USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 790 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 0 SER OG : rot -107:sc= 0.885 USER MOD Set 1.2: A 3 GLN : amide:sc= -2.52 K(o=-1.6,f=-5.1) USER MOD Single : A 0 SER N :NH3+ 146:sc= 0.0182 (180deg=0) USER MOD Single : A 5 SER OG : rot -73:sc= 1.2 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00131) USER MOD Single : A 12 THR OG1 : rot 74:sc= -0.296 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -2.87 K(o=-2.9,f=-3.9!) USER MOD Single : A 16 GLN : amide:sc= -1.78! C(o=-1.8!,f=-2.2!) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 22 SER OG : rot 64:sc= 0.00953 USER MOD Single : A 31 THR OG1 : rot 105:sc= 1.28 USER MOD Single : A 38 ASN : amide:sc= -3.35 K(o=-3.4,f=-6.9!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0398 USER MOD Single : A 47 HIS :FLIP no HD1:sc= -5.92 F(o=-7.1!,f=-5.9) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 166:sc=-0.00492 (180deg=-0.311) USER MOD Single : A 51 GLN : amide:sc= -2 K(o=-2,f=-4.3!) USER MOD Single : A 54 THR OG1 : rot -72:sc= 0.776 USER MOD Single : A 55 ASN : amide:sc= -0.275 X(o=-0.28,f=-0.5) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -2.22! C(o=-2.2!,f=-3.5!) USER MOD Single : A 74 GLN : amide:sc= -0.684 K(o=-0.68,f=-2) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.0316 X(o=-0.032,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.275 K(o=-0.28,f=-2!) USER MOD Single : A 90 GLN : amide:sc= -0.278 X(o=-0.28,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N SER A 0 2.484 -1.526 -3.215 1.00 0.00 N ATOM 9 CA SER A 0 2.056 -2.390 -4.308 1.00 0.00 C ATOM 10 C SER A 0 3.043 -3.535 -4.514 1.00 0.00 C ATOM 11 O SER A 0 3.638 -3.672 -5.583 1.00 0.00 O ATOM 12 CB SER A 0 1.918 -1.582 -5.600 1.00 0.00 C ATOM 13 OG SER A 0 1.047 -0.479 -5.422 1.00 0.00 O ATOM 0 H1 SER A 0 2.215 -0.543 -3.424 1.00 0.00 H new ATOM 0 H2 SER A 0 2.026 -1.830 -2.332 1.00 0.00 H new ATOM 0 H3 SER A 0 3.517 -1.587 -3.108 1.00 0.00 H new ATOM 0 HA SER A 0 1.086 -2.812 -4.046 1.00 0.00 H new ATOM 0 HB2 SER A 0 2.899 -1.227 -5.917 1.00 0.00 H new ATOM 0 HB3 SER A 0 1.539 -2.224 -6.395 1.00 0.00 H new ATOM 0 HG SER A 0 0.198 -0.655 -5.879 1.00 0.00 H new ATOM 19 N ALA A 1 3.211 -4.355 -3.482 1.00 0.00 N ATOM 20 CA ALA A 1 4.123 -5.490 -3.549 1.00 0.00 C ATOM 21 C ALA A 1 3.391 -6.760 -3.969 1.00 0.00 C ATOM 22 O ALA A 1 3.668 -7.326 -5.026 1.00 0.00 O ATOM 23 CB ALA A 1 4.811 -5.694 -2.207 1.00 0.00 C ATOM 0 H ALA A 1 2.727 -4.254 -2.590 1.00 0.00 H new ATOM 0 HA ALA A 1 4.879 -5.272 -4.303 1.00 0.00 H new ATOM 0 HB1 ALA A 1 5.489 -6.545 -2.271 1.00 0.00 H new ATOM 0 HB2 ALA A 1 5.376 -4.799 -1.948 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.061 -5.885 -1.439 1.00 0.00 H new ATOM 29 N ARG A 2 2.456 -7.201 -3.134 1.00 0.00 N ATOM 30 CA ARG A 2 1.685 -8.406 -3.419 1.00 0.00 C ATOM 31 C ARG A 2 0.821 -8.217 -4.662 1.00 0.00 C ATOM 32 O ARG A 2 0.799 -9.069 -5.549 1.00 0.00 O ATOM 33 CB ARG A 2 0.803 -8.767 -2.222 1.00 0.00 C ATOM 34 CG ARG A 2 1.215 -10.056 -1.529 1.00 0.00 C ATOM 35 CD ARG A 2 1.148 -11.244 -2.477 1.00 0.00 C ATOM 36 NE ARG A 2 0.645 -12.444 -1.816 1.00 0.00 N ATOM 37 CZ ARG A 2 0.663 -13.651 -2.370 1.00 0.00 C ATOM 38 NH1 ARG A 2 1.157 -13.817 -3.590 1.00 0.00 N ATOM 39 NH2 ARG A 2 0.187 -14.696 -1.705 1.00 0.00 N ATOM 0 H ARG A 2 2.214 -6.743 -2.255 1.00 0.00 H new ATOM 0 HA ARG A 2 2.385 -9.220 -3.605 1.00 0.00 H new ATOM 0 HB2 ARG A 2 0.833 -7.951 -1.500 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -0.230 -8.859 -2.557 1.00 0.00 H new ATOM 0 HG2 ARG A 2 2.229 -9.954 -1.142 1.00 0.00 H new ATOM 0 HG3 ARG A 2 0.564 -10.235 -0.673 1.00 0.00 H new ATOM 0 HD2 ARG A 2 0.504 -10.998 -3.321 1.00 0.00 H new ATOM 0 HD3 ARG A 2 2.141 -11.442 -2.881 1.00 0.00 H new ATOM 0 HE ARG A 2 0.258 -12.351 -0.877 1.00 0.00 H new ATOM 0 HH11 ARG A 2 1.524 -13.017 -4.105 1.00 0.00 H new ATOM 0 HH12 ARG A 2 1.170 -14.745 -4.013 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -0.194 -14.573 -0.767 1.00 0.00 H new ATOM 0 HH22 ARG A 2 0.202 -15.622 -2.132 1.00 0.00 H new ATOM 53 N GLN A 3 0.110 -7.095 -4.717 1.00 0.00 N ATOM 54 CA GLN A 3 -0.757 -6.796 -5.851 1.00 0.00 C ATOM 55 C GLN A 3 0.004 -6.925 -7.167 1.00 0.00 C ATOM 56 O GLN A 3 -0.551 -7.363 -8.176 1.00 0.00 O ATOM 57 CB GLN A 3 -1.335 -5.386 -5.720 1.00 0.00 C ATOM 58 CG GLN A 3 -0.280 -4.292 -5.733 1.00 0.00 C ATOM 59 CD GLN A 3 -0.873 -2.906 -5.567 1.00 0.00 C ATOM 60 OE1 GLN A 3 -0.834 -2.088 -6.486 1.00 0.00 O ATOM 61 NE2 GLN A 3 -1.428 -2.636 -4.391 1.00 0.00 N ATOM 0 H GLN A 3 0.117 -6.379 -3.991 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.574 -7.518 -5.852 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -2.036 -5.213 -6.536 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -1.903 -5.320 -4.792 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.437 -4.474 -4.932 1.00 0.00 H new ATOM 0 HG3 GLN A 3 0.272 -4.337 -6.672 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -1.438 -3.344 -3.657 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -1.844 -1.720 -4.222 1.00 0.00 H new ATOM 70 N LEU A 4 1.276 -6.543 -7.149 1.00 0.00 N ATOM 71 CA LEU A 4 2.113 -6.616 -8.341 1.00 0.00 C ATOM 72 C LEU A 4 2.868 -7.940 -8.396 1.00 0.00 C ATOM 73 O LEU A 4 3.414 -8.312 -9.435 1.00 0.00 O ATOM 74 CB LEU A 4 3.104 -5.450 -8.365 1.00 0.00 C ATOM 75 CG LEU A 4 2.495 -4.050 -8.271 1.00 0.00 C ATOM 76 CD1 LEU A 4 3.560 -2.989 -8.500 1.00 0.00 C ATOM 77 CD2 LEU A 4 1.360 -3.894 -9.272 1.00 0.00 C ATOM 0 H LEU A 4 1.750 -6.180 -6.322 1.00 0.00 H new ATOM 0 HA LEU A 4 1.464 -6.552 -9.215 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.803 -5.577 -7.539 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.684 -5.511 -9.286 1.00 0.00 H new ATOM 0 HG LEU A 4 2.089 -3.917 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.109 -1.999 -8.429 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.340 -3.087 -7.745 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.996 -3.119 -9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.939 -2.892 -9.191 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.742 -4.047 -10.282 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.585 -4.631 -9.062 1.00 0.00 H new ATOM 89 N SER A 5 2.893 -8.648 -7.272 1.00 0.00 N ATOM 90 CA SER A 5 3.582 -9.931 -7.191 1.00 0.00 C ATOM 91 C SER A 5 2.944 -10.950 -8.130 1.00 0.00 C ATOM 92 O SER A 5 3.532 -11.990 -8.430 1.00 0.00 O ATOM 93 CB SER A 5 3.556 -10.458 -5.755 1.00 0.00 C ATOM 94 OG SER A 5 2.339 -11.130 -5.480 1.00 0.00 O ATOM 0 H SER A 5 2.444 -8.355 -6.404 1.00 0.00 H new ATOM 0 HA SER A 5 4.617 -9.779 -7.496 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.394 -11.138 -5.599 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.683 -9.630 -5.058 1.00 0.00 H new ATOM 0 HG SER A 5 1.614 -10.475 -5.400 1.00 0.00 H new ATOM 100 N LYS A 6 1.736 -10.644 -8.593 1.00 0.00 N ATOM 101 CA LYS A 6 1.016 -11.531 -9.499 1.00 0.00 C ATOM 102 C LYS A 6 1.926 -12.014 -10.624 1.00 0.00 C ATOM 103 O LYS A 6 1.799 -13.144 -11.097 1.00 0.00 O ATOM 104 CB LYS A 6 -0.202 -10.814 -10.086 1.00 0.00 C ATOM 105 CG LYS A 6 -0.997 -11.665 -11.061 1.00 0.00 C ATOM 106 CD LYS A 6 -1.794 -12.741 -10.343 1.00 0.00 C ATOM 107 CE LYS A 6 -2.783 -13.420 -11.278 1.00 0.00 C ATOM 108 NZ LYS A 6 -3.558 -14.486 -10.585 1.00 0.00 N ATOM 0 H LYS A 6 1.235 -9.788 -8.355 1.00 0.00 H new ATOM 0 HA LYS A 6 0.680 -12.398 -8.929 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.856 -10.502 -9.272 1.00 0.00 H new ATOM 0 HB3 LYS A 6 0.130 -9.908 -10.594 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -1.674 -11.029 -11.631 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -0.318 -12.130 -11.776 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.113 -13.485 -9.930 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -2.330 -12.299 -9.503 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.470 -12.676 -11.683 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.247 -13.852 -12.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -4.221 -14.925 -11.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -2.905 -15.209 -10.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.090 -14.070 -9.794 1.00 0.00 H new ATOM 122 N LEU A 7 2.843 -11.152 -11.048 1.00 0.00 N ATOM 123 CA LEU A 7 3.776 -11.492 -12.117 1.00 0.00 C ATOM 124 C LEU A 7 5.050 -12.112 -11.552 1.00 0.00 C ATOM 125 O LEU A 7 5.662 -12.978 -12.177 1.00 0.00 O ATOM 126 CB LEU A 7 4.121 -10.246 -12.935 1.00 0.00 C ATOM 127 CG LEU A 7 5.090 -10.454 -14.099 1.00 0.00 C ATOM 128 CD1 LEU A 7 6.530 -10.362 -13.619 1.00 0.00 C ATOM 129 CD2 LEU A 7 4.834 -11.795 -14.772 1.00 0.00 C ATOM 0 H LEU A 7 2.961 -10.213 -10.668 1.00 0.00 H new ATOM 0 HA LEU A 7 3.295 -12.224 -12.766 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.195 -9.827 -13.330 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.547 -9.501 -12.263 1.00 0.00 H new ATOM 0 HG LEU A 7 4.923 -9.664 -14.831 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.205 -10.513 -14.462 1.00 0.00 H new ATOM 0 HD12 LEU A 7 6.706 -9.378 -13.184 1.00 0.00 H new ATOM 0 HD13 LEU A 7 6.712 -11.129 -12.866 1.00 0.00 H new ATOM 0 HD21 LEU A 7 5.533 -11.927 -15.598 1.00 0.00 H new ATOM 0 HD22 LEU A 7 4.973 -12.598 -14.048 1.00 0.00 H new ATOM 0 HD23 LEU A 7 3.813 -11.822 -15.152 1.00 0.00 H new ATOM 141 N LYS A 8 5.443 -11.664 -10.364 1.00 0.00 N ATOM 142 CA LYS A 8 6.642 -12.176 -9.712 1.00 0.00 C ATOM 143 C LYS A 8 6.721 -13.694 -9.832 1.00 0.00 C ATOM 144 O LYS A 8 7.672 -14.233 -10.398 1.00 0.00 O ATOM 145 CB LYS A 8 6.658 -11.769 -8.237 1.00 0.00 C ATOM 146 CG LYS A 8 7.967 -12.084 -7.533 1.00 0.00 C ATOM 147 CD LYS A 8 7.744 -12.949 -6.303 1.00 0.00 C ATOM 148 CE LYS A 8 8.661 -12.540 -5.161 1.00 0.00 C ATOM 149 NZ LYS A 8 9.257 -13.721 -4.477 1.00 0.00 N ATOM 0 H LYS A 8 4.948 -10.947 -9.833 1.00 0.00 H new ATOM 0 HA LYS A 8 7.509 -11.744 -10.212 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.463 -10.699 -8.162 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.845 -12.278 -7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.638 -12.596 -8.223 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.457 -11.155 -7.242 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.705 -12.868 -5.984 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.920 -13.995 -6.555 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.458 -11.903 -5.545 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.099 -11.947 -4.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 9.889 -13.399 -3.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.499 -14.307 -4.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 9.800 -14.282 -5.164 1.00 0.00 H new ATOM 163 N ARG A 9 5.714 -14.378 -9.297 1.00 0.00 N ATOM 164 CA ARG A 9 5.670 -15.835 -9.345 1.00 0.00 C ATOM 165 C ARG A 9 5.887 -16.339 -10.768 1.00 0.00 C ATOM 166 O ARG A 9 6.796 -17.128 -11.026 1.00 0.00 O ATOM 167 CB ARG A 9 4.329 -16.343 -8.811 1.00 0.00 C ATOM 168 CG ARG A 9 3.941 -15.745 -7.469 1.00 0.00 C ATOM 169 CD ARG A 9 2.699 -16.412 -6.900 1.00 0.00 C ATOM 170 NE ARG A 9 1.481 -15.958 -7.565 1.00 0.00 N ATOM 171 CZ ARG A 9 0.325 -16.611 -7.508 1.00 0.00 C ATOM 172 NH1 ARG A 9 0.231 -17.741 -6.820 1.00 0.00 N ATOM 173 NH2 ARG A 9 -0.740 -16.134 -8.140 1.00 0.00 N ATOM 0 H ARG A 9 4.919 -13.947 -8.826 1.00 0.00 H new ATOM 0 HA ARG A 9 6.473 -16.219 -8.716 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.549 -16.118 -9.538 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.373 -17.428 -8.716 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.768 -15.855 -6.768 1.00 0.00 H new ATOM 0 HG3 ARG A 9 3.761 -14.676 -7.584 1.00 0.00 H new ATOM 0 HD2 ARG A 9 2.788 -17.493 -7.005 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.630 -16.200 -5.833 1.00 0.00 H new ATOM 0 HE ARG A 9 1.520 -15.092 -8.103 1.00 0.00 H new ATOM 0 HH11 ARG A 9 1.047 -18.111 -6.333 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -0.658 -18.240 -6.778 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -0.672 -15.265 -8.670 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -1.627 -16.636 -8.096 1.00 0.00 H new ATOM 187 N PHE A 10 5.047 -15.878 -11.689 1.00 0.00 N ATOM 188 CA PHE A 10 5.146 -16.283 -13.086 1.00 0.00 C ATOM 189 C PHE A 10 6.573 -16.117 -13.600 1.00 0.00 C ATOM 190 O PHE A 10 7.108 -16.997 -14.277 1.00 0.00 O ATOM 191 CB PHE A 10 4.183 -15.463 -13.946 1.00 0.00 C ATOM 192 CG PHE A 10 4.309 -15.740 -15.417 1.00 0.00 C ATOM 193 CD1 PHE A 10 5.279 -15.104 -16.175 1.00 0.00 C ATOM 194 CD2 PHE A 10 3.457 -16.636 -16.043 1.00 0.00 C ATOM 195 CE1 PHE A 10 5.398 -15.356 -17.528 1.00 0.00 C ATOM 196 CE2 PHE A 10 3.571 -16.893 -17.396 1.00 0.00 C ATOM 197 CZ PHE A 10 4.542 -16.251 -18.140 1.00 0.00 C ATOM 0 H PHE A 10 4.290 -15.223 -11.493 1.00 0.00 H new ATOM 0 HA PHE A 10 4.875 -17.337 -13.153 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.160 -15.671 -13.631 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.362 -14.403 -13.767 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.950 -14.403 -15.702 1.00 0.00 H new ATOM 0 HD2 PHE A 10 2.695 -17.139 -15.467 1.00 0.00 H new ATOM 0 HE1 PHE A 10 6.159 -14.854 -18.107 1.00 0.00 H new ATOM 0 HE2 PHE A 10 2.902 -17.595 -17.871 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.632 -16.448 -19.198 1.00 0.00 H new ATOM 207 N LEU A 11 7.184 -14.983 -13.276 1.00 0.00 N ATOM 208 CA LEU A 11 8.550 -14.700 -13.704 1.00 0.00 C ATOM 209 C LEU A 11 9.527 -15.711 -13.113 1.00 0.00 C ATOM 210 O LEU A 11 10.305 -16.335 -13.835 1.00 0.00 O ATOM 211 CB LEU A 11 8.951 -13.283 -13.291 1.00 0.00 C ATOM 212 CG LEU A 11 9.810 -12.510 -14.293 1.00 0.00 C ATOM 213 CD1 LEU A 11 11.197 -13.126 -14.394 1.00 0.00 C ATOM 214 CD2 LEU A 11 9.138 -12.477 -15.658 1.00 0.00 C ATOM 0 H LEU A 11 6.755 -14.244 -12.718 1.00 0.00 H new ATOM 0 HA LEU A 11 8.588 -14.780 -14.790 1.00 0.00 H new ATOM 0 HB2 LEU A 11 8.043 -12.710 -13.103 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.493 -13.341 -12.347 1.00 0.00 H new ATOM 0 HG LEU A 11 9.915 -11.485 -13.937 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.794 -12.563 -15.111 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.680 -13.096 -13.417 1.00 0.00 H new ATOM 0 HD13 LEU A 11 11.112 -14.161 -14.726 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.763 -11.923 -16.358 1.00 0.00 H new ATOM 0 HD22 LEU A 11 9.002 -13.496 -16.021 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.167 -11.989 -15.574 1.00 0.00 H new ATOM 226 N THR A 12 9.480 -15.869 -11.794 1.00 0.00 N ATOM 227 CA THR A 12 10.360 -16.805 -11.105 1.00 0.00 C ATOM 228 C THR A 12 10.365 -18.165 -11.794 1.00 0.00 C ATOM 229 O THR A 12 11.419 -18.680 -12.168 1.00 0.00 O ATOM 230 CB THR A 12 9.943 -16.989 -9.634 1.00 0.00 C ATOM 231 OG1 THR A 12 8.647 -16.420 -9.417 1.00 0.00 O ATOM 232 CG2 THR A 12 10.951 -16.336 -8.700 1.00 0.00 C ATOM 0 H THR A 12 8.842 -15.361 -11.181 1.00 0.00 H new ATOM 0 HA THR A 12 11.363 -16.380 -11.140 1.00 0.00 H new ATOM 0 HB THR A 12 9.911 -18.057 -9.420 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.964 -16.999 -9.816 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.635 -16.479 -7.667 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.931 -16.791 -8.846 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.010 -15.269 -8.917 1.00 0.00 H new ATOM 240 N THR A 13 9.179 -18.742 -11.960 1.00 0.00 N ATOM 241 CA THR A 13 9.046 -20.043 -12.604 1.00 0.00 C ATOM 242 C THR A 13 9.402 -19.963 -14.084 1.00 0.00 C ATOM 243 O THR A 13 9.972 -20.898 -14.648 1.00 0.00 O ATOM 244 CB THR A 13 7.617 -20.598 -12.461 1.00 0.00 C ATOM 245 OG1 THR A 13 7.514 -21.864 -13.122 1.00 0.00 O ATOM 246 CG2 THR A 13 6.600 -19.630 -13.048 1.00 0.00 C ATOM 0 H THR A 13 8.297 -18.329 -11.657 1.00 0.00 H new ATOM 0 HA THR A 13 9.741 -20.716 -12.102 1.00 0.00 H new ATOM 0 HB THR A 13 7.405 -20.725 -11.399 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.602 -22.211 -13.025 1.00 0.00 H new ATOM 0 HG21 THR A 13 5.598 -20.043 -12.936 1.00 0.00 H new ATOM 0 HG22 THR A 13 6.660 -18.676 -12.523 1.00 0.00 H new ATOM 0 HG23 THR A 13 6.813 -19.476 -14.106 1.00 0.00 H new ATOM 254 N LEU A 14 9.064 -18.840 -14.709 1.00 0.00 N ATOM 255 CA LEU A 14 9.349 -18.637 -16.125 1.00 0.00 C ATOM 256 C LEU A 14 10.847 -18.724 -16.397 1.00 0.00 C ATOM 257 O LEU A 14 11.276 -19.342 -17.371 1.00 0.00 O ATOM 258 CB LEU A 14 8.814 -17.279 -16.584 1.00 0.00 C ATOM 259 CG LEU A 14 9.539 -16.636 -17.766 1.00 0.00 C ATOM 260 CD1 LEU A 14 8.569 -15.825 -18.611 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.684 -15.761 -17.277 1.00 0.00 C ATOM 0 H LEU A 14 8.592 -18.056 -14.257 1.00 0.00 H new ATOM 0 HA LEU A 14 8.850 -19.426 -16.687 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.763 -17.396 -16.848 1.00 0.00 H new ATOM 0 HB3 LEU A 14 8.856 -16.591 -15.740 1.00 0.00 H new ATOM 0 HG LEU A 14 9.954 -17.429 -18.388 1.00 0.00 H new ATOM 0 HD11 LEU A 14 9.104 -15.375 -19.448 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.784 -16.478 -18.991 1.00 0.00 H new ATOM 0 HD13 LEU A 14 8.123 -15.040 -18.001 1.00 0.00 H new ATOM 0 HD21 LEU A 14 11.189 -15.311 -18.132 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.291 -14.975 -16.633 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.393 -16.370 -16.716 1.00 0.00 H new ATOM 273 N GLN A 15 11.638 -18.102 -15.529 1.00 0.00 N ATOM 274 CA GLN A 15 13.089 -18.111 -15.675 1.00 0.00 C ATOM 275 C GLN A 15 13.684 -19.400 -15.117 1.00 0.00 C ATOM 276 O GLN A 15 14.697 -19.891 -15.614 1.00 0.00 O ATOM 277 CB GLN A 15 13.702 -16.903 -14.964 1.00 0.00 C ATOM 278 CG GLN A 15 13.494 -16.913 -13.458 1.00 0.00 C ATOM 279 CD GLN A 15 14.089 -15.695 -12.779 1.00 0.00 C ATOM 280 OE1 GLN A 15 15.308 -15.551 -12.694 1.00 0.00 O ATOM 281 NE2 GLN A 15 13.228 -14.810 -12.291 1.00 0.00 N ATOM 0 H GLN A 15 11.299 -17.586 -14.717 1.00 0.00 H new ATOM 0 HA GLN A 15 13.322 -18.055 -16.738 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.771 -16.872 -15.175 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.269 -15.991 -15.376 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.426 -16.959 -13.243 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.943 -17.814 -13.039 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.225 -14.970 -12.384 1.00 0.00 H new ATOM 0 HE22 GLN A 15 13.570 -13.970 -11.823 1.00 0.00 H new ATOM 290 N GLN A 16 13.048 -19.941 -14.083 1.00 0.00 N ATOM 291 CA GLN A 16 13.517 -21.172 -13.458 1.00 0.00 C ATOM 292 C GLN A 16 13.358 -22.357 -14.405 1.00 0.00 C ATOM 293 O GLN A 16 14.246 -23.205 -14.509 1.00 0.00 O ATOM 294 CB GLN A 16 12.750 -21.434 -12.161 1.00 0.00 C ATOM 295 CG GLN A 16 12.542 -22.910 -11.865 1.00 0.00 C ATOM 296 CD GLN A 16 13.846 -23.677 -11.774 1.00 0.00 C ATOM 297 OE1 GLN A 16 14.006 -24.728 -12.395 1.00 0.00 O ATOM 298 NE2 GLN A 16 14.789 -23.154 -10.999 1.00 0.00 N ATOM 0 H GLN A 16 12.207 -19.547 -13.661 1.00 0.00 H new ATOM 0 HA GLN A 16 14.576 -21.053 -13.228 1.00 0.00 H new ATOM 0 HB2 GLN A 16 13.290 -20.978 -11.331 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.779 -20.943 -12.218 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.997 -23.015 -10.927 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.921 -23.349 -12.646 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.614 -22.281 -10.502 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.688 -23.626 -10.901 1.00 0.00 H new ATOM 307 N PHE A 17 12.223 -22.412 -15.092 1.00 0.00 N ATOM 308 CA PHE A 17 11.947 -23.494 -16.029 1.00 0.00 C ATOM 309 C PHE A 17 12.309 -23.086 -17.454 1.00 0.00 C ATOM 310 O PHE A 17 12.295 -23.908 -18.370 1.00 0.00 O ATOM 311 CB PHE A 17 10.471 -23.894 -15.961 1.00 0.00 C ATOM 312 CG PHE A 17 10.252 -25.298 -15.476 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.417 -26.375 -16.332 1.00 0.00 C ATOM 314 CD2 PHE A 17 9.881 -25.542 -14.163 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.216 -27.668 -15.889 1.00 0.00 C ATOM 316 CE2 PHE A 17 9.680 -26.833 -13.714 1.00 0.00 C ATOM 317 CZ PHE A 17 9.846 -27.898 -14.578 1.00 0.00 C ATOM 0 H PHE A 17 11.478 -21.719 -15.018 1.00 0.00 H new ATOM 0 HA PHE A 17 12.561 -24.349 -15.747 1.00 0.00 H new ATOM 0 HB2 PHE A 17 9.946 -23.204 -15.300 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.028 -23.787 -16.951 1.00 0.00 H new ATOM 0 HD1 PHE A 17 10.706 -26.202 -17.358 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.748 -24.713 -13.483 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.348 -28.498 -16.567 1.00 0.00 H new ATOM 0 HE2 PHE A 17 9.393 -27.010 -12.688 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.687 -28.908 -14.230 1.00 0.00 H new ATOM 327 N GLY A 18 12.634 -21.809 -17.633 1.00 0.00 N ATOM 328 CA GLY A 18 12.995 -21.313 -18.948 1.00 0.00 C ATOM 329 C GLY A 18 14.155 -22.075 -19.558 1.00 0.00 C ATOM 330 O GLY A 18 14.301 -22.125 -20.778 1.00 0.00 O ATOM 0 H GLY A 18 12.654 -21.110 -16.891 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.131 -21.383 -19.609 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.256 -20.257 -18.875 1.00 0.00 H new ATOM 334 N ASN A 19 14.982 -22.671 -18.705 1.00 0.00 N ATOM 335 CA ASN A 19 16.137 -23.433 -19.167 1.00 0.00 C ATOM 336 C ASN A 19 15.720 -24.825 -19.631 1.00 0.00 C ATOM 337 O ASN A 19 16.524 -25.572 -20.190 1.00 0.00 O ATOM 338 CB ASN A 19 17.179 -23.546 -18.052 1.00 0.00 C ATOM 339 CG ASN A 19 18.527 -22.986 -18.463 1.00 0.00 C ATOM 340 OD1 ASN A 19 18.859 -21.843 -18.149 1.00 0.00 O ATOM 341 ND2 ASN A 19 19.312 -23.793 -19.168 1.00 0.00 N ATOM 0 H ASN A 19 14.874 -22.641 -17.691 1.00 0.00 H new ATOM 0 HA ASN A 19 16.575 -22.903 -20.013 1.00 0.00 H new ATOM 0 HB2 ASN A 19 16.822 -23.016 -17.169 1.00 0.00 H new ATOM 0 HB3 ASN A 19 17.294 -24.593 -17.770 1.00 0.00 H new ATOM 0 HD21 ASN A 19 20.232 -23.473 -19.472 1.00 0.00 H new ATOM 0 HD22 ASN A 19 18.995 -24.733 -19.406 1.00 0.00 H new ATOM 348 N ASP A 20 14.458 -25.167 -19.396 1.00 0.00 N ATOM 349 CA ASP A 20 13.932 -26.469 -19.791 1.00 0.00 C ATOM 350 C ASP A 20 13.337 -26.412 -21.195 1.00 0.00 C ATOM 351 O ASP A 20 13.626 -27.262 -22.037 1.00 0.00 O ATOM 352 CB ASP A 20 12.873 -26.939 -18.793 1.00 0.00 C ATOM 353 CG ASP A 20 12.481 -28.388 -19.005 1.00 0.00 C ATOM 354 OD1 ASP A 20 11.574 -28.644 -19.824 1.00 0.00 O ATOM 355 OD2 ASP A 20 13.081 -29.267 -18.350 1.00 0.00 O ATOM 0 H ASP A 20 13.780 -24.561 -18.934 1.00 0.00 H new ATOM 0 HA ASP A 20 14.757 -27.181 -19.795 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.252 -26.813 -17.779 1.00 0.00 H new ATOM 0 HB3 ASP A 20 11.988 -26.309 -18.883 1.00 0.00 H new ATOM 360 N ILE A 21 12.505 -25.405 -21.438 1.00 0.00 N ATOM 361 CA ILE A 21 11.869 -25.237 -22.739 1.00 0.00 C ATOM 362 C ILE A 21 12.898 -25.284 -23.863 1.00 0.00 C ATOM 363 O ILE A 21 12.634 -25.821 -24.939 1.00 0.00 O ATOM 364 CB ILE A 21 11.095 -23.908 -22.821 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.711 -23.605 -24.270 1.00 0.00 C ATOM 366 CG2 ILE A 21 11.927 -22.775 -22.239 1.00 0.00 C ATOM 367 CD1 ILE A 21 9.847 -22.373 -24.421 1.00 0.00 C ATOM 0 H ILE A 21 12.256 -24.693 -20.751 1.00 0.00 H new ATOM 0 HA ILE A 21 11.168 -26.063 -22.856 1.00 0.00 H new ATOM 0 HB ILE A 21 10.181 -24.000 -22.235 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.619 -23.476 -24.859 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.182 -24.463 -24.684 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.367 -21.842 -22.304 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.155 -22.990 -21.195 1.00 0.00 H new ATOM 0 HG23 ILE A 21 12.856 -22.680 -22.801 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.614 -22.219 -25.475 1.00 0.00 H new ATOM 0 HD12 ILE A 21 8.922 -22.506 -23.860 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.382 -21.504 -24.037 1.00 0.00 H new ATOM 379 N SER A 22 14.073 -24.718 -23.607 1.00 0.00 N ATOM 380 CA SER A 22 15.142 -24.692 -24.598 1.00 0.00 C ATOM 381 C SER A 22 16.360 -23.943 -24.065 1.00 0.00 C ATOM 382 O SER A 22 16.274 -23.162 -23.117 1.00 0.00 O ATOM 383 CB SER A 22 14.652 -24.038 -25.891 1.00 0.00 C ATOM 384 OG SER A 22 14.552 -24.988 -26.937 1.00 0.00 O ATOM 0 H SER A 22 14.309 -24.271 -22.721 1.00 0.00 H new ATOM 0 HA SER A 22 15.434 -25.721 -24.808 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.680 -23.575 -25.722 1.00 0.00 H new ATOM 0 HB3 SER A 22 15.338 -23.243 -26.182 1.00 0.00 H new ATOM 0 HG SER A 22 13.876 -25.659 -26.706 1.00 0.00 H new ATOM 390 N PRO A 23 17.522 -24.185 -24.688 1.00 0.00 N ATOM 391 CA PRO A 23 18.780 -23.543 -24.295 1.00 0.00 C ATOM 392 C PRO A 23 18.800 -22.055 -24.626 1.00 0.00 C ATOM 393 O PRO A 23 19.090 -21.223 -23.767 1.00 0.00 O ATOM 394 CB PRO A 23 19.832 -24.289 -25.120 1.00 0.00 C ATOM 395 CG PRO A 23 19.090 -24.800 -26.306 1.00 0.00 C ATOM 396 CD PRO A 23 17.698 -25.104 -25.825 1.00 0.00 C ATOM 0 HA PRO A 23 18.946 -23.596 -23.219 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.645 -23.627 -25.417 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.277 -25.104 -24.550 1.00 0.00 H new ATOM 0 HG2 PRO A 23 19.073 -24.059 -27.105 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.567 -25.693 -26.710 1.00 0.00 H new ATOM 0 HD2 PRO A 23 16.956 -24.927 -26.604 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.597 -26.145 -25.519 1.00 0.00 H new ATOM 404 N GLU A 24 18.489 -21.728 -25.876 1.00 0.00 N ATOM 405 CA GLU A 24 18.472 -20.339 -26.320 1.00 0.00 C ATOM 406 C GLU A 24 17.587 -19.489 -25.413 1.00 0.00 C ATOM 407 O GLU A 24 18.071 -18.597 -24.714 1.00 0.00 O ATOM 408 CB GLU A 24 17.977 -20.247 -27.765 1.00 0.00 C ATOM 409 CG GLU A 24 16.950 -21.308 -28.124 1.00 0.00 C ATOM 410 CD GLU A 24 17.525 -22.403 -29.002 1.00 0.00 C ATOM 411 OE1 GLU A 24 18.329 -22.081 -29.902 1.00 0.00 O ATOM 412 OE2 GLU A 24 17.171 -23.581 -28.789 1.00 0.00 O ATOM 0 H GLU A 24 18.246 -22.405 -26.599 1.00 0.00 H new ATOM 0 HA GLU A 24 19.491 -19.956 -26.268 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.542 -19.261 -27.929 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.829 -20.335 -28.439 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.555 -21.750 -27.209 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.112 -20.838 -28.638 1.00 0.00 H new ATOM 419 N ILE A 25 16.289 -19.771 -25.430 1.00 0.00 N ATOM 420 CA ILE A 25 15.336 -19.033 -24.609 1.00 0.00 C ATOM 421 C ILE A 25 15.770 -19.014 -23.147 1.00 0.00 C ATOM 422 O ILE A 25 15.561 -18.030 -22.439 1.00 0.00 O ATOM 423 CB ILE A 25 13.923 -19.638 -24.706 1.00 0.00 C ATOM 424 CG1 ILE A 25 12.919 -18.767 -23.947 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.916 -21.059 -24.163 1.00 0.00 C ATOM 426 CD1 ILE A 25 13.053 -17.290 -24.246 1.00 0.00 C ATOM 0 H ILE A 25 15.873 -20.505 -26.003 1.00 0.00 H new ATOM 0 HA ILE A 25 15.312 -18.013 -24.992 1.00 0.00 H new ATOM 0 HB ILE A 25 13.629 -19.670 -25.755 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.908 -19.090 -24.197 1.00 0.00 H new ATOM 0 HG13 ILE A 25 13.049 -18.926 -22.876 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.910 -21.472 -24.239 1.00 0.00 H new ATOM 0 HG22 ILE A 25 14.605 -21.673 -24.742 1.00 0.00 H new ATOM 0 HG23 ILE A 25 14.227 -21.051 -23.118 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.310 -16.734 -23.674 1.00 0.00 H new ATOM 0 HD12 ILE A 25 14.052 -16.952 -23.970 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.894 -17.118 -25.311 1.00 0.00 H new ATOM 438 N GLY A 26 16.377 -20.110 -22.701 1.00 0.00 N ATOM 439 CA GLY A 26 16.832 -20.198 -21.326 1.00 0.00 C ATOM 440 C GLY A 26 17.878 -19.152 -20.993 1.00 0.00 C ATOM 441 O GLY A 26 17.641 -18.269 -20.170 1.00 0.00 O ATOM 0 H GLY A 26 16.562 -20.938 -23.267 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.980 -20.081 -20.656 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.245 -21.191 -21.146 1.00 0.00 H new ATOM 445 N GLU A 27 19.039 -19.254 -21.634 1.00 0.00 N ATOM 446 CA GLU A 27 20.125 -18.310 -21.399 1.00 0.00 C ATOM 447 C GLU A 27 19.631 -16.871 -21.517 1.00 0.00 C ATOM 448 O GLU A 27 20.003 -16.009 -20.721 1.00 0.00 O ATOM 449 CB GLU A 27 21.264 -18.552 -22.391 1.00 0.00 C ATOM 450 CG GLU A 27 20.832 -18.471 -23.846 1.00 0.00 C ATOM 451 CD GLU A 27 21.984 -18.681 -24.809 1.00 0.00 C ATOM 452 OE1 GLU A 27 22.974 -17.924 -24.725 1.00 0.00 O ATOM 453 OE2 GLU A 27 21.895 -19.603 -25.647 1.00 0.00 O ATOM 0 H GLU A 27 19.251 -19.980 -22.319 1.00 0.00 H new ATOM 0 HA GLU A 27 20.495 -18.467 -20.386 1.00 0.00 H new ATOM 0 HB2 GLU A 27 22.051 -17.819 -22.213 1.00 0.00 H new ATOM 0 HB3 GLU A 27 21.695 -19.535 -22.203 1.00 0.00 H new ATOM 0 HG2 GLU A 27 20.064 -19.221 -24.035 1.00 0.00 H new ATOM 0 HG3 GLU A 27 20.380 -17.497 -24.033 1.00 0.00 H new ATOM 460 N ARG A 28 18.791 -16.620 -22.515 1.00 0.00 N ATOM 461 CA ARG A 28 18.247 -15.286 -22.739 1.00 0.00 C ATOM 462 C ARG A 28 17.338 -14.870 -21.586 1.00 0.00 C ATOM 463 O ARG A 28 17.582 -13.862 -20.922 1.00 0.00 O ATOM 464 CB ARG A 28 17.470 -15.243 -24.056 1.00 0.00 C ATOM 465 CG ARG A 28 17.652 -13.947 -24.829 1.00 0.00 C ATOM 466 CD ARG A 28 18.757 -14.069 -25.867 1.00 0.00 C ATOM 467 NE ARG A 28 19.528 -12.835 -25.992 1.00 0.00 N ATOM 468 CZ ARG A 28 20.257 -12.529 -27.059 1.00 0.00 C ATOM 469 NH1 ARG A 28 20.314 -13.362 -28.089 1.00 0.00 N ATOM 470 NH2 ARG A 28 20.932 -11.386 -27.098 1.00 0.00 N ATOM 0 H ARG A 28 18.472 -17.323 -23.182 1.00 0.00 H new ATOM 0 HA ARG A 28 19.080 -14.585 -22.794 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.787 -16.077 -24.682 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.410 -15.386 -23.847 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.717 -13.681 -25.321 1.00 0.00 H new ATOM 0 HG3 ARG A 28 17.889 -13.139 -24.137 1.00 0.00 H new ATOM 0 HD2 ARG A 28 19.423 -14.887 -25.593 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.321 -14.323 -26.833 1.00 0.00 H new ATOM 0 HE ARG A 28 19.505 -12.172 -25.217 1.00 0.00 H new ATOM 0 HH11 ARG A 28 19.797 -14.241 -28.063 1.00 0.00 H new ATOM 0 HH12 ARG A 28 20.875 -13.124 -28.907 1.00 0.00 H new ATOM 0 HH21 ARG A 28 20.891 -10.742 -26.308 1.00 0.00 H new ATOM 0 HH22 ARG A 28 21.492 -11.152 -27.918 1.00 0.00 H new ATOM 484 N VAL A 29 16.288 -15.652 -21.354 1.00 0.00 N ATOM 485 CA VAL A 29 15.343 -15.365 -20.282 1.00 0.00 C ATOM 486 C VAL A 29 16.069 -14.971 -19.000 1.00 0.00 C ATOM 487 O VAL A 29 15.867 -13.877 -18.472 1.00 0.00 O ATOM 488 CB VAL A 29 14.436 -16.576 -19.994 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.783 -16.441 -18.627 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.386 -16.726 -21.084 1.00 0.00 C ATOM 0 H VAL A 29 16.071 -16.489 -21.895 1.00 0.00 H new ATOM 0 HA VAL A 29 14.727 -14.531 -20.618 1.00 0.00 H new ATOM 0 HB VAL A 29 15.051 -17.476 -19.988 1.00 0.00 H new ATOM 0 HG11 VAL A 29 13.146 -17.306 -18.441 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.555 -16.387 -17.859 1.00 0.00 H new ATOM 0 HG13 VAL A 29 13.180 -15.534 -18.600 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.754 -17.586 -20.864 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.772 -15.826 -21.124 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.878 -16.873 -22.045 1.00 0.00 H new ATOM 500 N ARG A 30 16.915 -15.869 -18.506 1.00 0.00 N ATOM 501 CA ARG A 30 17.671 -15.615 -17.286 1.00 0.00 C ATOM 502 C ARG A 30 18.531 -14.363 -17.429 1.00 0.00 C ATOM 503 O ARG A 30 18.575 -13.519 -16.533 1.00 0.00 O ATOM 504 CB ARG A 30 18.554 -16.818 -16.948 1.00 0.00 C ATOM 505 CG ARG A 30 19.554 -17.164 -18.039 1.00 0.00 C ATOM 506 CD ARG A 30 20.058 -18.592 -17.900 1.00 0.00 C ATOM 507 NE ARG A 30 20.360 -18.934 -16.513 1.00 0.00 N ATOM 508 CZ ARG A 30 21.434 -18.497 -15.865 1.00 0.00 C ATOM 509 NH1 ARG A 30 22.305 -17.706 -16.477 1.00 0.00 N ATOM 510 NH2 ARG A 30 21.640 -18.852 -14.603 1.00 0.00 N ATOM 0 H ARG A 30 17.094 -16.778 -18.932 1.00 0.00 H new ATOM 0 HA ARG A 30 16.960 -15.455 -16.475 1.00 0.00 H new ATOM 0 HB2 ARG A 30 19.094 -16.614 -16.023 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.918 -17.684 -16.761 1.00 0.00 H new ATOM 0 HG2 ARG A 30 19.088 -17.035 -19.016 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.396 -16.474 -17.994 1.00 0.00 H new ATOM 0 HD2 ARG A 30 19.307 -19.281 -18.288 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.953 -18.721 -18.508 1.00 0.00 H new ATOM 0 HE ARG A 30 19.710 -19.542 -16.014 1.00 0.00 H new ATOM 0 HH11 ARG A 30 22.151 -17.432 -17.447 1.00 0.00 H new ATOM 0 HH12 ARG A 30 23.129 -17.372 -15.977 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.973 -19.461 -14.129 1.00 0.00 H new ATOM 0 HH22 ARG A 30 22.465 -18.516 -14.107 1.00 0.00 H new ATOM 524 N THR A 31 19.217 -14.249 -18.563 1.00 0.00 N ATOM 525 CA THR A 31 20.077 -13.102 -18.824 1.00 0.00 C ATOM 526 C THR A 31 19.311 -11.793 -18.670 1.00 0.00 C ATOM 527 O THR A 31 19.671 -10.943 -17.854 1.00 0.00 O ATOM 528 CB THR A 31 20.684 -13.165 -20.238 1.00 0.00 C ATOM 529 OG1 THR A 31 21.717 -14.155 -20.285 1.00 0.00 O ATOM 530 CG2 THR A 31 21.251 -11.813 -20.644 1.00 0.00 C ATOM 0 H THR A 31 19.193 -14.938 -19.315 1.00 0.00 H new ATOM 0 HA THR A 31 20.881 -13.137 -18.089 1.00 0.00 H new ATOM 0 HB THR A 31 19.892 -13.434 -20.937 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.387 -14.950 -20.753 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.674 -11.882 -21.646 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.456 -11.068 -20.637 1.00 0.00 H new ATOM 0 HG23 THR A 31 22.030 -11.519 -19.941 1.00 0.00 H new ATOM 538 N LEU A 32 18.252 -11.637 -19.457 1.00 0.00 N ATOM 539 CA LEU A 32 17.433 -10.431 -19.407 1.00 0.00 C ATOM 540 C LEU A 32 16.856 -10.222 -18.011 1.00 0.00 C ATOM 541 O LEU A 32 17.062 -9.177 -17.393 1.00 0.00 O ATOM 542 CB LEU A 32 16.301 -10.517 -20.432 1.00 0.00 C ATOM 543 CG LEU A 32 16.681 -11.067 -21.808 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.600 -10.746 -22.828 1.00 0.00 C ATOM 545 CD2 LEU A 32 18.023 -10.505 -22.255 1.00 0.00 C ATOM 0 H LEU A 32 17.940 -12.330 -20.137 1.00 0.00 H new ATOM 0 HA LEU A 32 18.069 -9.579 -19.648 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.510 -11.143 -20.018 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.882 -9.520 -20.565 1.00 0.00 H new ATOM 0 HG LEU A 32 16.771 -12.151 -21.733 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.888 -11.145 -23.801 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.659 -11.197 -22.515 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.478 -9.665 -22.901 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.277 -10.907 -23.236 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.961 -9.418 -22.313 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.793 -10.787 -21.537 1.00 0.00 H new ATOM 557 N VAL A 33 16.133 -11.223 -17.519 1.00 0.00 N ATOM 558 CA VAL A 33 15.528 -11.150 -16.194 1.00 0.00 C ATOM 559 C VAL A 33 16.547 -10.709 -15.149 1.00 0.00 C ATOM 560 O VAL A 33 16.488 -9.588 -14.644 1.00 0.00 O ATOM 561 CB VAL A 33 14.932 -12.507 -15.774 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.459 -12.458 -14.330 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.794 -12.899 -16.704 1.00 0.00 C ATOM 0 H VAL A 33 15.952 -12.094 -18.018 1.00 0.00 H new ATOM 0 HA VAL A 33 14.728 -10.412 -16.251 1.00 0.00 H new ATOM 0 HB VAL A 33 15.711 -13.266 -15.850 1.00 0.00 H new ATOM 0 HG11 VAL A 33 14.041 -13.425 -14.051 1.00 0.00 H new ATOM 0 HG12 VAL A 33 15.302 -12.225 -13.679 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.695 -11.688 -14.223 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.384 -13.860 -16.393 1.00 0.00 H new ATOM 0 HG22 VAL A 33 13.012 -12.141 -16.662 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.169 -12.978 -17.725 1.00 0.00 H new ATOM 573 N LEU A 34 17.480 -11.599 -14.829 1.00 0.00 N ATOM 574 CA LEU A 34 18.513 -11.302 -13.843 1.00 0.00 C ATOM 575 C LEU A 34 19.209 -9.983 -14.163 1.00 0.00 C ATOM 576 O LEU A 34 19.601 -9.241 -13.263 1.00 0.00 O ATOM 577 CB LEU A 34 19.540 -12.435 -13.795 1.00 0.00 C ATOM 578 CG LEU A 34 19.131 -13.678 -13.005 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.181 -13.401 -11.510 1.00 0.00 C ATOM 580 CD2 LEU A 34 17.741 -14.139 -13.418 1.00 0.00 C ATOM 0 H LEU A 34 17.542 -12.531 -15.238 1.00 0.00 H new ATOM 0 HA LEU A 34 18.034 -11.211 -12.868 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.766 -12.737 -14.818 1.00 0.00 H new ATOM 0 HB3 LEU A 34 20.463 -12.044 -13.367 1.00 0.00 H new ATOM 0 HG LEU A 34 19.838 -14.477 -13.229 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.887 -14.297 -10.964 1.00 0.00 H new ATOM 0 HD12 LEU A 34 20.195 -13.120 -11.226 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.497 -12.587 -11.268 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.466 -15.025 -12.845 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.021 -13.344 -13.224 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.738 -14.379 -14.481 1.00 0.00 H new ATOM 592 N GLY A 35 19.357 -9.695 -15.453 1.00 0.00 N ATOM 593 CA GLY A 35 20.003 -8.465 -15.870 1.00 0.00 C ATOM 594 C GLY A 35 19.300 -7.232 -15.338 1.00 0.00 C ATOM 595 O GLY A 35 19.825 -6.534 -14.469 1.00 0.00 O ATOM 0 H GLY A 35 19.041 -10.293 -16.217 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.037 -8.467 -15.526 1.00 0.00 H new ATOM 0 HA3 GLY A 35 20.029 -8.423 -16.959 1.00 0.00 H new ATOM 599 N LEU A 36 18.109 -6.960 -15.860 1.00 0.00 N ATOM 600 CA LEU A 36 17.332 -5.801 -15.434 1.00 0.00 C ATOM 601 C LEU A 36 17.138 -5.803 -13.921 1.00 0.00 C ATOM 602 O LEU A 36 16.916 -4.757 -13.312 1.00 0.00 O ATOM 603 CB LEU A 36 15.973 -5.788 -16.134 1.00 0.00 C ATOM 604 CG LEU A 36 15.154 -7.075 -16.035 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.300 -7.069 -14.776 1.00 0.00 C ATOM 606 CD2 LEU A 36 14.283 -7.250 -17.271 1.00 0.00 C ATOM 0 H LEU A 36 17.660 -7.527 -16.579 1.00 0.00 H new ATOM 0 HA LEU A 36 17.884 -4.903 -15.710 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.381 -4.972 -15.720 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.132 -5.563 -17.189 1.00 0.00 H new ATOM 0 HG LEU A 36 15.843 -7.918 -15.978 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.724 -7.993 -14.723 1.00 0.00 H new ATOM 0 HD12 LEU A 36 14.944 -6.992 -13.900 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.619 -6.218 -14.802 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.707 -8.171 -17.183 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.602 -6.403 -17.359 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.915 -7.301 -18.157 1.00 0.00 H new ATOM 618 N VAL A 37 17.224 -6.986 -13.320 1.00 0.00 N ATOM 619 CA VAL A 37 17.061 -7.124 -11.877 1.00 0.00 C ATOM 620 C VAL A 37 18.215 -6.467 -11.128 1.00 0.00 C ATOM 621 O VAL A 37 18.012 -5.546 -10.338 1.00 0.00 O ATOM 622 CB VAL A 37 16.970 -8.604 -11.462 1.00 0.00 C ATOM 623 CG1 VAL A 37 17.055 -8.741 -9.949 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.686 -9.227 -11.990 1.00 0.00 C ATOM 0 H VAL A 37 17.406 -7.862 -13.810 1.00 0.00 H new ATOM 0 HA VAL A 37 16.129 -6.623 -11.614 1.00 0.00 H new ATOM 0 HB VAL A 37 17.813 -9.138 -11.899 1.00 0.00 H new ATOM 0 HG11 VAL A 37 16.989 -9.794 -9.675 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.004 -8.334 -9.600 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.233 -8.194 -9.487 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.638 -10.273 -11.688 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.828 -8.692 -11.583 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.671 -9.163 -13.078 1.00 0.00 H new ATOM 634 N ASN A 38 19.428 -6.947 -11.383 1.00 0.00 N ATOM 635 CA ASN A 38 20.616 -6.407 -10.732 1.00 0.00 C ATOM 636 C ASN A 38 21.530 -5.726 -11.747 1.00 0.00 C ATOM 637 O ASN A 38 21.974 -4.597 -11.538 1.00 0.00 O ATOM 638 CB ASN A 38 21.378 -7.519 -10.010 1.00 0.00 C ATOM 639 CG ASN A 38 20.491 -8.702 -9.671 1.00 0.00 C ATOM 640 OD1 ASN A 38 19.992 -8.818 -8.552 1.00 0.00 O ATOM 641 ND2 ASN A 38 20.291 -9.588 -10.640 1.00 0.00 N ATOM 0 H ASN A 38 19.614 -7.709 -12.036 1.00 0.00 H new ATOM 0 HA ASN A 38 20.294 -5.664 -10.003 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.204 -7.856 -10.636 1.00 0.00 H new ATOM 0 HB3 ASN A 38 21.814 -7.121 -9.094 1.00 0.00 H new ATOM 0 HD21 ASN A 38 19.704 -10.405 -10.471 1.00 0.00 H new ATOM 0 HD22 ASN A 38 20.725 -9.452 -11.553 1.00 0.00 H new ATOM 648 N SER A 39 21.805 -6.420 -12.847 1.00 0.00 N ATOM 649 CA SER A 39 22.668 -5.884 -13.893 1.00 0.00 C ATOM 650 C SER A 39 22.035 -4.659 -14.545 1.00 0.00 C ATOM 651 O SER A 39 20.850 -4.382 -14.356 1.00 0.00 O ATOM 652 CB SER A 39 22.945 -6.953 -14.952 1.00 0.00 C ATOM 653 OG SER A 39 24.295 -6.908 -15.381 1.00 0.00 O ATOM 0 H SER A 39 21.443 -7.354 -13.037 1.00 0.00 H new ATOM 0 HA SER A 39 23.610 -5.584 -13.434 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.722 -7.939 -14.545 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.284 -6.804 -15.806 1.00 0.00 H new ATOM 0 HG SER A 39 24.447 -7.602 -16.056 1.00 0.00 H new ATOM 659 N THR A 40 22.834 -3.926 -15.314 1.00 0.00 N ATOM 660 CA THR A 40 22.354 -2.730 -15.994 1.00 0.00 C ATOM 661 C THR A 40 21.568 -3.088 -17.250 1.00 0.00 C ATOM 662 O THR A 40 22.142 -3.258 -18.326 1.00 0.00 O ATOM 663 CB THR A 40 23.518 -1.797 -16.379 1.00 0.00 C ATOM 664 OG1 THR A 40 24.147 -1.285 -15.199 1.00 0.00 O ATOM 665 CG2 THR A 40 23.025 -0.643 -17.239 1.00 0.00 C ATOM 0 H THR A 40 23.817 -4.140 -15.481 1.00 0.00 H new ATOM 0 HA THR A 40 21.698 -2.212 -15.295 1.00 0.00 H new ATOM 0 HB THR A 40 24.242 -2.374 -16.954 1.00 0.00 H new ATOM 0 HG1 THR A 40 24.887 -0.694 -15.453 1.00 0.00 H new ATOM 0 HG21 THR A 40 23.864 0.002 -17.498 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.574 -1.035 -18.150 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.283 -0.068 -16.685 1.00 0.00 H new ATOM 673 N LEU A 41 20.252 -3.202 -17.106 1.00 0.00 N ATOM 674 CA LEU A 41 19.386 -3.540 -18.231 1.00 0.00 C ATOM 675 C LEU A 41 18.052 -2.806 -18.131 1.00 0.00 C ATOM 676 O LEU A 41 17.502 -2.641 -17.041 1.00 0.00 O ATOM 677 CB LEU A 41 19.148 -5.050 -18.280 1.00 0.00 C ATOM 678 CG LEU A 41 20.004 -5.832 -19.278 1.00 0.00 C ATOM 679 CD1 LEU A 41 21.154 -6.527 -18.565 1.00 0.00 C ATOM 680 CD2 LEU A 41 19.153 -6.843 -20.033 1.00 0.00 C ATOM 0 H LEU A 41 19.761 -3.066 -16.222 1.00 0.00 H new ATOM 0 HA LEU A 41 19.884 -3.227 -19.149 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.322 -5.458 -17.284 1.00 0.00 H new ATOM 0 HB3 LEU A 41 18.098 -5.225 -18.517 1.00 0.00 H new ATOM 0 HG LEU A 41 20.422 -5.129 -19.998 1.00 0.00 H new ATOM 0 HD11 LEU A 41 21.752 -7.078 -19.291 1.00 0.00 H new ATOM 0 HD12 LEU A 41 21.778 -5.783 -18.071 1.00 0.00 H new ATOM 0 HD13 LEU A 41 20.757 -7.219 -17.822 1.00 0.00 H new ATOM 0 HD21 LEU A 41 19.778 -7.390 -20.739 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.706 -7.542 -19.326 1.00 0.00 H new ATOM 0 HD23 LEU A 41 18.364 -6.322 -20.576 1.00 0.00 H new ATOM 692 N THR A 42 17.535 -2.370 -19.275 1.00 0.00 N ATOM 693 CA THR A 42 16.266 -1.655 -19.317 1.00 0.00 C ATOM 694 C THR A 42 15.154 -2.541 -19.868 1.00 0.00 C ATOM 695 O THR A 42 15.412 -3.477 -20.625 1.00 0.00 O ATOM 696 CB THR A 42 16.366 -0.382 -20.178 1.00 0.00 C ATOM 697 OG1 THR A 42 15.093 0.272 -20.236 1.00 0.00 O ATOM 698 CG2 THR A 42 16.835 -0.716 -21.586 1.00 0.00 C ATOM 0 H THR A 42 17.976 -2.500 -20.186 1.00 0.00 H new ATOM 0 HA THR A 42 16.028 -1.373 -18.291 1.00 0.00 H new ATOM 0 HB THR A 42 17.096 0.284 -19.718 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.166 1.081 -20.784 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.898 0.199 -22.175 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.817 -1.186 -21.540 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.126 -1.400 -22.053 1.00 0.00 H new ATOM 706 N ILE A 43 13.919 -2.240 -19.483 1.00 0.00 N ATOM 707 CA ILE A 43 12.768 -3.009 -19.941 1.00 0.00 C ATOM 708 C ILE A 43 12.791 -3.184 -21.455 1.00 0.00 C ATOM 709 O ILE A 43 12.585 -4.285 -21.965 1.00 0.00 O ATOM 710 CB ILE A 43 11.444 -2.336 -19.533 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.402 -2.118 -18.019 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.261 -3.180 -19.984 1.00 0.00 C ATOM 713 CD1 ILE A 43 10.666 -3.207 -17.271 1.00 0.00 C ATOM 0 H ILE A 43 13.689 -1.470 -18.855 1.00 0.00 H new ATOM 0 HA ILE A 43 12.831 -3.987 -19.464 1.00 0.00 H new ATOM 0 HB ILE A 43 11.381 -1.364 -20.023 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.422 -2.055 -17.641 1.00 0.00 H new ATOM 0 HG13 ILE A 43 10.925 -1.160 -17.811 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.332 -2.692 -19.689 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.285 -3.290 -21.068 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.318 -4.164 -19.519 1.00 0.00 H new ATOM 0 HD11 ILE A 43 10.677 -2.986 -16.204 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.635 -3.256 -17.621 1.00 0.00 H new ATOM 0 HD13 ILE A 43 11.155 -4.165 -17.448 1.00 0.00 H new ATOM 725 N GLU A 44 13.045 -2.091 -22.168 1.00 0.00 N ATOM 726 CA GLU A 44 13.096 -2.125 -23.625 1.00 0.00 C ATOM 727 C GLU A 44 14.102 -3.165 -24.110 1.00 0.00 C ATOM 728 O GLU A 44 13.807 -3.960 -25.001 1.00 0.00 O ATOM 729 CB GLU A 44 13.464 -0.746 -24.177 1.00 0.00 C ATOM 730 CG GLU A 44 13.271 -0.620 -25.679 1.00 0.00 C ATOM 731 CD GLU A 44 14.021 0.560 -26.267 1.00 0.00 C ATOM 732 OE1 GLU A 44 13.758 1.703 -25.838 1.00 0.00 O ATOM 733 OE2 GLU A 44 14.870 0.339 -27.155 1.00 0.00 O ATOM 0 H GLU A 44 13.218 -1.172 -21.761 1.00 0.00 H new ATOM 0 HA GLU A 44 12.108 -2.403 -23.991 1.00 0.00 H new ATOM 0 HB2 GLU A 44 12.858 0.010 -23.677 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.505 -0.533 -23.934 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.607 -1.537 -26.163 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.208 -0.516 -25.897 1.00 0.00 H new ATOM 740 N GLU A 45 15.292 -3.150 -23.517 1.00 0.00 N ATOM 741 CA GLU A 45 16.342 -4.090 -23.890 1.00 0.00 C ATOM 742 C GLU A 45 15.952 -5.518 -23.517 1.00 0.00 C ATOM 743 O GLU A 45 16.240 -6.463 -24.250 1.00 0.00 O ATOM 744 CB GLU A 45 17.659 -3.715 -23.207 1.00 0.00 C ATOM 745 CG GLU A 45 18.777 -4.716 -23.448 1.00 0.00 C ATOM 746 CD GLU A 45 19.800 -4.217 -24.451 1.00 0.00 C ATOM 747 OE1 GLU A 45 19.445 -4.080 -25.641 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.954 -3.965 -24.047 1.00 0.00 O ATOM 0 H GLU A 45 15.552 -2.498 -22.777 1.00 0.00 H new ATOM 0 HA GLU A 45 16.473 -4.038 -24.971 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.977 -2.735 -23.563 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.489 -3.624 -22.134 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.276 -4.933 -22.503 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.350 -5.653 -23.806 1.00 0.00 H new ATOM 755 N PHE A 46 15.296 -5.665 -22.371 1.00 0.00 N ATOM 756 CA PHE A 46 14.867 -6.976 -21.899 1.00 0.00 C ATOM 757 C PHE A 46 13.734 -7.522 -22.763 1.00 0.00 C ATOM 758 O PHE A 46 13.549 -8.735 -22.870 1.00 0.00 O ATOM 759 CB PHE A 46 14.416 -6.894 -20.439 1.00 0.00 C ATOM 760 CG PHE A 46 13.144 -7.644 -20.161 1.00 0.00 C ATOM 761 CD1 PHE A 46 11.913 -7.032 -20.327 1.00 0.00 C ATOM 762 CD2 PHE A 46 13.182 -8.962 -19.734 1.00 0.00 C ATOM 763 CE1 PHE A 46 10.741 -7.720 -20.072 1.00 0.00 C ATOM 764 CE2 PHE A 46 12.013 -9.655 -19.479 1.00 0.00 C ATOM 765 CZ PHE A 46 10.792 -9.033 -19.647 1.00 0.00 C ATOM 0 H PHE A 46 15.050 -4.893 -21.752 1.00 0.00 H new ATOM 0 HA PHE A 46 15.716 -7.656 -21.972 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.207 -7.287 -19.800 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.278 -5.847 -20.168 1.00 0.00 H new ATOM 0 HD1 PHE A 46 11.868 -6.005 -20.659 1.00 0.00 H new ATOM 0 HD2 PHE A 46 14.135 -9.453 -19.599 1.00 0.00 H new ATOM 0 HE1 PHE A 46 9.787 -7.231 -20.205 1.00 0.00 H new ATOM 0 HE2 PHE A 46 12.055 -10.682 -19.149 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.878 -9.572 -19.446 1.00 0.00 H new ATOM 775 N HIS A 47 12.979 -6.618 -23.378 1.00 0.00 N ATOM 776 CA HIS A 47 11.864 -7.008 -24.234 1.00 0.00 C ATOM 777 C HIS A 47 12.318 -7.162 -25.682 1.00 0.00 C ATOM 778 O HIS A 47 11.635 -7.786 -26.494 1.00 0.00 O ATOM 779 CB HIS A 47 10.741 -5.973 -24.147 1.00 0.00 C ATOM 780 CG HIS A 47 9.724 -6.100 -25.239 1.00 0.00 C ATOM 781 ND1 HIS A 47 9.249 -5.186 -26.117 1.00 0.00 N flip ATOM 782 CD2 HIS A 47 9.070 -7.280 -25.525 1.00 0.00 C flip ATOM 783 CE1 HIS A 47 8.326 -5.823 -26.909 1.00 0.00 C flip ATOM 784 NE2 HIS A 47 8.237 -7.086 -26.532 1.00 0.00 N flip ATOM 0 H HIS A 47 13.119 -5.611 -23.300 1.00 0.00 H new ATOM 0 HA HIS A 47 11.490 -7.970 -23.885 1.00 0.00 H new ATOM 0 HB2 HIS A 47 10.241 -6.071 -23.183 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.175 -4.974 -24.181 1.00 0.00 H new ATOM 0 HD2 HIS A 47 9.216 -8.216 -25.007 1.00 0.00 H new ATOM 0 HE1 HIS A 47 7.764 -5.366 -27.710 1.00 0.00 H new ATOM 0 HE2 HIS A 47 7.629 -7.791 -26.948 1.00 0.00 H new ATOM 792 N SER A 48 13.475 -6.589 -25.999 1.00 0.00 N ATOM 793 CA SER A 48 14.019 -6.659 -27.350 1.00 0.00 C ATOM 794 C SER A 48 14.691 -8.007 -27.596 1.00 0.00 C ATOM 795 O SER A 48 14.800 -8.461 -28.735 1.00 0.00 O ATOM 796 CB SER A 48 15.022 -5.527 -27.578 1.00 0.00 C ATOM 797 OG SER A 48 15.828 -5.781 -28.716 1.00 0.00 O ATOM 0 H SER A 48 14.054 -6.071 -25.338 1.00 0.00 H new ATOM 0 HA SER A 48 13.194 -6.550 -28.054 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.489 -4.585 -27.709 1.00 0.00 H new ATOM 0 HB3 SER A 48 15.655 -5.415 -26.698 1.00 0.00 H new ATOM 0 HG SER A 48 16.460 -5.042 -28.841 1.00 0.00 H new ATOM 803 N LYS A 49 15.141 -8.642 -26.519 1.00 0.00 N ATOM 804 CA LYS A 49 15.801 -9.938 -26.614 1.00 0.00 C ATOM 805 C LYS A 49 14.813 -11.072 -26.363 1.00 0.00 C ATOM 806 O LYS A 49 14.834 -12.092 -27.054 1.00 0.00 O ATOM 807 CB LYS A 49 16.955 -10.020 -25.612 1.00 0.00 C ATOM 808 CG LYS A 49 18.323 -9.826 -26.242 1.00 0.00 C ATOM 809 CD LYS A 49 18.716 -8.358 -26.280 1.00 0.00 C ATOM 810 CE LYS A 49 19.424 -7.937 -25.001 1.00 0.00 C ATOM 811 NZ LYS A 49 20.815 -8.465 -24.937 1.00 0.00 N ATOM 0 H LYS A 49 15.060 -8.279 -25.569 1.00 0.00 H new ATOM 0 HA LYS A 49 16.197 -10.043 -27.624 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.809 -9.264 -24.840 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.927 -10.991 -25.117 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.067 -10.388 -25.678 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.319 -10.229 -27.255 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.368 -8.177 -27.135 1.00 0.00 H new ATOM 0 HD3 LYS A 49 17.826 -7.746 -26.423 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.445 -6.849 -24.939 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.860 -8.294 -24.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.339 -7.973 -24.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 20.790 -9.484 -24.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.289 -8.307 -25.849 1.00 0.00 H new ATOM 825 N LEU A 50 13.949 -10.888 -25.371 1.00 0.00 N ATOM 826 CA LEU A 50 12.951 -11.896 -25.029 1.00 0.00 C ATOM 827 C LEU A 50 11.974 -12.108 -26.182 1.00 0.00 C ATOM 828 O LEU A 50 11.726 -13.240 -26.597 1.00 0.00 O ATOM 829 CB LEU A 50 12.189 -11.481 -23.770 1.00 0.00 C ATOM 830 CG LEU A 50 11.738 -12.619 -22.852 1.00 0.00 C ATOM 831 CD1 LEU A 50 11.530 -12.110 -21.434 1.00 0.00 C ATOM 832 CD2 LEU A 50 10.465 -13.260 -23.384 1.00 0.00 C ATOM 0 H LEU A 50 13.919 -10.051 -24.789 1.00 0.00 H new ATOM 0 HA LEU A 50 13.470 -12.836 -24.839 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.820 -10.805 -23.194 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.308 -10.915 -24.073 1.00 0.00 H new ATOM 0 HG LEU A 50 12.521 -13.377 -22.832 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.209 -12.933 -20.795 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.465 -11.699 -21.054 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.766 -11.333 -21.435 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.159 -14.067 -22.719 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.674 -12.511 -23.434 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.649 -13.661 -24.381 1.00 0.00 H new ATOM 844 N GLN A 51 11.425 -11.012 -26.695 1.00 0.00 N ATOM 845 CA GLN A 51 10.477 -11.078 -27.800 1.00 0.00 C ATOM 846 C GLN A 51 11.078 -11.822 -28.989 1.00 0.00 C ATOM 847 O GLN A 51 10.375 -12.529 -29.709 1.00 0.00 O ATOM 848 CB GLN A 51 10.056 -9.670 -28.224 1.00 0.00 C ATOM 849 CG GLN A 51 11.094 -8.954 -29.073 1.00 0.00 C ATOM 850 CD GLN A 51 10.954 -9.263 -30.550 1.00 0.00 C ATOM 851 OE1 GLN A 51 10.051 -9.991 -30.961 1.00 0.00 O ATOM 852 NE2 GLN A 51 11.850 -8.708 -31.358 1.00 0.00 N ATOM 0 H GLN A 51 11.621 -10.068 -26.363 1.00 0.00 H new ATOM 0 HA GLN A 51 9.598 -11.625 -27.459 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.122 -9.732 -28.783 1.00 0.00 H new ATOM 0 HB3 GLN A 51 9.856 -9.076 -27.332 1.00 0.00 H new ATOM 0 HG2 GLN A 51 11.003 -7.879 -28.921 1.00 0.00 H new ATOM 0 HG3 GLN A 51 12.091 -9.240 -28.739 1.00 0.00 H new ATOM 0 HE21 GLN A 51 12.582 -8.111 -30.974 1.00 0.00 H new ATOM 0 HE22 GLN A 51 11.806 -8.879 -32.363 1.00 0.00 H new ATOM 861 N GLU A 52 12.382 -11.655 -29.187 1.00 0.00 N ATOM 862 CA GLU A 52 13.076 -12.310 -30.289 1.00 0.00 C ATOM 863 C GLU A 52 13.670 -13.643 -29.843 1.00 0.00 C ATOM 864 O GLU A 52 14.249 -14.376 -30.645 1.00 0.00 O ATOM 865 CB GLU A 52 14.182 -11.404 -30.835 1.00 0.00 C ATOM 866 CG GLU A 52 15.307 -11.153 -29.845 1.00 0.00 C ATOM 867 CD GLU A 52 16.340 -10.175 -30.371 1.00 0.00 C ATOM 868 OE1 GLU A 52 16.050 -9.485 -31.370 1.00 0.00 O ATOM 869 OE2 GLU A 52 17.439 -10.100 -29.782 1.00 0.00 O ATOM 0 H GLU A 52 12.978 -11.072 -28.599 1.00 0.00 H new ATOM 0 HA GLU A 52 12.350 -12.502 -31.079 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.597 -11.854 -31.737 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.746 -10.448 -31.127 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.888 -10.768 -28.915 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.795 -12.098 -29.608 1.00 0.00 H new ATOM 876 N ALA A 53 13.521 -13.950 -28.559 1.00 0.00 N ATOM 877 CA ALA A 53 14.040 -15.195 -28.006 1.00 0.00 C ATOM 878 C ALA A 53 12.949 -16.258 -27.927 1.00 0.00 C ATOM 879 O ALA A 53 13.156 -17.406 -28.320 1.00 0.00 O ATOM 880 CB ALA A 53 14.642 -14.950 -26.630 1.00 0.00 C ATOM 0 H ALA A 53 13.045 -13.354 -27.882 1.00 0.00 H new ATOM 0 HA ALA A 53 14.821 -15.562 -28.672 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.026 -15.888 -26.229 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.456 -14.230 -26.712 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.876 -14.556 -25.962 1.00 0.00 H new ATOM 886 N THR A 54 11.786 -15.868 -27.415 1.00 0.00 N ATOM 887 CA THR A 54 10.663 -16.788 -27.282 1.00 0.00 C ATOM 888 C THR A 54 10.108 -17.178 -28.647 1.00 0.00 C ATOM 889 O THR A 54 10.454 -18.226 -29.191 1.00 0.00 O ATOM 890 CB THR A 54 9.531 -16.174 -26.437 1.00 0.00 C ATOM 891 OG1 THR A 54 9.168 -14.892 -26.961 1.00 0.00 O ATOM 892 CG2 THR A 54 9.957 -16.030 -24.984 1.00 0.00 C ATOM 0 H THR A 54 11.597 -14.921 -27.086 1.00 0.00 H new ATOM 0 HA THR A 54 11.041 -17.678 -26.778 1.00 0.00 H new ATOM 0 HB THR A 54 8.671 -16.842 -26.483 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.875 -14.244 -26.759 1.00 0.00 H new ATOM 0 HG21 THR A 54 9.141 -15.594 -24.407 1.00 0.00 H new ATOM 0 HG22 THR A 54 10.205 -17.011 -24.579 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.831 -15.381 -24.924 1.00 0.00 H new ATOM 900 N ASN A 55 9.246 -16.328 -29.195 1.00 0.00 N ATOM 901 CA ASN A 55 8.643 -16.585 -30.498 1.00 0.00 C ATOM 902 C ASN A 55 7.563 -15.553 -30.811 1.00 0.00 C ATOM 903 O ASN A 55 7.054 -14.880 -29.915 1.00 0.00 O ATOM 904 CB ASN A 55 8.045 -17.993 -30.538 1.00 0.00 C ATOM 905 CG ASN A 55 8.757 -18.896 -31.526 1.00 0.00 C ATOM 906 OD1 ASN A 55 9.466 -19.824 -31.136 1.00 0.00 O ATOM 907 ND2 ASN A 55 8.572 -18.627 -32.813 1.00 0.00 N ATOM 0 H ASN A 55 8.949 -15.456 -28.757 1.00 0.00 H new ATOM 0 HA ASN A 55 9.425 -16.508 -31.254 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.097 -18.435 -29.543 1.00 0.00 H new ATOM 0 HB3 ASN A 55 6.990 -17.929 -30.804 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.026 -19.200 -33.524 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.976 -17.847 -33.090 1.00 0.00 H new ATOM 914 N PHE A 56 7.219 -15.434 -32.089 1.00 0.00 N ATOM 915 CA PHE A 56 6.200 -14.485 -32.521 1.00 0.00 C ATOM 916 C PHE A 56 6.608 -13.055 -32.176 1.00 0.00 C ATOM 917 O PHE A 56 7.548 -12.817 -31.418 1.00 0.00 O ATOM 918 CB PHE A 56 4.856 -14.815 -31.870 1.00 0.00 C ATOM 919 CG PHE A 56 3.990 -15.714 -32.706 1.00 0.00 C ATOM 920 CD1 PHE A 56 3.829 -15.478 -34.062 1.00 0.00 C ATOM 921 CD2 PHE A 56 3.337 -16.795 -32.136 1.00 0.00 C ATOM 922 CE1 PHE A 56 3.032 -16.303 -34.832 1.00 0.00 C ATOM 923 CE2 PHE A 56 2.539 -17.624 -32.902 1.00 0.00 C ATOM 924 CZ PHE A 56 2.388 -17.378 -34.252 1.00 0.00 C ATOM 0 H PHE A 56 7.631 -15.983 -32.844 1.00 0.00 H new ATOM 0 HA PHE A 56 6.100 -14.565 -33.603 1.00 0.00 H new ATOM 0 HB2 PHE A 56 5.035 -15.290 -30.906 1.00 0.00 H new ATOM 0 HB3 PHE A 56 4.319 -13.887 -31.673 1.00 0.00 H new ATOM 0 HD1 PHE A 56 4.332 -14.640 -34.522 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.453 -16.992 -31.081 1.00 0.00 H new ATOM 0 HE1 PHE A 56 2.913 -16.107 -35.887 1.00 0.00 H new ATOM 0 HE2 PHE A 56 2.035 -18.463 -32.445 1.00 0.00 H new ATOM 0 HZ PHE A 56 1.767 -18.025 -34.854 1.00 0.00 H new ATOM 934 N PRO A 57 5.884 -12.080 -32.745 1.00 0.00 N ATOM 935 CA PRO A 57 6.151 -10.658 -32.512 1.00 0.00 C ATOM 936 C PRO A 57 5.797 -10.226 -31.093 1.00 0.00 C ATOM 937 O PRO A 57 5.087 -10.932 -30.377 1.00 0.00 O ATOM 938 CB PRO A 57 5.243 -9.956 -33.526 1.00 0.00 C ATOM 939 CG PRO A 57 4.137 -10.922 -33.777 1.00 0.00 C ATOM 940 CD PRO A 57 4.749 -12.291 -33.659 1.00 0.00 C ATOM 0 HA PRO A 57 7.208 -10.418 -32.627 1.00 0.00 H new ATOM 0 HB2 PRO A 57 4.863 -9.014 -33.131 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.781 -9.723 -34.445 1.00 0.00 H new ATOM 0 HG2 PRO A 57 3.332 -10.791 -33.054 1.00 0.00 H new ATOM 0 HG3 PRO A 57 3.704 -10.772 -34.766 1.00 0.00 H new ATOM 0 HD2 PRO A 57 4.040 -13.015 -33.258 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.078 -12.669 -34.627 1.00 0.00 H new ATOM 948 N LEU A 58 6.297 -9.062 -30.693 1.00 0.00 N ATOM 949 CA LEU A 58 6.033 -8.535 -29.358 1.00 0.00 C ATOM 950 C LEU A 58 4.676 -9.006 -28.845 1.00 0.00 C ATOM 951 O LEU A 58 3.677 -8.948 -29.561 1.00 0.00 O ATOM 952 CB LEU A 58 6.083 -7.006 -29.372 1.00 0.00 C ATOM 953 CG LEU A 58 4.733 -6.290 -29.336 1.00 0.00 C ATOM 954 CD1 LEU A 58 4.233 -6.167 -27.905 1.00 0.00 C ATOM 955 CD2 LEU A 58 4.839 -4.918 -29.985 1.00 0.00 C ATOM 0 H LEU A 58 6.887 -8.465 -31.273 1.00 0.00 H new ATOM 0 HA LEU A 58 6.805 -8.911 -28.687 1.00 0.00 H new ATOM 0 HB2 LEU A 58 6.671 -6.674 -28.516 1.00 0.00 H new ATOM 0 HB3 LEU A 58 6.616 -6.688 -30.268 1.00 0.00 H new ATOM 0 HG LEU A 58 4.014 -6.883 -29.902 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.271 -5.655 -27.899 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.118 -7.161 -27.473 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.952 -5.597 -27.316 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.868 -4.423 -29.950 1.00 0.00 H new ATOM 0 HD22 LEU A 58 5.572 -4.317 -29.447 1.00 0.00 H new ATOM 0 HD23 LEU A 58 5.152 -5.030 -31.023 1.00 0.00 H new ATOM 967 N ARG A 59 4.649 -9.469 -27.599 1.00 0.00 N ATOM 968 CA ARG A 59 3.414 -9.949 -26.990 1.00 0.00 C ATOM 969 C ARG A 59 2.745 -8.845 -26.177 1.00 0.00 C ATOM 970 O ARG A 59 3.373 -7.862 -25.782 1.00 0.00 O ATOM 971 CB ARG A 59 3.698 -11.156 -26.094 1.00 0.00 C ATOM 972 CG ARG A 59 4.961 -11.013 -25.261 1.00 0.00 C ATOM 973 CD ARG A 59 4.721 -11.410 -23.813 1.00 0.00 C ATOM 974 NE ARG A 59 5.829 -12.190 -23.269 1.00 0.00 N ATOM 975 CZ ARG A 59 5.884 -12.610 -22.010 1.00 0.00 C ATOM 976 NH1 ARG A 59 4.898 -12.326 -21.170 1.00 0.00 N ATOM 977 NH2 ARG A 59 6.926 -13.315 -21.589 1.00 0.00 N ATOM 0 H ARG A 59 5.467 -9.522 -26.992 1.00 0.00 H new ATOM 0 HA ARG A 59 2.737 -10.250 -27.789 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.849 -11.311 -25.428 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.782 -12.047 -26.716 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.750 -11.635 -25.684 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.311 -9.982 -25.303 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.578 -10.513 -23.210 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.801 -11.990 -23.744 1.00 0.00 H new ATOM 0 HE ARG A 59 6.603 -12.425 -23.890 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.095 -11.784 -21.490 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.942 -12.649 -20.204 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.686 -13.535 -22.232 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.967 -13.637 -20.622 1.00 0.00 H new ATOM 991 N PRO A 60 1.438 -9.008 -25.920 1.00 0.00 N ATOM 992 CA PRO A 60 0.655 -8.036 -25.151 1.00 0.00 C ATOM 993 C PRO A 60 1.043 -8.014 -23.677 1.00 0.00 C ATOM 994 O PRO A 60 1.443 -9.034 -23.115 1.00 0.00 O ATOM 995 CB PRO A 60 -0.784 -8.528 -25.319 1.00 0.00 C ATOM 996 CG PRO A 60 -0.656 -9.987 -25.590 1.00 0.00 C ATOM 997 CD PRO A 60 0.625 -10.155 -26.359 1.00 0.00 C ATOM 0 HA PRO A 60 0.815 -7.016 -25.501 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.373 -8.342 -24.421 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -1.284 -8.015 -26.140 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -0.630 -10.556 -24.660 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -1.507 -10.353 -26.164 1.00 0.00 H new ATOM 0 HD2 PRO A 60 1.111 -11.103 -26.129 1.00 0.00 H new ATOM 0 HD3 PRO A 60 0.453 -10.138 -27.435 1.00 0.00 H new ATOM 1005 N PHE A 61 0.922 -6.846 -23.055 1.00 0.00 N ATOM 1006 CA PHE A 61 1.260 -6.693 -21.645 1.00 0.00 C ATOM 1007 C PHE A 61 2.641 -7.272 -21.350 1.00 0.00 C ATOM 1008 O PHE A 61 2.864 -7.869 -20.297 1.00 0.00 O ATOM 1009 CB PHE A 61 0.210 -7.378 -20.769 1.00 0.00 C ATOM 1010 CG PHE A 61 -1.185 -7.279 -21.317 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -1.800 -6.047 -21.467 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -1.881 -8.420 -21.685 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -3.083 -5.954 -21.971 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -3.165 -8.333 -22.190 1.00 0.00 C ATOM 1015 CZ PHE A 61 -3.766 -7.098 -22.334 1.00 0.00 C ATOM 0 H PHE A 61 0.593 -5.992 -23.505 1.00 0.00 H new ATOM 0 HA PHE A 61 1.275 -5.628 -21.415 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.473 -8.430 -20.655 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.233 -6.934 -19.774 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -1.270 -5.149 -21.187 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.415 -9.388 -21.576 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.552 -4.987 -22.081 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.697 -9.230 -22.471 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.768 -7.027 -22.730 1.00 0.00 H new ATOM 1025 N VAL A 62 3.564 -7.093 -22.290 1.00 0.00 N ATOM 1026 CA VAL A 62 4.923 -7.597 -22.132 1.00 0.00 C ATOM 1027 C VAL A 62 5.846 -6.522 -21.568 1.00 0.00 C ATOM 1028 O VAL A 62 6.704 -6.803 -20.731 1.00 0.00 O ATOM 1029 CB VAL A 62 5.495 -8.098 -23.472 1.00 0.00 C ATOM 1030 CG1 VAL A 62 5.854 -6.925 -24.371 1.00 0.00 C ATOM 1031 CG2 VAL A 62 6.705 -8.988 -23.234 1.00 0.00 C ATOM 0 H VAL A 62 3.395 -6.603 -23.168 1.00 0.00 H new ATOM 0 HA VAL A 62 4.872 -8.431 -21.432 1.00 0.00 H new ATOM 0 HB VAL A 62 4.731 -8.690 -23.976 1.00 0.00 H new ATOM 0 HG11 VAL A 62 6.256 -7.298 -25.313 1.00 0.00 H new ATOM 0 HG12 VAL A 62 4.962 -6.331 -24.568 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.602 -6.304 -23.878 1.00 0.00 H new ATOM 0 HG21 VAL A 62 7.097 -9.333 -24.191 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.475 -8.422 -22.709 1.00 0.00 H new ATOM 0 HG23 VAL A 62 6.412 -9.847 -22.631 1.00 0.00 H new ATOM 1041 N ILE A 63 5.664 -5.290 -22.032 1.00 0.00 N ATOM 1042 CA ILE A 63 6.479 -4.173 -21.573 1.00 0.00 C ATOM 1043 C ILE A 63 6.015 -3.679 -20.207 1.00 0.00 C ATOM 1044 O ILE A 63 6.802 -3.536 -19.271 1.00 0.00 O ATOM 1045 CB ILE A 63 6.440 -3.000 -22.571 1.00 0.00 C ATOM 1046 CG1 ILE A 63 7.335 -3.297 -23.775 1.00 0.00 C ATOM 1047 CG2 ILE A 63 6.871 -1.710 -21.888 1.00 0.00 C ATOM 1048 CD1 ILE A 63 8.794 -3.471 -23.415 1.00 0.00 C ATOM 0 H ILE A 63 4.959 -5.041 -22.726 1.00 0.00 H new ATOM 0 HA ILE A 63 7.502 -4.540 -21.496 1.00 0.00 H new ATOM 0 HB ILE A 63 5.417 -2.876 -22.925 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.980 -4.203 -24.267 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.241 -2.485 -24.496 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.839 -0.890 -22.605 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.197 -1.494 -21.059 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.887 -1.821 -21.509 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.369 -3.679 -24.317 1.00 0.00 H new ATOM 0 HD12 ILE A 63 9.166 -2.558 -22.950 1.00 0.00 H new ATOM 0 HD13 ILE A 63 8.900 -4.302 -22.718 1.00 0.00 H new ATOM 1060 N PRO A 64 4.706 -3.414 -20.087 1.00 0.00 N ATOM 1061 CA PRO A 64 4.107 -2.934 -18.838 1.00 0.00 C ATOM 1062 C PRO A 64 4.089 -4.007 -17.754 1.00 0.00 C ATOM 1063 O PRO A 64 3.751 -3.734 -16.602 1.00 0.00 O ATOM 1064 CB PRO A 64 2.679 -2.564 -19.248 1.00 0.00 C ATOM 1065 CG PRO A 64 2.398 -3.409 -20.442 1.00 0.00 C ATOM 1066 CD PRO A 64 3.710 -3.562 -21.161 1.00 0.00 C ATOM 0 HA PRO A 64 4.670 -2.105 -18.408 1.00 0.00 H new ATOM 0 HB2 PRO A 64 1.971 -2.766 -18.444 1.00 0.00 H new ATOM 0 HB3 PRO A 64 2.597 -1.503 -19.485 1.00 0.00 H new ATOM 0 HG2 PRO A 64 1.999 -4.380 -20.148 1.00 0.00 H new ATOM 0 HG3 PRO A 64 1.653 -2.940 -21.085 1.00 0.00 H new ATOM 0 HD2 PRO A 64 3.789 -4.532 -21.651 1.00 0.00 H new ATOM 0 HD3 PRO A 64 3.836 -2.803 -21.933 1.00 0.00 H new ATOM 1074 N PHE A 65 4.454 -5.228 -18.131 1.00 0.00 N ATOM 1075 CA PHE A 65 4.479 -6.343 -17.191 1.00 0.00 C ATOM 1076 C PHE A 65 5.581 -6.154 -16.153 1.00 0.00 C ATOM 1077 O PHE A 65 5.307 -5.928 -14.973 1.00 0.00 O ATOM 1078 CB PHE A 65 4.686 -7.662 -17.937 1.00 0.00 C ATOM 1079 CG PHE A 65 3.625 -8.686 -17.651 1.00 0.00 C ATOM 1080 CD1 PHE A 65 2.294 -8.313 -17.547 1.00 0.00 C ATOM 1081 CD2 PHE A 65 3.957 -10.021 -17.486 1.00 0.00 C ATOM 1082 CE1 PHE A 65 1.316 -9.253 -17.283 1.00 0.00 C ATOM 1083 CE2 PHE A 65 2.983 -10.965 -17.223 1.00 0.00 C ATOM 1084 CZ PHE A 65 1.661 -10.581 -17.122 1.00 0.00 C ATOM 0 H PHE A 65 4.736 -5.471 -19.081 1.00 0.00 H new ATOM 0 HA PHE A 65 3.519 -6.373 -16.675 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.709 -7.464 -19.009 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.659 -8.074 -17.668 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.018 -7.276 -17.674 1.00 0.00 H new ATOM 0 HD2 PHE A 65 4.990 -10.327 -17.564 1.00 0.00 H new ATOM 0 HE1 PHE A 65 0.283 -8.950 -17.203 1.00 0.00 H new ATOM 0 HE2 PHE A 65 3.256 -12.002 -17.097 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.898 -11.317 -16.918 1.00 0.00 H new ATOM 1094 N LEU A 66 6.829 -6.248 -16.600 1.00 0.00 N ATOM 1095 CA LEU A 66 7.974 -6.088 -15.710 1.00 0.00 C ATOM 1096 C LEU A 66 8.181 -4.621 -15.348 1.00 0.00 C ATOM 1097 O LEU A 66 8.853 -4.301 -14.367 1.00 0.00 O ATOM 1098 CB LEU A 66 9.237 -6.646 -16.368 1.00 0.00 C ATOM 1099 CG LEU A 66 9.972 -7.738 -15.591 1.00 0.00 C ATOM 1100 CD1 LEU A 66 10.920 -8.498 -16.506 1.00 0.00 C ATOM 1101 CD2 LEU A 66 10.729 -7.139 -14.415 1.00 0.00 C ATOM 0 H LEU A 66 7.073 -6.434 -17.573 1.00 0.00 H new ATOM 0 HA LEU A 66 7.772 -6.644 -14.794 1.00 0.00 H new ATOM 0 HB2 LEU A 66 8.968 -7.043 -17.347 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.929 -5.821 -16.538 1.00 0.00 H new ATOM 0 HG LEU A 66 9.234 -8.440 -15.202 1.00 0.00 H new ATOM 0 HD11 LEU A 66 11.434 -9.271 -15.936 1.00 0.00 H new ATOM 0 HD12 LEU A 66 10.353 -8.960 -17.314 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.653 -7.808 -16.925 1.00 0.00 H new ATOM 0 HD21 LEU A 66 11.246 -7.931 -13.874 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.457 -6.415 -14.782 1.00 0.00 H new ATOM 0 HD23 LEU A 66 10.027 -6.641 -13.746 1.00 0.00 H new ATOM 1113 N LYS A 67 7.598 -3.732 -16.144 1.00 0.00 N ATOM 1114 CA LYS A 67 7.715 -2.298 -15.907 1.00 0.00 C ATOM 1115 C LYS A 67 7.341 -1.952 -14.469 1.00 0.00 C ATOM 1116 O LYS A 67 7.984 -1.117 -13.834 1.00 0.00 O ATOM 1117 CB LYS A 67 6.820 -1.524 -16.878 1.00 0.00 C ATOM 1118 CG LYS A 67 7.561 -0.982 -18.087 1.00 0.00 C ATOM 1119 CD LYS A 67 8.591 0.062 -17.689 1.00 0.00 C ATOM 1120 CE LYS A 67 8.008 1.466 -17.737 1.00 0.00 C ATOM 1121 NZ LYS A 67 9.026 2.500 -17.402 1.00 0.00 N ATOM 0 H LYS A 67 7.039 -3.980 -16.960 1.00 0.00 H new ATOM 0 HA LYS A 67 8.753 -2.012 -16.073 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.016 -2.177 -17.218 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.353 -0.695 -16.346 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.055 -1.801 -18.609 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.848 -0.543 -18.785 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.954 -0.148 -16.683 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.450 0.000 -18.357 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.608 1.659 -18.732 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.174 1.537 -17.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.590 3.443 -17.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.390 2.331 -16.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.810 2.449 -18.084 1.00 0.00 H new ATOM 1135 N ALA A 68 6.299 -2.602 -13.961 1.00 0.00 N ATOM 1136 CA ALA A 68 5.842 -2.366 -12.597 1.00 0.00 C ATOM 1137 C ALA A 68 6.204 -3.535 -11.687 1.00 0.00 C ATOM 1138 O ALA A 68 5.760 -3.602 -10.541 1.00 0.00 O ATOM 1139 CB ALA A 68 4.340 -2.124 -12.578 1.00 0.00 C ATOM 0 H ALA A 68 5.755 -3.296 -14.474 1.00 0.00 H new ATOM 0 HA ALA A 68 6.346 -1.477 -12.220 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.013 -1.949 -11.553 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.104 -1.252 -13.188 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.826 -2.997 -12.979 1.00 0.00 H new ATOM 1145 N ASN A 69 7.012 -4.454 -12.205 1.00 0.00 N ATOM 1146 CA ASN A 69 7.432 -5.621 -11.438 1.00 0.00 C ATOM 1147 C ASN A 69 8.937 -5.597 -11.191 1.00 0.00 C ATOM 1148 O ASN A 69 9.469 -6.421 -10.446 1.00 0.00 O ATOM 1149 CB ASN A 69 7.045 -6.906 -12.174 1.00 0.00 C ATOM 1150 CG ASN A 69 5.954 -7.677 -11.457 1.00 0.00 C ATOM 1151 OD1 ASN A 69 6.216 -8.692 -10.812 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.721 -7.195 -11.566 1.00 0.00 N ATOM 0 H ASN A 69 7.389 -4.413 -13.152 1.00 0.00 H new ATOM 0 HA ASN A 69 6.923 -5.594 -10.474 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.709 -6.658 -13.181 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.925 -7.540 -12.279 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.945 -7.670 -11.104 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.550 -6.350 -12.111 1.00 0.00 H new ATOM 1159 N LEU A 70 9.619 -4.646 -11.820 1.00 0.00 N ATOM 1160 CA LEU A 70 11.064 -4.513 -11.669 1.00 0.00 C ATOM 1161 C LEU A 70 11.464 -4.561 -10.197 1.00 0.00 C ATOM 1162 O LEU A 70 12.314 -5.350 -9.785 1.00 0.00 O ATOM 1163 CB LEU A 70 11.544 -3.204 -12.297 1.00 0.00 C ATOM 1164 CG LEU A 70 12.851 -3.279 -13.088 1.00 0.00 C ATOM 1165 CD1 LEU A 70 14.009 -3.640 -12.171 1.00 0.00 C ATOM 1166 CD2 LEU A 70 12.731 -4.286 -14.222 1.00 0.00 C ATOM 0 H LEU A 70 9.195 -3.956 -12.439 1.00 0.00 H new ATOM 0 HA LEU A 70 11.537 -5.350 -12.183 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.762 -2.834 -12.960 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.664 -2.466 -11.504 1.00 0.00 H new ATOM 0 HG LEU A 70 13.049 -2.298 -13.520 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.931 -3.689 -12.751 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.108 -2.881 -11.395 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.819 -4.609 -11.709 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.670 -4.326 -14.774 1.00 0.00 H new ATOM 0 HD22 LEU A 70 12.509 -5.271 -13.812 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.928 -3.983 -14.894 1.00 0.00 H new ATOM 1178 N PRO A 71 10.835 -3.698 -9.385 1.00 0.00 N ATOM 1179 CA PRO A 71 11.107 -3.624 -7.946 1.00 0.00 C ATOM 1180 C PRO A 71 10.600 -4.851 -7.197 1.00 0.00 C ATOM 1181 O PRO A 71 10.984 -5.095 -6.052 1.00 0.00 O ATOM 1182 CB PRO A 71 10.342 -2.374 -7.505 1.00 0.00 C ATOM 1183 CG PRO A 71 9.250 -2.224 -8.507 1.00 0.00 C ATOM 1184 CD PRO A 71 9.810 -2.729 -9.808 1.00 0.00 C ATOM 0 HA PRO A 71 12.175 -3.583 -7.734 1.00 0.00 H new ATOM 0 HB2 PRO A 71 9.942 -2.490 -6.498 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.990 -1.498 -7.492 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.369 -2.795 -8.213 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.940 -1.183 -8.594 1.00 0.00 H new ATOM 0 HD2 PRO A 71 9.041 -3.199 -10.421 1.00 0.00 H new ATOM 0 HD3 PRO A 71 10.240 -1.922 -10.401 1.00 0.00 H new ATOM 1192 N LEU A 72 9.736 -5.622 -7.849 1.00 0.00 N ATOM 1193 CA LEU A 72 9.177 -6.826 -7.244 1.00 0.00 C ATOM 1194 C LEU A 72 10.007 -8.053 -7.604 1.00 0.00 C ATOM 1195 O LEU A 72 9.957 -9.074 -6.917 1.00 0.00 O ATOM 1196 CB LEU A 72 7.730 -7.023 -7.698 1.00 0.00 C ATOM 1197 CG LEU A 72 6.662 -6.310 -6.869 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.850 -6.606 -5.389 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.702 -4.810 -7.124 1.00 0.00 C ATOM 0 H LEU A 72 9.408 -5.435 -8.796 1.00 0.00 H new ATOM 0 HA LEU A 72 9.198 -6.702 -6.161 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.645 -6.685 -8.731 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.511 -8.091 -7.694 1.00 0.00 H new ATOM 0 HG LEU A 72 5.684 -6.684 -7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.081 -6.090 -4.814 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.771 -7.680 -5.220 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.834 -6.260 -5.071 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.935 -4.319 -6.526 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.682 -4.420 -6.849 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.518 -4.616 -8.181 1.00 0.00 H new ATOM 1211 N LEU A 73 10.772 -7.946 -8.685 1.00 0.00 N ATOM 1212 CA LEU A 73 11.617 -9.047 -9.136 1.00 0.00 C ATOM 1213 C LEU A 73 12.962 -9.032 -8.417 1.00 0.00 C ATOM 1214 O LEU A 73 13.531 -10.083 -8.125 1.00 0.00 O ATOM 1215 CB LEU A 73 11.833 -8.963 -10.648 1.00 0.00 C ATOM 1216 CG LEU A 73 11.561 -10.244 -11.437 1.00 0.00 C ATOM 1217 CD1 LEU A 73 10.177 -10.786 -11.115 1.00 0.00 C ATOM 1218 CD2 LEU A 73 11.701 -9.991 -12.931 1.00 0.00 C ATOM 0 H LEU A 73 10.825 -7.109 -9.265 1.00 0.00 H new ATOM 0 HA LEU A 73 11.110 -9.982 -8.899 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.193 -8.174 -11.043 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.864 -8.659 -10.831 1.00 0.00 H new ATOM 0 HG LEU A 73 12.299 -10.991 -11.144 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.001 -11.698 -11.686 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.111 -11.007 -10.050 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.425 -10.042 -11.378 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.504 -10.914 -13.476 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.987 -9.228 -13.239 1.00 0.00 H new ATOM 0 HD23 LEU A 73 12.713 -9.650 -13.149 1.00 0.00 H new ATOM 1230 N GLN A 74 13.462 -7.834 -8.133 1.00 0.00 N ATOM 1231 CA GLN A 74 14.739 -7.683 -7.447 1.00 0.00 C ATOM 1232 C GLN A 74 14.643 -8.169 -6.004 1.00 0.00 C ATOM 1233 O GLN A 74 15.644 -8.225 -5.290 1.00 0.00 O ATOM 1234 CB GLN A 74 15.188 -6.220 -7.475 1.00 0.00 C ATOM 1235 CG GLN A 74 14.079 -5.237 -7.136 1.00 0.00 C ATOM 1236 CD GLN A 74 14.389 -4.411 -5.903 1.00 0.00 C ATOM 1237 OE1 GLN A 74 13.554 -4.273 -5.008 1.00 0.00 O ATOM 1238 NE2 GLN A 74 15.595 -3.857 -5.849 1.00 0.00 N ATOM 0 H GLN A 74 13.002 -6.954 -8.367 1.00 0.00 H new ATOM 0 HA GLN A 74 15.477 -8.293 -7.969 1.00 0.00 H new ATOM 0 HB2 GLN A 74 16.008 -6.087 -6.770 1.00 0.00 H new ATOM 0 HB3 GLN A 74 15.578 -5.987 -8.466 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.917 -4.571 -7.984 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.149 -5.784 -6.978 1.00 0.00 H new ATOM 0 HE21 GLN A 74 16.256 -3.998 -6.613 1.00 0.00 H new ATOM 0 HE22 GLN A 74 15.861 -3.291 -5.043 1.00 0.00 H new ATOM 1247 N ARG A 75 13.432 -8.520 -5.583 1.00 0.00 N ATOM 1248 CA ARG A 75 13.205 -9.000 -4.225 1.00 0.00 C ATOM 1249 C ARG A 75 13.405 -10.510 -4.142 1.00 0.00 C ATOM 1250 O ARG A 75 14.086 -11.007 -3.245 1.00 0.00 O ATOM 1251 CB ARG A 75 11.793 -8.635 -3.762 1.00 0.00 C ATOM 1252 CG ARG A 75 11.308 -7.293 -4.285 1.00 0.00 C ATOM 1253 CD ARG A 75 11.710 -6.155 -3.360 1.00 0.00 C ATOM 1254 NE ARG A 75 13.141 -6.166 -3.069 1.00 0.00 N ATOM 1255 CZ ARG A 75 13.674 -5.623 -1.979 1.00 0.00 C ATOM 1256 NH1 ARG A 75 12.897 -5.031 -1.083 1.00 0.00 N ATOM 1257 NH2 ARG A 75 14.985 -5.673 -1.785 1.00 0.00 N ATOM 0 H ARG A 75 12.593 -8.481 -6.162 1.00 0.00 H new ATOM 0 HA ARG A 75 13.931 -8.518 -3.570 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.101 -9.413 -4.086 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.769 -8.621 -2.672 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.720 -7.118 -5.279 1.00 0.00 H new ATOM 0 HG3 ARG A 75 10.223 -7.313 -4.389 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.440 -5.203 -3.818 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.150 -6.230 -2.428 1.00 0.00 H new ATOM 0 HE ARG A 75 13.766 -6.615 -3.739 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.888 -4.992 -1.229 1.00 0.00 H new ATOM 0 HH12 ARG A 75 13.308 -4.615 -0.247 1.00 0.00 H new ATOM 0 HH21 ARG A 75 15.585 -6.128 -2.473 1.00 0.00 H new ATOM 0 HH22 ARG A 75 15.393 -5.256 -0.948 1.00 0.00 H new ATOM 1271 N GLU A 76 12.806 -11.234 -5.083 1.00 0.00 N ATOM 1272 CA GLU A 76 12.918 -12.687 -5.114 1.00 0.00 C ATOM 1273 C GLU A 76 14.370 -13.118 -5.302 1.00 0.00 C ATOM 1274 O GLU A 76 14.733 -14.259 -5.013 1.00 0.00 O ATOM 1275 CB GLU A 76 12.054 -13.263 -6.238 1.00 0.00 C ATOM 1276 CG GLU A 76 12.719 -13.212 -7.604 1.00 0.00 C ATOM 1277 CD GLU A 76 13.589 -14.424 -7.874 1.00 0.00 C ATOM 1278 OE1 GLU A 76 13.531 -15.387 -7.081 1.00 0.00 O ATOM 1279 OE2 GLU A 76 14.328 -14.410 -8.881 1.00 0.00 O ATOM 0 H GLU A 76 12.239 -10.838 -5.833 1.00 0.00 H new ATOM 0 HA GLU A 76 12.564 -13.073 -4.158 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.808 -14.298 -6.002 1.00 0.00 H new ATOM 0 HB3 GLU A 76 11.114 -12.713 -6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.952 -13.141 -8.375 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.327 -12.310 -7.675 1.00 0.00 H new ATOM 1286 N LEU A 77 15.195 -12.197 -5.787 1.00 0.00 N ATOM 1287 CA LEU A 77 16.608 -12.480 -6.014 1.00 0.00 C ATOM 1288 C LEU A 77 17.288 -12.929 -4.725 1.00 0.00 C ATOM 1289 O LEU A 77 18.309 -13.616 -4.755 1.00 0.00 O ATOM 1290 CB LEU A 77 17.313 -11.242 -6.572 1.00 0.00 C ATOM 1291 CG LEU A 77 17.981 -11.408 -7.938 1.00 0.00 C ATOM 1292 CD1 LEU A 77 19.170 -12.351 -7.839 1.00 0.00 C ATOM 1293 CD2 LEU A 77 16.978 -11.917 -8.963 1.00 0.00 C ATOM 0 H LEU A 77 14.910 -11.248 -6.031 1.00 0.00 H new ATOM 0 HA LEU A 77 16.679 -13.289 -6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.584 -10.434 -6.642 1.00 0.00 H new ATOM 0 HB3 LEU A 77 18.071 -10.926 -5.855 1.00 0.00 H new ATOM 0 HG LEU A 77 18.343 -10.433 -8.266 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.633 -12.457 -8.820 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.898 -11.946 -7.136 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.832 -13.327 -7.490 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.470 -12.029 -9.929 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.586 -12.882 -8.641 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.158 -11.205 -9.054 1.00 0.00 H new ATOM 1305 N LEU A 78 16.714 -12.537 -3.593 1.00 0.00 N ATOM 1306 CA LEU A 78 17.263 -12.900 -2.291 1.00 0.00 C ATOM 1307 C LEU A 78 16.903 -14.338 -1.930 1.00 0.00 C ATOM 1308 O LEU A 78 17.508 -14.936 -1.040 1.00 0.00 O ATOM 1309 CB LEU A 78 16.745 -11.947 -1.213 1.00 0.00 C ATOM 1310 CG LEU A 78 17.669 -10.786 -0.843 1.00 0.00 C ATOM 1311 CD1 LEU A 78 18.893 -11.295 -0.097 1.00 0.00 C ATOM 1312 CD2 LEU A 78 18.083 -10.016 -2.088 1.00 0.00 C ATOM 0 H LEU A 78 15.869 -11.968 -3.550 1.00 0.00 H new ATOM 0 HA LEU A 78 18.349 -12.820 -2.347 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.793 -11.535 -1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 78 16.543 -12.526 -0.312 1.00 0.00 H new ATOM 0 HG LEU A 78 17.124 -10.108 -0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 78 19.539 -10.455 0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 78 18.578 -11.801 0.816 1.00 0.00 H new ATOM 0 HD13 LEU A 78 19.440 -11.994 -0.730 1.00 0.00 H new ATOM 0 HD21 LEU A 78 18.740 -9.194 -1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 78 18.610 -10.683 -2.770 1.00 0.00 H new ATOM 0 HD23 LEU A 78 17.196 -9.619 -2.582 1.00 0.00 H new ATOM 1324 N HIS A 79 15.915 -14.889 -2.629 1.00 0.00 N ATOM 1325 CA HIS A 79 15.477 -16.258 -2.384 1.00 0.00 C ATOM 1326 C HIS A 79 16.266 -17.243 -3.241 1.00 0.00 C ATOM 1327 O HIS A 79 16.647 -18.317 -2.777 1.00 0.00 O ATOM 1328 CB HIS A 79 13.982 -16.396 -2.674 1.00 0.00 C ATOM 1329 CG HIS A 79 13.492 -17.811 -2.631 1.00 0.00 C ATOM 1330 ND1 HIS A 79 13.480 -18.569 -1.479 1.00 0.00 N ATOM 1331 CD2 HIS A 79 12.993 -18.605 -3.607 1.00 0.00 C ATOM 1332 CE1 HIS A 79 12.997 -19.768 -1.749 1.00 0.00 C ATOM 1333 NE2 HIS A 79 12.693 -19.816 -3.033 1.00 0.00 N ATOM 0 H HIS A 79 15.403 -14.408 -3.369 1.00 0.00 H new ATOM 0 HA HIS A 79 15.660 -16.490 -1.335 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.423 -15.804 -1.949 1.00 0.00 H new ATOM 0 HB3 HIS A 79 13.771 -15.977 -3.658 1.00 0.00 H new ATOM 0 HD2 HIS A 79 12.856 -18.336 -4.644 1.00 0.00 H new ATOM 0 HE1 HIS A 79 12.872 -20.573 -1.040 1.00 0.00 H new ATOM 0 HE2 HIS A 79 12.299 -20.621 -3.519 1.00 0.00 H new ATOM 1341 N ALA A 80 16.508 -16.869 -4.493 1.00 0.00 N ATOM 1342 CA ALA A 80 17.253 -17.718 -5.414 1.00 0.00 C ATOM 1343 C ALA A 80 18.569 -18.177 -4.795 1.00 0.00 C ATOM 1344 O ALA A 80 18.978 -19.326 -4.963 1.00 0.00 O ATOM 1345 CB ALA A 80 17.511 -16.982 -6.721 1.00 0.00 C ATOM 0 H ALA A 80 16.199 -15.983 -4.893 1.00 0.00 H new ATOM 0 HA ALA A 80 16.650 -18.602 -5.621 1.00 0.00 H new ATOM 0 HB1 ALA A 80 18.068 -17.629 -7.399 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.560 -16.710 -7.179 1.00 0.00 H new ATOM 0 HB3 ALA A 80 18.090 -16.080 -6.522 1.00 0.00 H new ATOM 1351 N ALA A 81 19.228 -17.272 -4.080 1.00 0.00 N ATOM 1352 CA ALA A 81 20.498 -17.585 -3.434 1.00 0.00 C ATOM 1353 C ALA A 81 20.323 -18.668 -2.376 1.00 0.00 C ATOM 1354 O ALA A 81 21.125 -19.598 -2.287 1.00 0.00 O ATOM 1355 CB ALA A 81 21.098 -16.331 -2.815 1.00 0.00 C ATOM 0 H ALA A 81 18.904 -16.316 -3.933 1.00 0.00 H new ATOM 0 HA ALA A 81 21.181 -17.964 -4.194 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.045 -16.579 -2.336 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.268 -15.587 -3.593 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.411 -15.928 -2.072 1.00 0.00 H new ATOM 1361 N ARG A 82 19.270 -18.541 -1.574 1.00 0.00 N ATOM 1362 CA ARG A 82 18.992 -19.509 -0.520 1.00 0.00 C ATOM 1363 C ARG A 82 18.914 -20.923 -1.087 1.00 0.00 C ATOM 1364 O ARG A 82 19.358 -21.883 -0.456 1.00 0.00 O ATOM 1365 CB ARG A 82 17.683 -19.160 0.190 1.00 0.00 C ATOM 1366 CG ARG A 82 17.654 -17.749 0.755 1.00 0.00 C ATOM 1367 CD ARG A 82 18.672 -17.576 1.871 1.00 0.00 C ATOM 1368 NE ARG A 82 18.710 -16.203 2.370 1.00 0.00 N ATOM 1369 CZ ARG A 82 19.584 -15.773 3.273 1.00 0.00 C ATOM 1370 NH1 ARG A 82 20.488 -16.604 3.774 1.00 0.00 N ATOM 1371 NH2 ARG A 82 19.555 -14.509 3.677 1.00 0.00 N ATOM 0 H ARG A 82 18.596 -17.778 -1.634 1.00 0.00 H new ATOM 0 HA ARG A 82 19.810 -19.469 0.200 1.00 0.00 H new ATOM 0 HB2 ARG A 82 16.857 -19.279 -0.511 1.00 0.00 H new ATOM 0 HB3 ARG A 82 17.518 -19.870 1.000 1.00 0.00 H new ATOM 0 HG2 ARG A 82 17.859 -17.033 -0.041 1.00 0.00 H new ATOM 0 HG3 ARG A 82 16.656 -17.528 1.134 1.00 0.00 H new ATOM 0 HD2 ARG A 82 18.430 -18.253 2.690 1.00 0.00 H new ATOM 0 HD3 ARG A 82 19.660 -17.857 1.507 1.00 0.00 H new ATOM 0 HE ARG A 82 18.028 -15.538 2.005 1.00 0.00 H new ATOM 0 HH11 ARG A 82 20.513 -17.576 3.466 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.158 -16.271 4.467 1.00 0.00 H new ATOM 0 HH21 ARG A 82 18.861 -13.867 3.294 1.00 0.00 H new ATOM 0 HH22 ARG A 82 20.227 -14.180 4.371 1.00 0.00 H new ATOM 1385 N LEU A 83 18.345 -21.045 -2.282 1.00 0.00 N ATOM 1386 CA LEU A 83 18.208 -22.343 -2.935 1.00 0.00 C ATOM 1387 C LEU A 83 19.334 -22.569 -3.938 1.00 0.00 C ATOM 1388 O LEU A 83 19.334 -23.555 -4.674 1.00 0.00 O ATOM 1389 CB LEU A 83 16.854 -22.440 -3.640 1.00 0.00 C ATOM 1390 CG LEU A 83 16.390 -23.849 -4.010 1.00 0.00 C ATOM 1391 CD1 LEU A 83 15.716 -24.519 -2.823 1.00 0.00 C ATOM 1392 CD2 LEU A 83 15.447 -23.803 -5.204 1.00 0.00 C ATOM 0 H LEU A 83 17.971 -20.262 -2.818 1.00 0.00 H new ATOM 0 HA LEU A 83 18.268 -23.116 -2.169 1.00 0.00 H new ATOM 0 HB2 LEU A 83 16.099 -21.987 -2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 83 16.897 -21.842 -4.551 1.00 0.00 H new ATOM 0 HG LEU A 83 17.265 -24.438 -4.285 1.00 0.00 H new ATOM 0 HD11 LEU A 83 15.393 -25.521 -3.106 1.00 0.00 H new ATOM 0 HD12 LEU A 83 16.421 -24.586 -1.994 1.00 0.00 H new ATOM 0 HD13 LEU A 83 14.851 -23.931 -2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 83 15.127 -24.814 -5.454 1.00 0.00 H new ATOM 0 HD22 LEU A 83 14.576 -23.197 -4.956 1.00 0.00 H new ATOM 0 HD23 LEU A 83 15.963 -23.365 -6.058 1.00 0.00 H new ATOM 1404 N ALA A 84 20.294 -21.650 -3.960 1.00 0.00 N ATOM 1405 CA ALA A 84 21.428 -21.751 -4.870 1.00 0.00 C ATOM 1406 C ALA A 84 22.735 -21.917 -4.102 1.00 0.00 C ATOM 1407 O ALA A 84 23.804 -22.055 -4.697 1.00 0.00 O ATOM 1408 CB ALA A 84 21.494 -20.526 -5.770 1.00 0.00 C ATOM 0 H ALA A 84 20.309 -20.827 -3.358 1.00 0.00 H new ATOM 0 HA ALA A 84 21.287 -22.636 -5.490 1.00 0.00 H new ATOM 0 HB1 ALA A 84 22.346 -20.615 -6.444 1.00 0.00 H new ATOM 0 HB2 ALA A 84 20.576 -20.453 -6.353 1.00 0.00 H new ATOM 0 HB3 ALA A 84 21.608 -19.631 -5.158 1.00 0.00 H new ATOM 1414 N LYS A 85 22.642 -21.901 -2.776 1.00 0.00 N ATOM 1415 CA LYS A 85 23.817 -22.050 -1.925 1.00 0.00 C ATOM 1416 C LYS A 85 24.841 -20.958 -2.216 1.00 0.00 C ATOM 1417 O LYS A 85 26.039 -21.148 -2.008 1.00 0.00 O ATOM 1418 CB LYS A 85 24.451 -23.427 -2.133 1.00 0.00 C ATOM 1419 CG LYS A 85 23.455 -24.502 -2.533 1.00 0.00 C ATOM 1420 CD LYS A 85 22.340 -24.637 -1.511 1.00 0.00 C ATOM 1421 CE LYS A 85 21.190 -25.477 -2.047 1.00 0.00 C ATOM 1422 NZ LYS A 85 20.536 -26.273 -0.972 1.00 0.00 N ATOM 0 H LYS A 85 21.765 -21.786 -2.268 1.00 0.00 H new ATOM 0 HA LYS A 85 23.498 -21.957 -0.887 1.00 0.00 H new ATOM 0 HB2 LYS A 85 25.219 -23.351 -2.902 1.00 0.00 H new ATOM 0 HB3 LYS A 85 24.950 -23.730 -1.213 1.00 0.00 H new ATOM 0 HG2 LYS A 85 23.030 -24.261 -3.507 1.00 0.00 H new ATOM 0 HG3 LYS A 85 23.971 -25.456 -2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 85 22.732 -25.093 -0.602 1.00 0.00 H new ATOM 0 HD3 LYS A 85 21.973 -23.647 -1.239 1.00 0.00 H new ATOM 0 HE2 LYS A 85 20.453 -24.826 -2.516 1.00 0.00 H new ATOM 0 HE3 LYS A 85 21.561 -26.148 -2.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 19.758 -26.831 -1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 21.233 -26.913 -0.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 20.159 -25.631 -0.245 1.00 0.00 H new ATOM 1436 N GLN A 86 24.361 -19.815 -2.696 1.00 0.00 N ATOM 1437 CA GLN A 86 25.236 -18.693 -3.013 1.00 0.00 C ATOM 1438 C GLN A 86 24.660 -17.385 -2.481 1.00 0.00 C ATOM 1439 O GLN A 86 23.618 -17.376 -1.828 1.00 0.00 O ATOM 1440 CB GLN A 86 25.445 -18.594 -4.526 1.00 0.00 C ATOM 1441 CG GLN A 86 25.686 -19.937 -5.196 1.00 0.00 C ATOM 1442 CD GLN A 86 26.819 -19.892 -6.202 1.00 0.00 C ATOM 1443 OE1 GLN A 86 27.731 -20.719 -6.165 1.00 0.00 O ATOM 1444 NE2 GLN A 86 26.766 -18.925 -7.110 1.00 0.00 N ATOM 0 H GLN A 86 23.372 -19.642 -2.874 1.00 0.00 H new ATOM 0 HA GLN A 86 26.198 -18.868 -2.530 1.00 0.00 H new ATOM 0 HB2 GLN A 86 24.570 -18.125 -4.975 1.00 0.00 H new ATOM 0 HB3 GLN A 86 26.294 -17.940 -4.725 1.00 0.00 H new ATOM 0 HG2 GLN A 86 25.911 -20.684 -4.434 1.00 0.00 H new ATOM 0 HG3 GLN A 86 24.773 -20.258 -5.697 1.00 0.00 H new ATOM 0 HE21 GLN A 86 25.992 -18.261 -7.104 1.00 0.00 H new ATOM 0 HE22 GLN A 86 27.500 -18.846 -7.814 1.00 0.00 H new ATOM 1453 N ASN A 87 25.346 -16.283 -2.765 1.00 0.00 N ATOM 1454 CA ASN A 87 24.902 -14.969 -2.314 1.00 0.00 C ATOM 1455 C ASN A 87 23.778 -14.441 -3.200 1.00 0.00 C ATOM 1456 O ASN A 87 23.640 -14.820 -4.363 1.00 0.00 O ATOM 1457 CB ASN A 87 26.073 -13.984 -2.314 1.00 0.00 C ATOM 1458 CG ASN A 87 26.653 -13.775 -0.929 1.00 0.00 C ATOM 1459 OD1 ASN A 87 26.349 -14.520 0.003 1.00 0.00 O ATOM 1460 ND2 ASN A 87 27.493 -12.756 -0.787 1.00 0.00 N ATOM 0 H ASN A 87 26.211 -16.274 -3.305 1.00 0.00 H new ATOM 0 HA ASN A 87 24.522 -15.071 -1.298 1.00 0.00 H new ATOM 0 HB2 ASN A 87 26.854 -14.352 -2.980 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.739 -13.026 -2.713 1.00 0.00 H new ATOM 0 HD21 ASN A 87 27.914 -12.565 0.122 1.00 0.00 H new ATOM 0 HD22 ASN A 87 27.717 -12.164 -1.587 1.00 0.00 H new ATOM 1467 N PRO A 88 22.955 -13.543 -2.639 1.00 0.00 N ATOM 1468 CA PRO A 88 21.829 -12.942 -3.360 1.00 0.00 C ATOM 1469 C PRO A 88 22.287 -11.984 -4.454 1.00 0.00 C ATOM 1470 O PRO A 88 21.635 -11.851 -5.489 1.00 0.00 O ATOM 1471 CB PRO A 88 21.072 -12.183 -2.267 1.00 0.00 C ATOM 1472 CG PRO A 88 22.100 -11.888 -1.230 1.00 0.00 C ATOM 1473 CD PRO A 88 23.060 -13.045 -1.257 1.00 0.00 C ATOM 0 HA PRO A 88 21.226 -13.692 -3.873 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.628 -11.267 -2.656 1.00 0.00 H new ATOM 0 HB3 PRO A 88 20.259 -12.783 -1.859 1.00 0.00 H new ATOM 0 HG2 PRO A 88 22.613 -10.950 -1.445 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.643 -11.783 -0.246 1.00 0.00 H new ATOM 0 HD2 PRO A 88 24.076 -12.730 -1.020 1.00 0.00 H new ATOM 0 HD3 PRO A 88 22.786 -13.811 -0.532 1.00 0.00 H new ATOM 1481 N ALA A 89 23.413 -11.318 -4.218 1.00 0.00 N ATOM 1482 CA ALA A 89 23.959 -10.374 -5.185 1.00 0.00 C ATOM 1483 C ALA A 89 24.965 -11.053 -6.108 1.00 0.00 C ATOM 1484 O ALA A 89 25.236 -10.572 -7.208 1.00 0.00 O ATOM 1485 CB ALA A 89 24.607 -9.199 -4.468 1.00 0.00 C ATOM 0 H ALA A 89 23.965 -11.415 -3.365 1.00 0.00 H new ATOM 0 HA ALA A 89 23.137 -10.003 -5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 89 25.010 -8.502 -5.203 1.00 0.00 H new ATOM 0 HB2 ALA A 89 23.862 -8.690 -3.856 1.00 0.00 H new ATOM 0 HB3 ALA A 89 25.414 -9.562 -3.831 1.00 0.00 H new ATOM 1491 N GLN A 90 25.517 -12.173 -5.651 1.00 0.00 N ATOM 1492 CA GLN A 90 26.495 -12.917 -6.436 1.00 0.00 C ATOM 1493 C GLN A 90 25.823 -14.037 -7.224 1.00 0.00 C ATOM 1494 O GLN A 90 26.431 -14.638 -8.110 1.00 0.00 O ATOM 1495 CB GLN A 90 27.577 -13.498 -5.524 1.00 0.00 C ATOM 1496 CG GLN A 90 28.108 -12.506 -4.502 1.00 0.00 C ATOM 1497 CD GLN A 90 28.724 -11.279 -5.144 1.00 0.00 C ATOM 1498 OE1 GLN A 90 29.762 -11.363 -5.802 1.00 0.00 O ATOM 1499 NE2 GLN A 90 28.086 -10.129 -4.958 1.00 0.00 N ATOM 0 H GLN A 90 25.304 -12.584 -4.742 1.00 0.00 H new ATOM 0 HA GLN A 90 26.957 -12.227 -7.142 1.00 0.00 H new ATOM 0 HB2 GLN A 90 27.173 -14.365 -5.001 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.405 -13.854 -6.137 1.00 0.00 H new ATOM 0 HG2 GLN A 90 27.295 -12.198 -3.844 1.00 0.00 H new ATOM 0 HG3 GLN A 90 28.854 -12.998 -3.878 1.00 0.00 H new ATOM 0 HE21 GLN A 90 27.229 -10.105 -4.406 1.00 0.00 H new ATOM 0 HE22 GLN A 90 28.453 -9.270 -5.368 1.00 0.00 H new ATOM 1508 N TYR A 91 24.566 -14.312 -6.895 1.00 0.00 N ATOM 1509 CA TYR A 91 23.812 -15.362 -7.570 1.00 0.00 C ATOM 1510 C TYR A 91 23.880 -15.194 -9.085 1.00 0.00 C ATOM 1511 O TYR A 91 23.912 -16.174 -9.829 1.00 0.00 O ATOM 1512 CB TYR A 91 22.353 -15.348 -7.109 1.00 0.00 C ATOM 1513 CG TYR A 91 21.463 -16.288 -7.889 1.00 0.00 C ATOM 1514 CD1 TYR A 91 21.589 -17.665 -7.759 1.00 0.00 C ATOM 1515 CD2 TYR A 91 20.494 -15.798 -8.757 1.00 0.00 C ATOM 1516 CE1 TYR A 91 20.778 -18.528 -8.471 1.00 0.00 C ATOM 1517 CE2 TYR A 91 19.677 -16.653 -9.471 1.00 0.00 C ATOM 1518 CZ TYR A 91 19.823 -18.017 -9.325 1.00 0.00 C ATOM 1519 OH TYR A 91 19.012 -18.873 -10.035 1.00 0.00 O ATOM 0 H TYR A 91 24.048 -13.823 -6.165 1.00 0.00 H new ATOM 0 HA TYR A 91 24.260 -16.321 -7.309 1.00 0.00 H new ATOM 0 HB2 TYR A 91 22.312 -15.615 -6.053 1.00 0.00 H new ATOM 0 HB3 TYR A 91 21.962 -14.334 -7.197 1.00 0.00 H new ATOM 0 HD1 TYR A 91 22.334 -18.069 -7.089 1.00 0.00 H new ATOM 0 HD2 TYR A 91 20.378 -14.731 -8.875 1.00 0.00 H new ATOM 0 HE1 TYR A 91 20.891 -19.596 -8.359 1.00 0.00 H new ATOM 0 HE2 TYR A 91 18.928 -16.256 -10.140 1.00 0.00 H new ATOM 0 HH TYR A 91 18.393 -18.353 -10.589 1.00 0.00 H new ATOM 1529 N LEU A 92 23.903 -13.944 -9.534 1.00 0.00 N ATOM 1530 CA LEU A 92 23.968 -13.644 -10.960 1.00 0.00 C ATOM 1531 C LEU A 92 25.415 -13.493 -11.419 1.00 0.00 C ATOM 1532 O LEU A 92 25.836 -14.119 -12.391 1.00 0.00 O ATOM 1533 CB LEU A 92 23.187 -12.366 -11.269 1.00 0.00 C ATOM 1534 CG LEU A 92 23.439 -11.740 -12.641 1.00 0.00 C ATOM 1535 CD1 LEU A 92 22.956 -12.665 -13.747 1.00 0.00 C ATOM 1536 CD2 LEU A 92 22.758 -10.383 -12.742 1.00 0.00 C ATOM 0 H LEU A 92 23.878 -13.122 -8.931 1.00 0.00 H new ATOM 0 HA LEU A 92 23.519 -14.476 -11.502 1.00 0.00 H new ATOM 0 HB2 LEU A 92 22.123 -12.585 -11.182 1.00 0.00 H new ATOM 0 HB3 LEU A 92 23.424 -11.626 -10.505 1.00 0.00 H new ATOM 0 HG LEU A 92 24.513 -11.595 -12.761 1.00 0.00 H new ATOM 0 HD11 LEU A 92 23.144 -12.203 -14.716 1.00 0.00 H new ATOM 0 HD12 LEU A 92 23.491 -13.613 -13.688 1.00 0.00 H new ATOM 0 HD13 LEU A 92 21.887 -12.843 -13.631 1.00 0.00 H new ATOM 0 HD21 LEU A 92 22.948 -9.953 -13.725 1.00 0.00 H new ATOM 0 HD22 LEU A 92 21.684 -10.503 -12.600 1.00 0.00 H new ATOM 0 HD23 LEU A 92 23.153 -9.719 -11.973 1.00 0.00 H new