647 -2.748 -4.630 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.137 -3.645 -5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.593 -4.133 -5.747 1.00 0.00 H new ATOM 1553 N LYS A 114 -0.013 -8.699 -2.746 1.00 0.00 N ATOM 1554 CA LYS A 114 -0.782 -9.384 -1.714 1.00 0.00 C ATOM 1555 C LYS A 114 0.105 -9.600 -0.502 1.00 0.00 C ATOM 1556 O LYS A 114 1.178 -10.191 -0.622 1.00 0.00 O ATOM 1557 CB LYS A 114 -1.317 -10.739 -2.225 1.00 0.00 C ATOM 1558 CG LYS A 114 -2.388 -10.594 -3.328 1.00 0.00 C ATOM 1559 CD LYS A 114 -3.261 -11.850 -3.520 1.00 0.00 C ATOM 1560 CE LYS A 114 -3.018 -12.638 -4.805 1.00 0.00 C ATOM 1561 NZ LYS A 114 -1.700 -13.303 -4.840 1.00 0.00 N ATOM 0 H LYS A 114 0.950 -9.027 -2.821 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.640 -8.768 -1.445 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.485 -11.328 -2.611 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.740 -11.294 -1.388 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.033 -9.749 -3.086 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -1.895 -10.359 -4.271 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -3.099 -12.515 -2.672 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.308 -11.549 -3.493 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.800 -13.389 -4.916 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.100 -11.964 -5.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.805 -14.261 -5.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.050 -12.754 -5.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.315 -13.362 -3.876 1.00 0.00 H new ATOM 1575 N SER A 115 -0.310 -9.078 0.649 1.00 0.00 N ATOM 1576 CA SER A 115 0.413 -9.240 1.902 1.00 0.00 C ATOM 1577 C SER A 115 -0.255 -10.400 2.621 1.00 0.00 C ATOM 1578 O SER A 115 -1.465 -10.579 2.431 1.00 0.00 O ATOM 1579 CB SER A 115 0.330 -7.988 2.780 1.00 0.00 C ATOM 1580 OG SER A 115 1.498 -7.970 3.567 1.00 0.00 O ATOM 0 H SER A 115 -1.164 -8.527 0.737 1.00 0.00 H new ATOM 0 HA SER A 115 1.470 -9.417 1.704 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.262 -7.089 2.167 1.00 0.00 H new ATOM 0 HB3 SER A 115 -0.560 -8.014 3.408 1.00 0.00 H new ATOM 0 HG SER A 115 1.785 -7.043 3.705 1.00 0.00 H new ATOM 1586 N PHE A 116 0.518 -11.140 3.428 1.00 0.00 N ATOM 1587 CA PHE A 116 0.141 -12.298 4.239 1.00 0.00 C ATOM 1588 C PHE A 116 -1.200 -12.891 3.798 1.00 0.00 C ATOM 1589 O PHE A 116 -2.253 -12.546 4.348 1.00 0.00 O ATOM 1590 CB PHE A 116 0.147 -11.920 5.741 1.00 0.00 C ATOM 1591 CG PHE A 116 -0.524 -12.941 6.659 1.00 0.00 C ATOM 1592 CD1 PHE A 116 -0.007 -14.240 6.808 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -1.730 -12.621 7.308 1.00 0.00 C ATOM 1594 CE1 PHE A 116 -0.642 -15.180 7.639 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -2.370 -13.554 8.138 1.00 0.00 C ATOM 1596 CZ PHE A 116 -1.822 -14.834 8.316 1.00 0.00 C ATOM 0 H PHE A 116 1.508 -10.922 3.537 1.00 0.00 H new ATOM 0 HA PHE A 116 0.883 -13.081 4.085 1.00 0.00 H new ATOM 0 HB2 PHE A 116 1.179 -11.785 6.064 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -0.353 -10.959 5.862 1.00 0.00 H new ATOM 0 HD1 PHE A 116 0.891 -14.520 6.277 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -2.169 -11.645 7.166 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -0.222 -16.168 7.756 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -3.287 -13.286 8.642 1.00 0.00 H new ATOM 0 HZ PHE A 116 -2.304 -15.547 8.968 1.00 0.00 H new ATOM 1606 N GLU A 117 -1.184 -13.695 2.735 1.00 0.00 N ATOM 1607 CA GLU A 117 -2.381 -14.335 2.202 1.00 0.00 C ATOM 1608 C GLU A 117 -2.560 -15.710 2.844 1.00 0.00 C ATOM 1609 O GLU A 117 -1.976 -15.994 3.894 1.00 0.00 O ATOM 1610 CB GLU A 117 -2.402 -14.263 0.658 1.00 0.00 C ATOM 1611 CG GLU A 117 -1.188 -14.860 -0.067 1.00 0.00 C ATOM 1612 CD GLU A 117 -1.408 -14.929 -1.580 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -2.152 -15.825 -2.044 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -0.879 -14.098 -2.343 1.00 0.00 O ATOM 0 H GLU A 117 -0.334 -13.920 2.218 1.00 0.00 H new ATOM 0 HA GLU A 117 -3.284 -13.793 2.481 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -3.297 -14.774 0.304 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -2.495 -13.217 0.365 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -0.305 -14.257 0.145 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -0.990 -15.861 0.318 1.00 0.00 H new ATOM 1621 N ALA A 118 -3.484 -16.500 2.312 1.00 0.00 N ATOM 1622 CA ALA A 118 -3.828 -17.840 2.741 1.00 0.00 C ATOM 1623 C ALA A 118 -4.487 -18.496 1.528 1.00 0.00 C ATOM 1624 O ALA A 118 -3.978 -18.365 0.415 1.00 0.00 O ATOM 1625 CB ALA A 118 -4.721 -17.800 3.996 1.00 0.00 C ATOM 0 H ALA A 118 -4.047 -16.197 1.517 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.961 -18.425 3.050 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -4.967 -18.817 4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.190 -17.298 4.805 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.639 -17.256 3.772 1.00 0.00 H new ATOM 1631 N ASP A 119 -5.574 -19.226 1.743 1.00 0.00 N ATOM 1632 CA ASP A 119 -6.349 -19.913 0.725 1.00 0.00 C ATOM 1633 C ASP A 119 -7.318 -18.889 0.175 1.00 0.00 C ATOM 1634 O ASP A 119 -7.937 -18.147 0.946 1.00 0.00 O ATOM 1635 CB ASP A 119 -7.150 -21.073 1.319 1.00 0.00 C ATOM 1636 CG ASP A 119 -6.248 -22.221 1.741 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -5.702 -22.931 0.862 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -6.103 -22.451 2.959 1.00 0.00 O ATOM 0 H ASP A 119 -5.956 -19.360 2.679 1.00 0.00 H new ATOM 0 HA ASP A 119 -5.687 -20.324 -0.037 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -7.717 -20.720 2.180 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -7.873 -21.429 0.585 1.00 0.00 H new ATOM 1643 N ALA A 120 -7.509 -18.908 -1.142 1.00 0.00 N ATOM 1644 CA ALA A 120 -8.364 -18.016 -1.904 1.00 0.00 C ATOM 1645 C ALA A 120 -9.792 -17.864 -1.391 1.00 0.00 C ATOM 1646 O ALA A 120 -10.443 -16.878 -1.747 1.00 0.00 O ATOM 1647 CB ALA A 120 -8.322 -18.420 -3.382 1.00 0.00 C ATOM 0 H ALA A 120 -7.040 -19.590 -1.737 1.00 0.00 H new ATOM 0 HA ALA A 120 -7.953 -17.015 -1.772 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -8.962 -17.754 -3.960 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -7.298 -18.349 -3.750 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -8.675 -19.446 -3.489 1.00 0.00 H new ATOM 1653 N GLU A 121 -10.298 -18.786 -0.582 1.00 0.00 N ATOM 1654 CA GLU A 121 -11.638 -18.739 -0.028 1.00 0.00 C ATOM 1655 C GLU A 121 -11.575 -18.343 1.449 1.00 0.00 C ATOM 1656 O GLU A 121 -12.405 -17.551 1.895 1.00 0.00 O ATOM 1657 CB GLU A 121 -12.293 -20.105 -0.223 1.00 0.00 C ATOM 1658 CG GLU A 121 -13.808 -20.071 -0.034 1.00 0.00 C ATOM 1659 CD GLU A 121 -14.339 -21.499 0.034 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -14.277 -22.209 -1.007 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -14.783 -21.922 1.122 1.00 0.00 O ATOM 0 H GLU A 121 -9.771 -19.608 -0.287 1.00 0.00 H new ATOM 0 HA GLU A 121 -12.240 -17.988 -0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.065 -20.472 -1.224 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.860 -20.814 0.483 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -14.060 -19.533 0.880 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -14.277 -19.535 -0.859 1.00 0.00 H new ATOM 1668 N GLY A 122 -10.571 -18.826 2.189 1.00 0.00 N ATOM 1669 CA GLY A 122 -10.368 -18.555 3.603 1.00 0.00 C ATOM 1670 C GLY A 122 -10.246 -17.063 3.838 1.00 0.00 C ATOM 1671 O GLY A 122 -11.077 -16.470 4.522 1.00 0.00 O ATOM 0 H GLY A 122 -9.855 -19.438 1.798 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.202 -18.954 4.181 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -9.467 -19.060 3.952 1.00 0.00 H new ATOM 1675 N ARG A 123 -9.176 -16.474 3.302 1.00 0.00 N ATOM 1676 CA ARG A 123 -8.909 -15.036 3.418 1.00 0.00 C ATOM 1677 C ARG A 123 -7.684 -14.648 2.621 1.00 0.00 C ATOM 1678 O ARG A 123 -6.591 -15.149 2.876 1.00 0.00 O ATOM 1679 CB ARG A 123 -8.745 -14.511 4.867 1.00 0.00 C ATOM 1680 CG ARG A 123 -7.716 -15.152 5.819 1.00 0.00 C ATOM 1681 CD ARG A 123 -8.099 -16.483 6.474 1.00 0.00 C ATOM 1682 NE ARG A 123 -9.282 -16.340 7.334 1.00 0.00 N ATOM 1683 CZ ARG A 123 -9.820 -17.266 8.131 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -9.290 -18.486 8.203 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -10.893 -16.934 8.835 1.00 0.00 N ATOM 0 H ARG A 123 -8.466 -16.981 2.773 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.806 -14.566 3.016 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -8.504 -13.450 4.800 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -9.720 -14.586 5.349 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -6.791 -15.303 5.263 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -7.498 -14.436 6.612 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -8.297 -17.226 5.701 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -7.261 -16.853 7.065 1.00 0.00 H new ATOM 0 HE ARG A 123 -9.744 -15.431 7.320 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -8.467 -18.718 7.647 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -9.707 -19.188 8.814 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -11.283 -15.995 8.758 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -11.329 -17.618 9.454 1.00 0.00 H new ATOM 1699 N ARG A 124 -7.835 -13.815 1.595 1.00 0.00 N ATOM 1700 CA ARG A 124 -6.751 -13.342 0.799 1.00 0.00 C ATOM 1701 C ARG A 124 -7.018 -11.875 0.556 1.00 0.00 C ATOM 1702 O ARG A 124 -8.142 -11.513 0.200 1.00 0.00 O ATOM 1703 CB ARG A 124 -6.745 -14.122 -0.489 1.00 0.00 C ATOM 1704 CG ARG A 124 -6.147 -15.517 -0.268 1.00 0.00 C ATOM 1705 CD ARG A 124 -5.373 -16.084 -1.449 1.00 0.00 C ATOM 1706 NE ARG A 124 -5.989 -15.798 -2.758 1.00 0.00 N ATOM 1707 CZ ARG A 124 -5.363 -15.785 -3.938 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -4.051 -15.948 -4.023 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -6.067 -15.568 -5.043 1.00 0.00 N ATOM 0 H ARG A 124 -8.743 -13.453 1.303 1.00 0.00 H new ATOM 0 HA ARG A 124 -5.779 -13.468 1.276 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -7.762 -14.212 -0.872 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -6.167 -13.587 -1.243 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -5.483 -15.478 0.596 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -6.954 -16.206 -0.019 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -4.362 -15.677 -1.437 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -5.284 -17.164 -1.328 1.00 0.00 H new ATOM 0 HE ARG A 124 -6.988 -15.590 -2.763 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -3.498 -16.087 -3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -3.593 -15.935 -4.935 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -7.074 -15.414 -4.984 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -5.601 -15.556 -5.950 1.00 0.00 H new ATOM 1723 N PHE A 125 -5.986 -11.056 0.638 1.00 0.00 N ATOM 1724 CA PHE A 125 -6.101 -9.634 0.419 1.00 0.00 C ATOM 1725 C PHE A 125 -6.114 -9.423 -1.082 1.00 0.00 C ATOM 1726 O PHE A 125 -5.683 -10.286 -1.861 1.00 0.00 O ATOM 1727 CB PHE A 125 -4.901 -8.942 1.100 1.00 0.00 C ATOM 1728 CG PHE A 125 -4.721 -7.437 0.979 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -5.799 -6.545 0.807 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -3.412 -6.921 1.043 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -5.559 -5.175 0.615 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -3.172 -5.552 0.851 1.00 0.00 C ATOM 1733 CZ PHE A 125 -4.247 -4.680 0.619 1.00 0.00 C ATOM 0 H PHE A 125 -5.040 -11.365 0.860 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.010 -9.208 0.844 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -4.952 -9.178 2.163 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.995 -9.409 0.713 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.813 -6.917 0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.585 -7.586 1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -6.388 -4.500 0.464 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.162 -5.170 0.882 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.064 -3.630 0.444 1.00 0.00 H new ATOM 1743 N GLU A 126 -6.755 -8.334 -1.486 1.00 0.00 N ATOM 1744 CA GLU A 126 -6.805 -8.000 -2.907 1.00 0.00 C ATOM 1745 C GLU A 126 -6.913 -6.498 -3.115 1.00 0.00 C ATOM 1746 O GLU A 126 -7.935 -5.894 -2.792 1.00 0.00 O ATOM 1747 CB GLU A 126 -7.917 -8.764 -3.635 1.00 0.00 C ATOM 1748 CG GLU A 126 -7.623 -8.853 -5.138 1.00 0.00 C ATOM 1749 CD GLU A 126 -8.517 -9.844 -5.885 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -9.539 -10.325 -5.347 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -8.169 -10.218 -7.032 1.00 0.00 O ATOM 0 H GLU A 126 -7.237 -7.680 -0.869 1.00 0.00 H new ATOM 0 HA GLU A 126 -5.864 -8.322 -3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -8.009 -9.767 -3.218 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -8.872 -8.264 -3.476 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -7.743 -7.864 -5.581 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -6.581 -9.141 -5.278 1.00 0.00 H new ATOM 1758 N VAL A 127 -5.870 -5.913 -3.695 1.00 0.00 N ATOM 1759 CA VAL A 127 -5.748 -4.498 -3.988 1.00 0.00 C ATOM 1760 C VAL A 127 -5.359 -4.320 -5.446 1.00 0.00 C ATOM 1761 O VAL A 127 -4.652 -5.163 -6.018 1.00 0.00 O ATOM 1762 CB VAL A 127 -4.698 -3.878 -3.044 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -3.270 -4.415 -3.226 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -4.614 -2.363 -3.196 1.00 0.00 C ATOM 0 H VAL A 127 -5.049 -6.443 -3.986 1.00 0.00 H new ATOM 0 HA VAL A 127 -6.698 -3.989 -3.826 1.00 0.00 H new ATOM 0 HB VAL A 127 -5.059 -4.166 -2.057 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.603 -3.921 -2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -3.259 -5.490 -3.044 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -2.933 -4.216 -4.243 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.862 -1.970 -2.512 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -4.338 -2.115 -4.221 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.582 -1.920 -2.964 1.00 0.00 H new ATOM 1774 N ALA A 128 -5.843 -3.234 -6.037 1.00 0.00 N ATOM 1775 CA ALA A 128 -5.564 -2.858 -7.407 1.00 0.00 C ATOM 1776 C ALA A 128 -4.797 -1.544 -7.358 1.00 0.00 C ATOM 1777 O ALA A 128 -5.168 -0.645 -6.610 1.00 0.00 O ATOM 1778 CB ALA A 128 -6.879 -2.672 -8.168 1.00 0.00 C ATOM 0 H ALA A 128 -6.457 -2.576 -5.558 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.983 -3.626 -7.917 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.666 -2.389 -9.199 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -7.441 -3.606 -8.157 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.468 -1.888 -7.691 1.00 0.00 H new ATOM 1784 N LEU A 129 -3.756 -1.406 -8.169 1.00 0.00 N ATOM 1785 CA LEU A 129 -2.962 -0.189 -8.224 1.00 0.00 C ATOM 1786 C LEU A 129 -2.869 0.251 -9.674 1.00 0.00 C ATOM 1787 O LEU A 129 -2.428 -0.531 -10.524 1.00 0.00 O ATOM 1788 CB LEU A 129 -1.588 -0.415 -7.577 1.00 0.00 C ATOM 1789 CG LEU A 129 -0.728 0.866 -7.612 1.00 0.00 C ATOM 1790 CD1 LEU A 129 0.062 0.977 -6.306 1.00 0.00 C ATOM 1791 CD2 LEU A 129 0.266 0.883 -8.784 1.00 0.00 C ATOM 0 H LEU A 129 -3.440 -2.136 -8.807 1.00 0.00 H new ATOM 0 HA LEU A 129 -3.434 0.610 -7.653 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.720 -0.738 -6.544 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.067 -1.218 -8.098 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.410 1.707 -7.740 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.672 1.880 -6.325 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.630 1.024 -5.465 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.708 0.106 -6.196 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.843 1.807 -8.758 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.941 0.031 -8.701 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.280 0.823 -9.725 1.00 0.00 H new ATOM 1803 N ASP A 130 -3.373 1.450 -9.949 1.00 0.00 N ATOM 1804 CA ASP A 130 -3.359 2.090 -11.260 1.00 0.00 C ATOM 1805 C ASP A 130 -1.976 2.740 -11.315 1.00 0.00 C ATOM 1806 O ASP A 130 -1.701 3.663 -10.546 1.00 0.00 O ATOM 1807 CB ASP A 130 -4.499 3.125 -11.368 1.00 0.00 C ATOM 1808 CG ASP A 130 -5.227 3.076 -12.709 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -5.894 2.049 -12.975 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -5.265 4.086 -13.453 1.00 0.00 O ATOM 0 H ASP A 130 -3.820 2.026 -9.236 1.00 0.00 H new ATOM 0 HA ASP A 130 -3.523 1.402 -12.090 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -5.216 2.952 -10.566 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -4.090 4.124 -11.220 1.00 0.00 H new ATOM 1815 N GLY A 131 -1.054 2.201 -12.116 1.00 0.00 N ATOM 1816 CA GLY A 131 0.290 2.755 -12.201 1.00 0.00 C ATOM 1817 C GLY A 131 0.293 3.985 -13.089 1.00 0.00 C ATOM 1818 O GLY A 131 -0.264 3.927 -14.188 1.00 0.00 O ATOM 0 H GLY A 131 -1.216 1.387 -12.709 1.00 0.00 H new ATOM 0 HA2 GLY A 131 0.648 3.015 -11.205 1.00 0.00 H new ATOM 0 HA3 GLY A 131 0.975 2.007 -12.600 1.00 0.00 H new ATOM 1822 N ASP A 132 0.926 5.069 -12.630 1.00 0.00 N ATOM 1823 CA ASP A 132 1.022 6.310 -13.391 1.00 0.00 C ATOM 1824 C ASP A 132 2.476 6.517 -13.799 1.00 0.00 C ATOM 1825 O ASP A 132 2.782 6.291 -14.972 1.00 0.00 O ATOM 1826 CB ASP A 132 0.394 7.516 -12.680 1.00 0.00 C ATOM 1827 CG ASP A 132 0.168 8.615 -13.718 1.00 0.00 C ATOM 1828 OD1 ASP A 132 1.134 9.205 -14.222 1.00 0.00 O ATOM 1829 OD2 ASP A 132 -0.997 8.796 -14.154 1.00 0.00 O ATOM 0 H ASP A 132 1.385 5.107 -11.720 1.00 0.00 H new ATOM 0 HA ASP A 132 0.419 6.220 -14.295 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -0.550 7.234 -12.213 1.00 0.00 H new ATOM 0 HB3 ASP A 132 1.049 7.872 -11.885 1.00 0.00 H new ATOM 1834 N HIS A 133 3.378 6.886 -12.873 1.00 0.00 N ATOM 1835 CA HIS A 133 4.794 7.102 -13.171 1.00 0.00 C ATOM 1836 C HIS A 133 5.499 5.740 -13.148 1.00 0.00 C ATOM 1837 O HIS A 133 5.379 4.955 -14.094 1.00 0.00 O ATOM 1838 CB HIS A 133 5.421 8.129 -12.200 1.00 0.00 C ATOM 1839 CG HIS A 133 5.075 9.571 -12.500 1.00 0.00 C ATOM 1840 ND1 HIS A 133 5.976 10.609 -12.613 1.00 0.00 N ATOM 1841 CD2 HIS A 133 3.823 10.098 -12.681 1.00 0.00 C ATOM 1842 CE1 HIS A 133 5.280 11.730 -12.862 1.00 0.00 C ATOM 1843 NE2 HIS A 133 3.967 11.464 -12.949 1.00 0.00 N ATOM 0 H HIS A 133 3.138 7.042 -11.894 1.00 0.00 H new ATOM 0 HA HIS A 133 4.914 7.537 -14.163 1.00 0.00 H new ATOM 0 HB2 HIS A 133 5.098 7.895 -11.186 1.00 0.00 H new ATOM 0 HB3 HIS A 133 6.505 8.017 -12.223 1.00 0.00 H new ATOM 0 HD2 HIS A 133 2.891 9.555 -12.627 1.00 0.00 H new ATOM 0 HE1 HIS A 133 5.717 12.711 -12.977 1.00 0.00 H new ATOM 0 HE2 HIS A 133 3.222 12.126 -13.167 1.00 0.00 H new ATOM 1851 N THR A 134 6.185 5.409 -12.061 1.00 0.00 N ATOM 1852 CA THR A 134 6.915 4.195 -11.832 1.00 0.00 C ATOM 1853 C THR A 134 6.472 3.664 -10.469 1.00 0.00 C ATOM 1854 O THR A 134 6.020 4.437 -9.615 1.00 0.00 O ATOM 1855 CB THR A 134 8.413 4.510 -11.895 1.00 0.00 C ATOM 1856 OG1 THR A 134 8.733 5.859 -11.595 1.00 0.00 O ATOM 1857 CG2 THR A 134 9.012 4.163 -13.258 1.00 0.00 C ATOM 0 H THR A 134 6.242 6.040 -11.262 1.00 0.00 H new ATOM 0 HA THR A 134 6.720 3.430 -12.583 1.00 0.00 H new ATOM 0 HB THR A 134 8.850 3.881 -11.120 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.703 5.986 -11.653 1.00 0.00 H new ATOM 0 HG21 THR A 134 10.075 4.402 -13.260 1.00 0.00 H new ATOM 0 HG22 THR A 134 8.879 3.099 -13.454 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.509 4.740 -14.034 1.00 0.00 H new ATOM 1865 N GLY A 135 6.643 2.361 -10.244 1.00 0.00 N ATOM 1866 CA GLY A 135 6.246 1.703 -9.012 1.00 0.00 C ATOM 1867 C GLY A 135 7.377 0.982 -8.302 1.00 0.00 C ATOM 1868 O GLY A 135 7.181 -0.174 -7.931 1.00 0.00 O ATOM 0 H GLY A 135 7.067 1.730 -10.924 1.00 0.00 H new ATOM 0 HA2 GLY A 135 5.822 2.446 -8.336 1.00 0.00 H new ATOM 0 HA3 GLY A 135 5.455 0.986 -9.234 1.00 0.00 H new ATOM 1872 N ASP A 136 8.562 1.586 -8.192 1.00 0.00 N ATOM 1873 CA ASP A 136 9.679 0.950 -7.478 1.00 0.00 C ATOM 1874 C ASP A 136 9.405 1.080 -5.966 1.00 0.00 C ATOM 1875 O ASP A 136 8.656 1.961 -5.538 1.00 0.00 O ATOM 1876 CB ASP A 136 11.038 1.572 -7.868 1.00 0.00 C ATOM 1877 CG ASP A 136 12.050 0.570 -8.450 1.00 0.00 C ATOM 1878 OD1 ASP A 136 11.916 -0.663 -8.240 1.00 0.00 O ATOM 1879 OD2 ASP A 136 12.971 1.011 -9.172 1.00 0.00 O ATOM 0 H ASP A 136 8.775 2.504 -8.582 1.00 0.00 H new ATOM 0 HA ASP A 136 9.745 -0.102 -7.755 1.00 0.00 H new ATOM 0 HB2 ASP A 136 10.866 2.362 -8.599 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.475 2.042 -6.987 1.00 0.00 H new ATOM 1884 N LEU A 137 9.930 0.178 -5.132 1.00 0.00 N ATOM 1885 CA LEU A 137 9.741 0.178 -3.685 1.00 0.00 C ATOM 1886 C LEU A 137 11.074 0.006 -2.966 1.00 0.00 C ATOM 1887 O LEU A 137 12.013 -0.567 -3.521 1.00 0.00 O ATOM 1888 CB LEU A 137 8.814 -0.982 -3.291 1.00 0.00 C ATOM 1889 CG LEU A 137 7.356 -0.849 -3.779 1.00 0.00 C ATOM 1890 CD1 LEU A 137 7.140 -1.614 -5.084 1.00 0.00 C ATOM 1891 CD2 LEU A 137 6.381 -1.424 -2.751 1.00 0.00 C ATOM 0 H LEU A 137 10.514 -0.592 -5.457 1.00 0.00 H new ATOM 0 HA LEU A 137 9.301 1.132 -3.395 1.00 0.00 H new ATOM 0 HB2 LEU A 137 9.230 -1.909 -3.686 1.00 0.00 H new ATOM 0 HB3 LEU A 137 8.811 -1.071 -2.205 1.00 0.00 H new ATOM 0 HG LEU A 137 7.173 0.215 -3.928 1.00 0.00 H new ATOM 0 HD11 LEU A 137 6.104 -1.502 -5.404 1.00 0.00 H new ATOM 0 HD12 LEU A 137 7.802 -1.216 -5.853 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.360 -2.670 -4.927 1.00 0.00 H new ATOM 0 HD21 LEU A 137 5.360 -1.318 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 137 6.601 -2.479 -2.591 1.00 0.00 H new ATOM 0 HD23 LEU A 137 6.485 -0.885 -1.809 1.00 0.00 H new ATOM 1903 N SER A 138 11.175 0.467 -1.724 1.00 0.00 N ATOM 1904 CA SER A 138 12.293 0.393 -0.811 1.00 0.00 C ATOM 1905 C SER A 138 11.704 0.829 0.538 1.00 0.00 C ATOM 1906 O SER A 138 10.574 1.317 0.587 1.00 0.00 O ATOM 1907 CB SER A 138 13.457 1.295 -1.218 1.00 0.00 C ATOM 1908 OG SER A 138 13.974 0.983 -2.500 1.00 0.00 O ATOM 0 H SER A 138 10.388 0.952 -1.294 1.00 0.00 H new ATOM 0 HA SER A 138 12.721 -0.609 -0.790 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.126 2.333 -1.208 1.00 0.00 H new ATOM 0 HB3 SER A 138 14.254 1.207 -0.479 1.00 0.00 H new ATOM 0 HG SER A 138 13.413 0.299 -2.922 1.00 0.00 H new ATOM 1914 N ALA A 139 12.478 0.701 1.603 1.00 0.00 N ATOM 1915 CA ALA A 139 12.120 1.037 2.983 1.00 0.00 C ATOM 1916 C ALA A 139 11.589 2.467 3.155 1.00 0.00 C ATOM 1917 O ALA A 139 10.765 2.716 4.037 1.00 0.00 O ATOM 1918 CB ALA A 139 13.326 0.796 3.889 1.00 0.00 C ATOM 0 H ALA A 139 13.429 0.340 1.530 1.00 0.00 H new ATOM 0 HA ALA A 139 11.295 0.384 3.267 1.00 0.00 H new ATOM 0 HB1 ALA A 139 13.064 1.045 4.917 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.620 -0.252 3.833 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.156 1.423 3.564 1.00 0.00 H new ATOM 1924 N ALA A 140 12.057 3.404 2.329 1.00 0.00 N ATOM 1925 CA ALA A 140 11.623 4.791 2.352 1.00 0.00 C ATOM 1926 C ALA A 140 10.200 4.901 1.794 1.00 0.00 C ATOM 1927 O ALA A 140 9.403 5.706 2.278 1.00 0.00 O ATOM 1928 CB ALA A 140 12.566 5.615 1.471 1.00 0.00 C ATOM 0 H ALA A 140 12.760 3.211 1.615 1.00 0.00 H new ATOM 0 HA ALA A 140 11.638 5.161 3.377 1.00 0.00 H new ATOM 0 HB1 ALA A 140 12.252 6.659 1.479 1.00 0.00 H new ATOM 0 HB2 ALA A 140 13.583 5.539 1.856 1.00 0.00 H new ATOM 0 HB3 ALA A 140 12.535 5.235 0.450 1.00 0.00 H new ATOM 1934 N ASN A 141 9.918 4.119 0.744 1.00 0.00 N ATOM 1935 CA ASN A 141 8.646 4.067 0.046 1.00 0.00 C ATOM 1936 C ASN A 141 7.648 3.365 0.957 1.00 0.00 C ATOM 1937 O ASN A 141 6.752 3.970 1.537 1.00 0.00 O ATOM 1938 CB ASN A 141 8.788 3.411 -1.358 1.00 0.00 C ATOM 1939 CG ASN A 141 9.749 4.109 -2.325 1.00 0.00 C ATOM 1940 OD1 ASN A 141 10.694 4.796 -1.937 1.00 0.00 O ATOM 1941 ND2 ASN A 141 9.608 3.876 -3.616 1.00 0.00 N ATOM 0 H ASN A 141 10.607 3.480 0.347 1.00 0.00 H new ATOM 0 HA ASN A 141 8.276 5.071 -0.164 1.00 0.00 H new ATOM 0 HB2 ASN A 141 9.120 2.381 -1.225 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.802 3.371 -1.821 1.00 0.00 H new ATOM 0 HD21 ASN A 141 10.278 4.264 -4.280 1.00 0.00 H new ATOM 0 HD22 ASN A 141 8.829 3.308 -3.950 1.00 0.00 H new ATOM 1948 N VAL A 142 7.833 2.069 1.104 1.00 0.00 N ATOM 1949 CA VAL A 142 7.034 1.171 1.903 1.00 0.00 C ATOM 1950 C VAL A 142 7.632 0.957 3.285 1.00 0.00 C ATOM 1951 O VAL A 142 8.783 0.542 3.432 1.00 0.00 O ATOM 1952 CB VAL A 142 6.845 -0.129 1.122 1.00 0.00 C ATOM 1953 CG1 VAL A 142 8.122 -0.772 0.556 1.00 0.00 C ATOM 1954 CG2 VAL A 142 6.052 -1.169 1.920 1.00 0.00 C ATOM 0 H VAL A 142 8.599 1.585 0.635 1.00 0.00 H new ATOM 0 HA VAL A 142 6.054 1.611 2.089 1.00 0.00 H new ATOM 0 HB VAL A 142 6.273 0.194 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.863 -1.687 0.023 1.00 0.00 H new ATOM 0 HG12 VAL A 142 8.606 -0.077 -0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.803 -1.009 1.373 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.942 -2.077 1.326 1.00 0.00 H new ATOM 0 HG22 VAL A 142 6.583 -1.401 2.843 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.066 -0.770 2.159 1.00 0.00 H new ATOM 1964 N VAL A 143 6.820 1.219 4.303 1.00 0.00 N ATOM 1965 CA VAL A 143 7.222 1.046 5.687 1.00 0.00 C ATOM 1966 C VAL A 143 7.311 -0.458 5.933 1.00 0.00 C ATOM 1967 O VAL A 143 6.293 -1.147 6.006 1.00 0.00 O ATOM 1968 CB VAL A 143 6.321 1.756 6.699 1.00 0.00 C ATOM 1969 CG1 VAL A 143 6.893 1.635 8.120 1.00 0.00 C ATOM 1970 CG2 VAL A 143 6.195 3.254 6.377 1.00 0.00 C ATOM 0 H VAL A 143 5.865 1.557 4.188 1.00 0.00 H new ATOM 0 HA VAL A 143 8.188 1.527 5.843 1.00 0.00 H new ATOM 0 HB VAL A 143 5.344 1.277 6.639 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.235 2.148 8.822 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.967 0.583 8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.883 2.089 8.153 1.00 0.00 H new ATOM 0 HG21 VAL A 143 5.549 3.731 7.114 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.182 3.717 6.406 1.00 0.00 H new ATOM 0 HG23 VAL A 143 5.765 3.378 5.383 1.00 0.00 H new ATOM 1980 N PHE A 144 8.535 -0.970 6.021 1.00 0.00 N ATOM 1981 CA PHE A 144 8.802 -2.378 6.262 1.00 0.00 C ATOM 1982 C PHE A 144 8.646 -2.679 7.747 1.00 0.00 C ATOM 1983 O PHE A 144 7.957 -3.634 8.107 1.00 0.00 O ATOM 1984 CB PHE A 144 10.214 -2.740 5.779 1.00 0.00 C ATOM 1985 CG PHE A 144 10.212 -3.562 4.512 1.00 0.00 C ATOM 1986 CD1 PHE A 144 9.981 -2.933 3.278 1.00 0.00 C ATOM 1987 CD2 PHE A 144 10.437 -4.950 4.560 1.00 0.00 C ATOM 1988 CE1 PHE A 144 10.005 -3.685 2.093 1.00 0.00 C ATOM 1989 CE2 PHE A 144 10.459 -5.701 3.372 1.00 0.00 C ATOM 1990 CZ PHE A 144 10.261 -5.066 2.134 1.00 0.00 C ATOM 0 H PHE A 144 9.380 -0.407 5.925 1.00 0.00 H new ATOM 0 HA PHE A 144 8.087 -2.982 5.704 1.00 0.00 H new ATOM 0 HB2 PHE A 144 10.780 -1.824 5.610 1.00 0.00 H new ATOM 0 HB3 PHE A 144 10.730 -3.293 6.564 1.00 0.00 H new ATOM 0 HD1 PHE A 144 9.785 -1.872 3.241 1.00 0.00 H new ATOM 0 HD2 PHE A 144 10.593 -5.439 5.510 1.00 0.00 H new ATOM 0 HE1 PHE A 144 9.826 -3.200 1.145 1.00 0.00 H new ATOM 0 HE2 PHE A 144 10.628 -6.767 3.411 1.00 0.00 H new ATOM 0 HZ PHE A 144 10.305 -5.637 1.218 1.00 0.00 H new