USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 786 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 7 TYR OH : rot 150:sc= -2.29 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HE2:sc= -0.195 K(o=-0.19,f=-0.92) USER MOD Single : A 17 THR OG1 : rot 93:sc= 1.29 USER MOD Single : A 24 GLN : amide:sc= -0.0137 X(o=-0.014,f=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc=-0.00523 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -1.36 K(o=-1.4,f=-11!) USER MOD Single : A 54 GLN : amide:sc=-0.000842 X(o=-0.00084,f=-0.054) USER MOD Single : A 55 ASN : amide:sc= -0.0818 K(o=-0.082,f=-1.3) USER MOD Single : A 61 ASN : amide:sc= -0.534 X(o=-0.53,f=-0.32) USER MOD Single : A 62 SER OG : rot 158:sc= 1.21 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 GLN : amide:sc= -0.428 K(o=-0.43,f=-0.93) USER MOD Single : A 92 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.0088) USER MOD ----------------------------------------------------------------- ATOM 22 N SER A 3 6.322 -2.073 -2.394 1.00 72.33 N ATOM 23 CA SER A 3 6.731 -2.887 -3.533 1.00 42.11 C ATOM 24 C SER A 3 8.232 -2.763 -3.778 1.00 20.03 C ATOM 25 O SER A 3 8.874 -3.702 -4.249 1.00 13.52 O ATOM 26 CB SER A 3 5.962 -2.469 -4.788 1.00 63.20 C ATOM 27 OG SER A 3 6.654 -1.455 -5.496 1.00 11.01 O ATOM 0 HA SER A 3 6.502 -3.928 -3.305 1.00 42.11 H new ATOM 0 HB2 SER A 3 5.817 -3.334 -5.435 1.00 63.20 H new ATOM 0 HB3 SER A 3 4.971 -2.111 -4.509 1.00 63.20 H new ATOM 0 HG SER A 3 6.143 -1.206 -6.294 1.00 11.01 H new ATOM 33 N GLN A 4 8.784 -1.598 -3.454 1.00 32.01 N ATOM 34 CA GLN A 4 10.209 -1.351 -3.639 1.00 53.50 C ATOM 35 C GLN A 4 10.994 -1.729 -2.388 1.00 0.14 C ATOM 36 O GLN A 4 10.885 -1.071 -1.352 1.00 43.04 O ATOM 37 CB GLN A 4 10.452 0.120 -3.983 1.00 0.01 C ATOM 38 CG GLN A 4 10.045 0.489 -5.400 1.00 70.34 C ATOM 39 CD GLN A 4 9.575 1.925 -5.518 1.00 13.14 C ATOM 40 OE1 GLN A 4 8.480 2.271 -5.071 1.00 64.41 O ATOM 41 NE2 GLN A 4 10.401 2.772 -6.121 1.00 23.44 N ATOM 0 H GLN A 4 8.266 -0.811 -3.062 1.00 32.01 H new ATOM 0 HA GLN A 4 10.556 -1.972 -4.465 1.00 53.50 H new ATOM 0 HB2 GLN A 4 9.900 0.745 -3.281 1.00 0.01 H new ATOM 0 HB3 GLN A 4 11.510 0.346 -3.847 1.00 0.01 H new ATOM 0 HG2 GLN A 4 10.891 0.332 -6.069 1.00 70.34 H new ATOM 0 HG3 GLN A 4 9.249 -0.178 -5.730 1.00 70.34 H new ATOM 0 HE21 GLN A 4 11.299 2.443 -6.477 1.00 23.44 H new ATOM 0 HE22 GLN A 4 10.138 3.752 -6.229 1.00 23.44 H new ATOM 50 N ILE A 5 11.784 -2.792 -2.490 1.00 30.41 N ATOM 51 CA ILE A 5 12.588 -3.257 -1.366 1.00 73.33 C ATOM 52 C ILE A 5 13.924 -3.819 -1.841 1.00 54.10 C ATOM 53 O ILE A 5 14.003 -4.459 -2.890 1.00 34.31 O ATOM 54 CB ILE A 5 11.849 -4.338 -0.555 1.00 12.35 C ATOM 55 CG1 ILE A 5 10.557 -3.769 0.036 1.00 2.52 C ATOM 56 CG2 ILE A 5 12.748 -4.880 0.547 1.00 55.22 C ATOM 57 CD1 ILE A 5 9.364 -3.895 -0.885 1.00 43.23 C ATOM 0 H ILE A 5 11.885 -3.348 -3.339 1.00 30.41 H new ATOM 0 HA ILE A 5 12.767 -2.393 -0.727 1.00 73.33 H new ATOM 0 HB ILE A 5 11.590 -5.159 -1.223 1.00 12.35 H new ATOM 0 HG12 ILE A 5 10.339 -4.282 0.972 1.00 2.52 H new ATOM 0 HG13 ILE A 5 10.710 -2.717 0.277 1.00 2.52 H new ATOM 0 HG21 ILE A 5 12.212 -5.643 1.112 1.00 55.22 H new ATOM 0 HG22 ILE A 5 13.643 -5.318 0.104 1.00 55.22 H new ATOM 0 HG23 ILE A 5 13.034 -4.068 1.216 1.00 55.22 H new ATOM 0 HD11 ILE A 5 8.484 -3.471 -0.401 1.00 43.23 H new ATOM 0 HD12 ILE A 5 9.562 -3.358 -1.812 1.00 43.23 H new ATOM 0 HD13 ILE A 5 9.185 -4.947 -1.106 1.00 43.23 H new ATOM 69 N HIS A 6 14.972 -3.576 -1.061 1.00 22.10 N ATOM 70 CA HIS A 6 16.306 -4.060 -1.400 1.00 52.33 C ATOM 71 C HIS A 6 17.046 -4.532 -0.153 1.00 22.13 C ATOM 72 O HIS A 6 16.891 -3.961 0.927 1.00 43.52 O ATOM 73 CB HIS A 6 17.108 -2.961 -2.098 1.00 14.40 C ATOM 74 CG HIS A 6 17.190 -1.688 -1.312 1.00 33.40 C ATOM 75 ND1 HIS A 6 16.261 -0.675 -1.422 1.00 3.33 N ATOM 76 CD2 HIS A 6 18.096 -1.269 -0.399 1.00 4.22 C ATOM 77 CE1 HIS A 6 16.594 0.314 -0.611 1.00 44.04 C ATOM 78 NE2 HIS A 6 17.704 -0.022 0.021 1.00 2.43 N ATOM 0 H HIS A 6 14.924 -3.047 -0.190 1.00 22.10 H new ATOM 0 HA HIS A 6 16.197 -4.906 -2.078 1.00 52.33 H new ATOM 0 HB2 HIS A 6 18.117 -3.325 -2.290 1.00 14.40 H new ATOM 0 HB3 HIS A 6 16.655 -2.752 -3.067 1.00 14.40 H new ATOM 0 HD2 HIS A 6 18.966 -1.814 -0.063 1.00 4.22 H new ATOM 0 HE1 HIS A 6 16.051 1.239 -0.486 1.00 44.04 H new ATOM 0 HE2 HIS A 6 18.191 0.552 0.709 1.00 2.43 H new ATOM 86 N TYR A 7 17.850 -5.578 -0.308 1.00 74.33 N ATOM 87 CA TYR A 7 18.611 -6.129 0.806 1.00 22.52 C ATOM 88 C TYR A 7 20.111 -5.980 0.568 1.00 12.01 C ATOM 89 O TYR A 7 20.550 -5.715 -0.551 1.00 14.31 O ATOM 90 CB TYR A 7 18.261 -7.604 1.011 1.00 34.21 C ATOM 91 CG TYR A 7 16.774 -7.881 0.997 1.00 42.14 C ATOM 92 CD1 TYR A 7 15.882 -7.023 1.627 1.00 55.12 C ATOM 93 CD2 TYR A 7 16.262 -9.000 0.352 1.00 65.25 C ATOM 94 CE1 TYR A 7 14.523 -7.272 1.617 1.00 71.43 C ATOM 95 CE2 TYR A 7 14.905 -9.257 0.335 1.00 41.20 C ATOM 96 CZ TYR A 7 14.040 -8.390 0.969 1.00 35.33 C ATOM 97 OH TYR A 7 12.687 -8.642 0.956 1.00 53.53 O ATOM 0 H TYR A 7 17.991 -6.061 -1.195 1.00 74.33 H new ATOM 0 HA TYR A 7 18.346 -5.571 1.704 1.00 22.52 H new ATOM 0 HB2 TYR A 7 18.739 -8.194 0.230 1.00 34.21 H new ATOM 0 HB3 TYR A 7 18.676 -7.938 1.962 1.00 34.21 H new ATOM 0 HD1 TYR A 7 16.257 -6.146 2.133 1.00 55.12 H new ATOM 0 HD2 TYR A 7 16.937 -9.681 -0.145 1.00 65.25 H new ATOM 0 HE1 TYR A 7 13.843 -6.596 2.113 1.00 71.43 H new ATOM 0 HE2 TYR A 7 14.524 -10.131 -0.172 1.00 41.20 H new ATOM 0 HH TYR A 7 12.451 -9.121 0.134 1.00 53.53 H new ATOM 107 N SER A 8 20.892 -6.153 1.630 1.00 51.14 N ATOM 108 CA SER A 8 22.342 -6.034 1.539 1.00 65.44 C ATOM 109 C SER A 8 23.025 -7.284 2.087 1.00 1.20 C ATOM 110 O SER A 8 22.930 -7.584 3.277 1.00 34.43 O ATOM 111 CB SER A 8 22.823 -4.800 2.303 1.00 44.50 C ATOM 112 OG SER A 8 22.314 -3.611 1.724 1.00 50.23 O ATOM 0 H SER A 8 20.545 -6.376 2.563 1.00 51.14 H new ATOM 0 HA SER A 8 22.608 -5.927 0.487 1.00 65.44 H new ATOM 0 HB2 SER A 8 22.506 -4.866 3.344 1.00 44.50 H new ATOM 0 HB3 SER A 8 23.913 -4.770 2.303 1.00 44.50 H new ATOM 0 HG SER A 8 22.635 -2.837 2.232 1.00 50.23 H new ATOM 118 N ILE A 9 23.713 -8.007 1.210 1.00 22.35 N ATOM 119 CA ILE A 9 24.413 -9.223 1.606 1.00 31.22 C ATOM 120 C ILE A 9 25.772 -9.322 0.923 1.00 64.54 C ATOM 121 O ILE A 9 25.875 -9.391 -0.302 1.00 65.43 O ATOM 122 CB ILE A 9 23.589 -10.481 1.271 1.00 5.13 C ATOM 123 CG1 ILE A 9 24.434 -11.740 1.479 1.00 35.02 C ATOM 124 CG2 ILE A 9 23.075 -10.412 -0.159 1.00 12.23 C ATOM 125 CD1 ILE A 9 23.665 -13.025 1.265 1.00 34.05 C ATOM 0 H ILE A 9 23.801 -7.772 0.221 1.00 22.35 H new ATOM 0 HA ILE A 9 24.555 -9.168 2.685 1.00 31.22 H new ATOM 0 HB ILE A 9 22.732 -10.526 1.943 1.00 5.13 H new ATOM 0 HG12 ILE A 9 25.283 -11.716 0.795 1.00 35.02 H new ATOM 0 HG13 ILE A 9 24.840 -11.733 2.491 1.00 35.02 H new ATOM 0 HG21 ILE A 9 22.495 -11.308 -0.381 1.00 12.23 H new ATOM 0 HG22 ILE A 9 22.443 -9.532 -0.276 1.00 12.23 H new ATOM 0 HG23 ILE A 9 23.919 -10.347 -0.846 1.00 12.23 H new ATOM 0 HD11 ILE A 9 24.326 -13.876 1.429 1.00 34.05 H new ATOM 0 HD12 ILE A 9 22.832 -13.072 1.967 1.00 34.05 H new ATOM 0 HD13 ILE A 9 23.282 -13.054 0.245 1.00 34.05 H new ATOM 137 N PRO A 10 26.842 -9.332 1.732 1.00 42.14 N ATOM 138 CA PRO A 10 28.215 -9.425 1.227 1.00 24.11 C ATOM 139 C PRO A 10 28.525 -10.798 0.640 1.00 42.33 C ATOM 140 O PRO A 10 28.076 -11.820 1.157 1.00 2.45 O ATOM 141 CB PRO A 10 29.069 -9.171 2.472 1.00 33.43 C ATOM 142 CG PRO A 10 28.202 -9.577 3.614 1.00 25.44 C ATOM 143 CD PRO A 10 26.794 -9.253 3.201 1.00 14.23 C ATOM 0 HA PRO A 10 28.399 -8.721 0.416 1.00 24.11 H new ATOM 0 HB2 PRO A 10 29.989 -9.754 2.447 1.00 33.43 H new ATOM 0 HB3 PRO A 10 29.358 -8.123 2.547 1.00 33.43 H new ATOM 0 HG2 PRO A 10 28.311 -10.640 3.828 1.00 25.44 H new ATOM 0 HG3 PRO A 10 28.476 -9.040 4.522 1.00 25.44 H new ATOM 0 HD2 PRO A 10 26.080 -9.963 3.618 1.00 14.23 H new ATOM 0 HD3 PRO A 10 26.494 -8.262 3.540 1.00 14.23 H new ATOM 151 N GLU A 11 29.295 -10.813 -0.444 1.00 5.43 N ATOM 152 CA GLU A 11 29.664 -12.061 -1.101 1.00 23.02 C ATOM 153 C GLU A 11 30.161 -13.085 -0.084 1.00 43.22 C ATOM 154 O GLU A 11 30.499 -12.737 1.047 1.00 64.23 O ATOM 155 CB GLU A 11 30.743 -11.808 -2.156 1.00 23.51 C ATOM 156 CG GLU A 11 30.292 -10.892 -3.281 1.00 1.03 C ATOM 157 CD GLU A 11 31.436 -10.463 -4.179 1.00 24.44 C ATOM 158 OE1 GLU A 11 32.564 -10.964 -3.984 1.00 13.44 O ATOM 159 OE2 GLU A 11 31.204 -9.627 -5.077 1.00 33.41 O ATOM 0 H GLU A 11 29.675 -9.975 -0.885 1.00 5.43 H new ATOM 0 HA GLU A 11 28.776 -12.461 -1.589 1.00 23.02 H new ATOM 0 HB2 GLU A 11 31.617 -11.372 -1.672 1.00 23.51 H new ATOM 0 HB3 GLU A 11 31.056 -12.762 -2.579 1.00 23.51 H new ATOM 0 HG2 GLU A 11 29.537 -11.402 -3.879 1.00 1.03 H new ATOM 0 HG3 GLU A 11 29.817 -10.008 -2.856 1.00 1.03 H new ATOM 166 N GLU A 12 30.201 -14.348 -0.496 1.00 65.04 N ATOM 167 CA GLU A 12 30.656 -15.422 0.379 1.00 74.32 C ATOM 168 C GLU A 12 29.699 -15.608 1.553 1.00 23.14 C ATOM 169 O GLU A 12 30.125 -15.865 2.679 1.00 33.22 O ATOM 170 CB GLU A 12 32.065 -15.127 0.896 1.00 20.42 C ATOM 171 CG GLU A 12 32.977 -16.342 0.903 1.00 25.32 C ATOM 172 CD GLU A 12 34.249 -16.122 0.107 1.00 51.40 C ATOM 173 OE1 GLU A 12 34.194 -16.221 -1.137 1.00 21.32 O ATOM 174 OE2 GLU A 12 35.298 -15.850 0.727 1.00 42.32 O ATOM 0 H GLU A 12 29.924 -14.652 -1.429 1.00 65.04 H new ATOM 0 HA GLU A 12 30.677 -16.345 -0.201 1.00 74.32 H new ATOM 0 HB2 GLU A 12 32.514 -14.349 0.278 1.00 20.42 H new ATOM 0 HB3 GLU A 12 31.996 -14.729 1.908 1.00 20.42 H new ATOM 0 HG2 GLU A 12 33.236 -16.591 1.932 1.00 25.32 H new ATOM 0 HG3 GLU A 12 32.440 -17.197 0.493 1.00 25.32 H new ATOM 181 N ALA A 13 28.405 -15.475 1.282 1.00 61.21 N ATOM 182 CA ALA A 13 27.388 -15.630 2.315 1.00 41.44 C ATOM 183 C ALA A 13 26.835 -17.051 2.333 1.00 42.44 C ATOM 184 O ALA A 13 25.899 -17.373 1.601 1.00 63.34 O ATOM 185 CB ALA A 13 26.264 -14.626 2.102 1.00 30.44 C ATOM 0 H ALA A 13 28.036 -15.260 0.356 1.00 61.21 H new ATOM 0 HA ALA A 13 27.854 -15.438 3.281 1.00 41.44 H new ATOM 0 HB1 ALA A 13 25.511 -14.752 2.880 1.00 30.44 H new ATOM 0 HB2 ALA A 13 26.667 -13.614 2.147 1.00 30.44 H new ATOM 0 HB3 ALA A 13 25.808 -14.792 1.126 1.00 30.44 H new ATOM 191 N LYS A 14 27.420 -17.898 3.173 1.00 42.52 N ATOM 192 CA LYS A 14 26.986 -19.285 3.287 1.00 4.23 C ATOM 193 C LYS A 14 25.480 -19.367 3.510 1.00 33.13 C ATOM 194 O LYS A 14 24.873 -18.451 4.066 1.00 4.25 O ATOM 195 CB LYS A 14 27.721 -19.977 4.437 1.00 24.41 C ATOM 196 CG LYS A 14 27.767 -19.155 5.713 1.00 44.51 C ATOM 197 CD LYS A 14 27.796 -20.040 6.947 1.00 32.41 C ATOM 198 CE LYS A 14 27.178 -19.342 8.149 1.00 43.11 C ATOM 199 NZ LYS A 14 25.745 -19.704 8.325 1.00 54.03 N ATOM 0 H LYS A 14 28.197 -17.648 3.785 1.00 42.52 H new ATOM 0 HA LYS A 14 27.225 -19.793 2.353 1.00 4.23 H new ATOM 0 HB2 LYS A 14 27.235 -20.930 4.646 1.00 24.41 H new ATOM 0 HB3 LYS A 14 28.740 -20.201 4.123 1.00 24.41 H new ATOM 0 HG2 LYS A 14 28.649 -18.515 5.703 1.00 44.51 H new ATOM 0 HG3 LYS A 14 26.898 -18.499 5.755 1.00 44.51 H new ATOM 0 HD2 LYS A 14 27.256 -20.965 6.745 1.00 32.41 H new ATOM 0 HD3 LYS A 14 28.826 -20.315 7.175 1.00 32.41 H new ATOM 0 HE2 LYS A 14 27.733 -19.609 9.049 1.00 43.11 H new ATOM 0 HE3 LYS A 14 27.267 -18.262 8.028 1.00 43.11 H new ATOM 0 HZ1 LYS A 14 25.361 -19.208 9.154 1.00 54.03 H new ATOM 0 HZ2 LYS A 14 25.210 -19.427 7.477 1.00 54.03 H new ATOM 0 HZ3 LYS A 14 25.661 -20.731 8.467 1.00 54.03 H new ATOM 213 N HIS A 15 24.881 -20.471 3.074 1.00 12.14 N ATOM 214 CA HIS A 15 23.445 -20.673 3.229 1.00 74.33 C ATOM 215 C HIS A 15 23.014 -20.430 4.672 1.00 54.11 C ATOM 216 O HIS A 15 23.541 -21.042 5.599 1.00 22.15 O ATOM 217 CB HIS A 15 23.059 -22.090 2.801 1.00 11.31 C ATOM 218 CG HIS A 15 23.290 -22.360 1.346 1.00 11.12 C ATOM 219 ND1 HIS A 15 22.888 -23.523 0.723 1.00 14.55 N ATOM 220 CD2 HIS A 15 23.884 -21.609 0.390 1.00 43.23 C ATOM 221 CE1 HIS A 15 23.226 -23.476 -0.553 1.00 1.24 C ATOM 222 NE2 HIS A 15 23.832 -22.325 -0.781 1.00 50.51 N ATOM 0 H HIS A 15 25.368 -21.239 2.611 1.00 12.14 H new ATOM 0 HA HIS A 15 22.931 -19.955 2.590 1.00 74.33 H new ATOM 0 HB2 HIS A 15 23.630 -22.807 3.390 1.00 11.31 H new ATOM 0 HB3 HIS A 15 22.006 -22.256 3.030 1.00 11.31 H new ATOM 0 HD1 HIS A 15 22.405 -24.298 1.177 1.00 14.55 H new ATOM 0 HD2 HIS A 15 24.318 -20.629 0.523 1.00 43.23 H new ATOM 0 HE1 HIS A 15 23.039 -24.247 -1.285 1.00 1.24 H new ATOM 230 N GLY A 16 22.051 -19.530 4.854 1.00 62.53 N ATOM 231 CA GLY A 16 21.567 -19.222 6.186 1.00 13.52 C ATOM 232 C GLY A 16 22.046 -17.871 6.679 1.00 43.42 C ATOM 233 O GLY A 16 21.817 -17.504 7.832 1.00 3.00 O ATOM 0 H GLY A 16 21.598 -19.010 4.102 1.00 62.53 H new ATOM 0 HA2 GLY A 16 20.477 -19.240 6.186 1.00 13.52 H new ATOM 0 HA3 GLY A 16 21.899 -19.996 6.878 1.00 13.52 H new ATOM 237 N THR A 17 22.716 -17.127 5.804 1.00 41.13 N ATOM 238 CA THR A 17 23.232 -15.810 6.156 1.00 20.34 C ATOM 239 C THR A 17 22.157 -14.740 6.004 1.00 5.12 C ATOM 240 O THR A 17 21.397 -14.742 5.036 1.00 65.24 O ATOM 241 CB THR A 17 24.445 -15.431 5.287 1.00 44.14 C ATOM 242 OG1 THR A 17 25.504 -16.375 5.484 1.00 11.20 O ATOM 243 CG2 THR A 17 24.937 -14.032 5.625 1.00 42.42 C ATOM 0 H THR A 17 22.914 -17.415 4.846 1.00 41.13 H new ATOM 0 HA THR A 17 23.544 -15.861 7.199 1.00 20.34 H new ATOM 0 HB THR A 17 24.134 -15.447 4.242 1.00 44.14 H new ATOM 0 HG1 THR A 17 25.440 -17.084 4.811 1.00 11.20 H new ATOM 0 HG21 THR A 17 25.794 -13.787 4.998 1.00 42.42 H new ATOM 0 HG22 THR A 17 24.138 -13.312 5.445 1.00 42.42 H new ATOM 0 HG23 THR A 17 25.231 -13.993 6.674 1.00 42.42 H new ATOM 251 N PHE A 18 22.100 -13.825 6.966 1.00 34.14 N ATOM 252 CA PHE A 18 21.117 -12.748 6.939 1.00 1.10 C ATOM 253 C PHE A 18 21.280 -11.895 5.684 1.00 34.21 C ATOM 254 O PHE A 18 22.391 -11.700 5.192 1.00 2.54 O ATOM 255 CB PHE A 18 21.255 -11.872 8.186 1.00 54.21 C ATOM 256 CG PHE A 18 20.523 -10.564 8.084 1.00 74.25 C ATOM 257 CD1 PHE A 18 19.147 -10.536 7.920 1.00 31.33 C ATOM 258 CD2 PHE A 18 21.210 -9.363 8.151 1.00 31.11 C ATOM 259 CE1 PHE A 18 18.471 -9.335 7.825 1.00 1.50 C ATOM 260 CE2 PHE A 18 20.539 -8.158 8.057 1.00 64.11 C ATOM 261 CZ PHE A 18 19.168 -8.144 7.895 1.00 50.04 C ATOM 0 H PHE A 18 22.723 -13.808 7.774 1.00 34.14 H new ATOM 0 HA PHE A 18 20.123 -13.196 6.926 1.00 1.10 H new ATOM 0 HB2 PHE A 18 20.881 -12.422 9.050 1.00 54.21 H new ATOM 0 HB3 PHE A 18 22.312 -11.675 8.367 1.00 54.21 H new ATOM 0 HD1 PHE A 18 18.597 -11.464 7.866 1.00 31.33 H new ATOM 0 HD2 PHE A 18 22.282 -9.368 8.278 1.00 31.11 H new ATOM 0 HE1 PHE A 18 17.399 -9.327 7.696 1.00 1.50 H new ATOM 0 HE2 PHE A 18 21.087 -7.229 8.110 1.00 64.11 H new ATOM 0 HZ PHE A 18 18.641 -7.204 7.823 1.00 50.04 H new ATOM 271 N VAL A 19 20.162 -11.390 5.170 1.00 25.31 N ATOM 272 CA VAL A 19 20.180 -10.558 3.973 1.00 34.20 C ATOM 273 C VAL A 19 19.381 -9.276 4.183 1.00 23.52 C ATOM 274 O VAL A 19 19.858 -8.181 3.890 1.00 11.22 O ATOM 275 CB VAL A 19 19.609 -11.312 2.757 1.00 33.02 C ATOM 276 CG1 VAL A 19 19.697 -10.452 1.506 1.00 54.21 C ATOM 277 CG2 VAL A 19 20.338 -12.632 2.559 1.00 61.21 C ATOM 0 H VAL A 19 19.234 -11.543 5.564 1.00 25.31 H new ATOM 0 HA VAL A 19 21.222 -10.306 3.778 1.00 34.20 H new ATOM 0 HB VAL A 19 18.558 -11.529 2.946 1.00 33.02 H new ATOM 0 HG11 VAL A 19 19.289 -11.001 0.657 1.00 54.21 H new ATOM 0 HG12 VAL A 19 19.126 -9.536 1.654 1.00 54.21 H new ATOM 0 HG13 VAL A 19 20.739 -10.202 1.309 1.00 54.21 H new ATOM 0 HG21 VAL A 19 19.922 -13.152 1.696 1.00 61.21 H new ATOM 0 HG22 VAL A 19 21.398 -12.441 2.391 1.00 61.21 H new ATOM 0 HG23 VAL A 19 20.217 -13.251 3.448 1.00 61.21 H new ATOM 287 N GLY A 20 18.162 -9.422 4.694 1.00 43.10 N ATOM 288 CA GLY A 20 17.317 -8.267 4.935 1.00 33.54 C ATOM 289 C GLY A 20 15.873 -8.650 5.194 1.00 71.31 C ATOM 290 O GLY A 20 15.242 -9.311 4.369 1.00 31.51 O ATOM 0 H GLY A 20 17.745 -10.318 4.945 1.00 43.10 H new ATOM 0 HA2 GLY A 20 17.701 -7.711 5.790 1.00 33.54 H new ATOM 0 HA3 GLY A 20 17.364 -7.600 4.074 1.00 33.54 H new ATOM 294 N ARG A 21 15.349 -8.235 6.343 1.00 70.54 N ATOM 295 CA ARG A 21 13.971 -8.542 6.709 1.00 43.54 C ATOM 296 C ARG A 21 13.023 -8.249 5.550 1.00 40.15 C ATOM 297 O ARG A 21 12.690 -7.094 5.284 1.00 41.42 O ATOM 298 CB ARG A 21 13.556 -7.732 7.938 1.00 11.23 C ATOM 299 CG ARG A 21 14.229 -8.186 9.223 1.00 62.52 C ATOM 300 CD ARG A 21 13.758 -7.372 10.417 1.00 4.52 C ATOM 301 NE ARG A 21 12.542 -7.921 11.009 1.00 14.22 N ATOM 302 CZ ARG A 21 12.029 -7.499 12.160 1.00 51.02 C ATOM 303 NH1 ARG A 21 12.624 -6.528 12.838 1.00 3.12 N ATOM 304 NH2 ARG A 21 10.918 -8.049 12.634 1.00 40.43 N ATOM 0 H ARG A 21 15.857 -7.686 7.036 1.00 70.54 H new ATOM 0 HA ARG A 21 13.912 -9.605 6.945 1.00 43.54 H new ATOM 0 HB2 ARG A 21 13.791 -6.682 7.766 1.00 11.23 H new ATOM 0 HB3 ARG A 21 12.475 -7.801 8.060 1.00 11.23 H new ATOM 0 HG2 ARG A 21 14.015 -9.241 9.394 1.00 62.52 H new ATOM 0 HG3 ARG A 21 15.310 -8.092 9.121 1.00 62.52 H new ATOM 0 HD2 ARG A 21 14.546 -7.343 11.169 1.00 4.52 H new ATOM 0 HD3 ARG A 21 13.577 -6.343 10.105 1.00 4.52 H new ATOM 0 HE ARG A 21 12.059 -8.670 10.512 1.00 14.22 H new ATOM 0 HH11 ARG A 21 13.478 -6.103 12.477 1.00 3.12 H new ATOM 0 HH12 ARG A 21 12.228 -6.206 13.721 1.00 3.12 H new ATOM 0 HH21 ARG A 21 10.457 -8.796 12.115 1.00 40.43 H new ATOM 0 HH22 ARG A 21 10.525 -7.724 13.518 1.00 40.43 H new ATOM 318 N ILE A 22 12.593 -9.302 4.864 1.00 72.45 N ATOM 319 CA ILE A 22 11.683 -9.158 3.734 1.00 71.10 C ATOM 320 C ILE A 22 10.288 -8.756 4.200 1.00 52.42 C ATOM 321 O ILE A 22 9.617 -7.947 3.559 1.00 45.03 O ATOM 322 CB ILE A 22 11.584 -10.462 2.921 1.00 70.24 C ATOM 323 CG1 ILE A 22 10.497 -10.340 1.851 1.00 72.51 C ATOM 324 CG2 ILE A 22 11.300 -11.640 3.841 1.00 71.03 C ATOM 325 CD1 ILE A 22 10.613 -11.373 0.752 1.00 54.05 C ATOM 0 H ILE A 22 12.860 -10.265 5.071 1.00 72.45 H new ATOM 0 HA ILE A 22 12.092 -8.373 3.098 1.00 71.10 H new ATOM 0 HB ILE A 22 12.538 -10.637 2.424 1.00 70.24 H new ATOM 0 HG12 ILE A 22 9.520 -10.433 2.325 1.00 72.51 H new ATOM 0 HG13 ILE A 22 10.543 -9.345 1.409 1.00 72.51 H new ATOM 0 HG21 ILE A 22 11.233 -12.554 3.251 1.00 71.03 H new ATOM 0 HG22 ILE A 22 12.106 -11.736 4.569 1.00 71.03 H new ATOM 0 HG23 ILE A 22 10.357 -11.475 4.363 1.00 71.03 H new ATOM 0 HD11 ILE A 22 9.811 -11.227 0.029 1.00 54.05 H new ATOM 0 HD12 ILE A 22 11.576 -11.266 0.252 1.00 54.05 H new ATOM 0 HD13 ILE A 22 10.536 -12.372 1.182 1.00 54.05 H new ATOM 337 N ALA A 23 9.857 -9.324 5.321 1.00 23.52 N ATOM 338 CA ALA A 23 8.544 -9.022 5.876 1.00 74.24 C ATOM 339 C ALA A 23 8.496 -7.603 6.433 1.00 61.44 C ATOM 340 O ALA A 23 7.487 -6.911 6.306 1.00 75.34 O ATOM 341 CB ALA A 23 8.183 -10.029 6.958 1.00 4.33 C ATOM 0 H ALA A 23 10.399 -9.997 5.863 1.00 23.52 H new ATOM 0 HA ALA A 23 7.812 -9.093 5.071 1.00 74.24 H new ATOM 0 HB1 ALA A 23 7.200 -9.791 7.363 1.00 4.33 H new ATOM 0 HB2 ALA A 23 8.166 -11.032 6.531 1.00 4.33 H new ATOM 0 HB3 ALA A 23 8.924 -9.987 7.756 1.00 4.33 H new ATOM 347 N GLN A 24 9.594 -7.178 7.050 1.00 54.11 N ATOM 348 CA GLN A 24 9.675 -5.842 7.627 1.00 1.54 C ATOM 349 C GLN A 24 9.577 -4.773 6.543 1.00 22.24 C ATOM 350 O GLN A 24 8.879 -3.772 6.706 1.00 72.43 O ATOM 351 CB GLN A 24 10.982 -5.678 8.405 1.00 43.12 C ATOM 352 CG GLN A 24 11.001 -4.459 9.314 1.00 62.44 C ATOM 353 CD GLN A 24 11.904 -3.358 8.794 1.00 10.12 C ATOM 354 OE1 GLN A 24 11.442 -2.408 8.161 1.00 3.35 O ATOM 355 NE2 GLN A 24 13.199 -3.479 9.059 1.00 24.44 N ATOM 0 H GLN A 24 10.438 -7.739 7.163 1.00 54.11 H new ATOM 0 HA GLN A 24 8.835 -5.718 8.311 1.00 1.54 H new ATOM 0 HB2 GLN A 24 11.152 -6.571 9.006 1.00 43.12 H new ATOM 0 HB3 GLN A 24 11.809 -5.607 7.699 1.00 43.12 H new ATOM 0 HG2 GLN A 24 9.987 -4.073 9.419 1.00 62.44 H new ATOM 0 HG3 GLN A 24 11.333 -4.757 10.308 1.00 62.44 H new ATOM 0 HE21 GLN A 24 13.539 -4.283 9.587 1.00 24.44 H new ATOM 0 HE22 GLN A 24 13.855 -2.768 8.735 1.00 24.44 H new ATOM 364 N ASP A 25 10.282 -4.992 5.439 1.00 74.34 N ATOM 365 CA ASP A 25 10.274 -4.048 4.327 1.00 74.50 C ATOM 366 C ASP A 25 8.969 -4.144 3.542 1.00 31.22 C ATOM 367 O ASP A 25 8.683 -3.305 2.687 1.00 1.33 O ATOM 368 CB ASP A 25 11.461 -4.310 3.400 1.00 43.15 C ATOM 369 CG ASP A 25 12.793 -4.076 4.085 1.00 63.03 C ATOM 370 OD1 ASP A 25 12.793 -3.552 5.218 1.00 41.52 O ATOM 371 OD2 ASP A 25 13.836 -4.417 3.487 1.00 1.35 O ATOM 0 H ASP A 25 10.866 -5.815 5.290 1.00 74.34 H new ATOM 0 HA ASP A 25 10.358 -3.041 4.736 1.00 74.50 H new ATOM 0 HB2 ASP A 25 11.417 -5.338 3.039 1.00 43.15 H new ATOM 0 HB3 ASP A 25 11.386 -3.662 2.527 1.00 43.15 H new ATOM 376 N LEU A 26 8.181 -5.172 3.837 1.00 22.33 N ATOM 377 CA LEU A 26 6.906 -5.379 3.159 1.00 44.12 C ATOM 378 C LEU A 26 5.757 -4.786 3.967 1.00 11.21 C ATOM 379 O LEU A 26 4.829 -4.201 3.409 1.00 3.15 O ATOM 380 CB LEU A 26 6.665 -6.872 2.928 1.00 43.34 C ATOM 381 CG LEU A 26 6.972 -7.391 1.522 1.00 35.34 C ATOM 382 CD1 LEU A 26 8.393 -7.032 1.119 1.00 70.05 C ATOM 383 CD2 LEU A 26 6.760 -8.897 1.452 1.00 15.55 C ATOM 0 H LEU A 26 8.403 -5.876 4.542 1.00 22.33 H new ATOM 0 HA LEU A 26 6.948 -4.871 2.196 1.00 44.12 H new ATOM 0 HB2 LEU A 26 7.270 -7.432 3.641 1.00 43.34 H new ATOM 0 HB3 LEU A 26 5.622 -7.091 3.155 1.00 43.34 H new ATOM 0 HG LEU A 26 6.286 -6.914 0.821 1.00 35.34 H new ATOM 0 HD11 LEU A 26 8.593 -7.409 0.116 1.00 70.05 H new ATOM 0 HD12 LEU A 26 8.511 -5.948 1.129 1.00 70.05 H new ATOM 0 HD13 LEU A 26 9.095 -7.480 1.822 1.00 70.05 H new ATOM 0 HD21 LEU A 26 6.983 -9.249 0.445 1.00 15.55 H new ATOM 0 HD22 LEU A 26 7.421 -9.391 2.164 1.00 15.55 H new ATOM 0 HD23 LEU A 26 5.724 -9.130 1.697 1.00 15.55 H new ATOM 395 N GLY A 27 5.826 -4.939 5.286 1.00 24.31 N ATOM 396 CA GLY A 27 4.787 -4.412 6.150 1.00 13.42 C ATOM 397 C GLY A 27 3.660 -5.401 6.372 1.00 53.32 C ATOM 398 O GLY A 27 2.484 -5.044 6.284 1.00 50.22 O ATOM 0 H GLY A 27 6.584 -5.419 5.771 1.00 24.31 H new ATOM 0 HA2 GLY A 27 5.222 -4.140 7.112 1.00 13.42 H new ATOM 0 HA3 GLY A 27 4.384 -3.499 5.713 1.00 13.42 H new ATOM 402 N LEU A 28 4.017 -6.648 6.659 1.00 51.44 N ATOM 403 CA LEU A 28 3.026 -7.693 6.892 1.00 44.11 C ATOM 404 C LEU A 28 3.310 -8.431 8.196 1.00 2.55 C ATOM 405 O LEU A 28 4.438 -8.429 8.688 1.00 1.34 O ATOM 406 CB LEU A 28 3.016 -8.682 5.725 1.00 34.23 C ATOM 407 CG LEU A 28 3.690 -8.209 4.437 1.00 3.44 C ATOM 408 CD1 LEU A 28 3.786 -9.348 3.435 1.00 61.21 C ATOM 409 CD2 LEU A 28 2.932 -7.032 3.840 1.00 63.34 C ATOM 0 H LEU A 28 4.985 -6.960 6.736 1.00 51.44 H new ATOM 0 HA LEU A 28 2.047 -7.221 6.969 1.00 44.11 H new ATOM 0 HB2 LEU A 28 3.504 -9.601 6.050 1.00 34.23 H new ATOM 0 HB3 LEU A 28 1.980 -8.934 5.498 1.00 34.23 H new ATOM 0 HG LEU A 28 4.701 -7.880 4.678 1.00 3.44 H new ATOM 0 HD11 LEU A 28 4.268 -8.992 2.525 1.00 61.21 H new ATOM 0 HD12 LEU A 28 4.373 -10.161 3.863 1.00 61.21 H new ATOM 0 HD13 LEU A 28 2.785 -9.709 3.198 1.00 61.21 H new ATOM 0 HD21 LEU A 28 3.426 -6.708 2.924 1.00 63.34 H new ATOM 0 HD22 LEU A 28 1.910 -7.335 3.614 1.00 63.34 H new ATOM 0 HD23 LEU A 28 2.917 -6.209 4.554 1.00 63.34 H new ATOM 421 N GLU A 29 2.279 -9.062 8.750 1.00 43.31 N ATOM 422 CA GLU A 29 2.419 -9.805 9.997 1.00 43.42 C ATOM 423 C GLU A 29 3.154 -11.122 9.766 1.00 70.04 C ATOM 424 O GLU A 29 3.051 -11.724 8.696 1.00 45.23 O ATOM 425 CB GLU A 29 1.045 -10.076 10.612 1.00 52.31 C ATOM 426 CG GLU A 29 0.939 -9.663 12.071 1.00 73.35 C ATOM 427 CD GLU A 29 1.068 -10.839 13.020 1.00 41.41 C ATOM 428 OE1 GLU A 29 0.031 -11.453 13.347 1.00 62.21 O ATOM 429 OE2 GLU A 29 2.205 -11.144 13.436 1.00 42.41 O ATOM 0 H GLU A 29 1.339 -9.073 8.355 1.00 43.31 H new ATOM 0 HA GLU A 29 3.005 -9.198 10.688 1.00 43.42 H new ATOM 0 HB2 GLU A 29 0.287 -9.544 10.037 1.00 52.31 H new ATOM 0 HB3 GLU A 29 0.822 -11.139 10.527 1.00 52.31 H new ATOM 0 HG2 GLU A 29 1.716 -8.933 12.296 1.00 73.35 H new ATOM 0 HG3 GLU A 29 -0.019 -9.170 12.237 1.00 73.35 H new ATOM 436 N LEU A 30 3.895 -11.564 10.775 1.00 23.14 N ATOM 437 CA LEU A 30 4.648 -12.810 10.684 1.00 64.15 C ATOM 438 C LEU A 30 3.711 -14.013 10.664 1.00 33.05 C ATOM 439 O LEU A 30 4.034 -15.058 10.099 1.00 63.11 O ATOM 440 CB LEU A 30 5.623 -12.928 11.856 1.00 2.55 C ATOM 441 CG LEU A 30 7.103 -13.049 11.490 1.00 33.50 C ATOM 442 CD1 LEU A 30 7.391 -14.412 10.880 1.00 30.52 C ATOM 443 CD2 LEU A 30 7.508 -11.938 10.533 1.00 64.22 C ATOM 0 H LEU A 30 3.991 -11.078 11.667 1.00 23.14 H new ATOM 0 HA LEU A 30 5.212 -12.796 9.751 1.00 64.15 H new ATOM 0 HB2 LEU A 30 5.498 -12.054 12.496 1.00 2.55 H new ATOM 0 HB3 LEU A 30 5.344 -13.799 12.448 1.00 2.55 H new ATOM 0 HG LEU A 30 7.693 -12.949 12.401 1.00 33.50 H new ATOM 0 HD11 LEU A 30 8.449 -14.481 10.626 1.00 30.52 H new ATOM 0 HD12 LEU A 30 7.139 -15.193 11.598 1.00 30.52 H new ATOM 0 HD13 LEU A 30 6.792 -14.541 9.979 1.00 30.52 H new ATOM 0 HD21 LEU A 30 8.564 -12.040 10.283 1.00 64.22 H new ATOM 0 HD22 LEU A 30 6.912 -12.006 9.623 1.00 64.22 H new ATOM 0 HD23 LEU A 30 7.339 -10.971 11.006 1.00 64.22 H new ATOM 455 N THR A 31 2.545 -13.858 11.285 1.00 61.31 N ATOM 456 CA THR A 31 1.560 -14.931 11.339 1.00 55.44 C ATOM 457 C THR A 31 0.528 -14.785 10.226 1.00 34.21 C ATOM 458 O THR A 31 -0.419 -15.567 10.139 1.00 25.13 O ATOM 459 CB THR A 31 0.833 -14.958 12.697 1.00 61.54 C ATOM 460 OG1 THR A 31 1.740 -14.601 13.745 1.00 5.21 O ATOM 461 CG2 THR A 31 0.251 -16.337 12.971 1.00 63.01 C ATOM 0 H THR A 31 2.260 -13.000 11.757 1.00 61.31 H new ATOM 0 HA THR A 31 2.103 -15.867 11.207 1.00 55.44 H new ATOM 0 HB THR A 31 0.017 -14.236 12.662 1.00 61.54 H new ATOM 0 HG1 THR A 31 1.270 -14.619 14.605 1.00 5.21 H new ATOM 0 HG21 THR A 31 -0.258 -16.332 13.935 1.00 63.01 H new ATOM 0 HG22 THR A 31 -0.461 -16.594 12.187 1.00 63.01 H new ATOM 0 HG23 THR A 31 1.054 -17.074 12.988 1.00 63.01 H new ATOM 469 N GLU A 32 0.717 -13.780 9.377 1.00 62.00 N ATOM 470 CA GLU A 32 -0.199 -13.533 8.270 1.00 62.34 C ATOM 471 C GLU A 32 0.378 -14.061 6.959 1.00 54.22 C ATOM 472 O GLU A 32 -0.329 -14.170 5.956 1.00 51.12 O ATOM 473 CB GLU A 32 -0.492 -12.037 8.145 1.00 51.22 C ATOM 474 CG GLU A 32 -1.751 -11.600 8.875 1.00 72.42 C ATOM 475 CD GLU A 32 -1.644 -11.774 10.377 1.00 13.04 C ATOM 476 OE1 GLU A 32 -1.475 -12.926 10.830 1.00 1.53 O ATOM 477 OE2 GLU A 32 -1.730 -10.759 11.100 1.00 30.41 O ATOM 0 H GLU A 32 1.496 -13.124 9.435 1.00 62.00 H new ATOM 0 HA GLU A 32 -1.130 -14.062 8.477 1.00 62.34 H new ATOM 0 HB2 GLU A 32 0.357 -11.475 8.534 1.00 51.22 H new ATOM 0 HB3 GLU A 32 -0.587 -11.781 7.090 1.00 51.22 H new ATOM 0 HG2 GLU A 32 -1.954 -10.553 8.648 1.00 72.42 H new ATOM 0 HG3 GLU A 32 -2.599 -12.176 8.506 1.00 72.42 H new ATOM 484 N LEU A 33 1.666 -14.386 6.974 1.00 35.04 N ATOM 485 CA LEU A 33 2.339 -14.902 5.787 1.00 12.34 C ATOM 486 C LEU A 33 1.814 -16.286 5.422 1.00 74.23 C ATOM 487 O LEU A 33 1.637 -16.604 4.246 1.00 65.34 O ATOM 488 CB LEU A 33 3.850 -14.962 6.020 1.00 54.24 C ATOM 489 CG LEU A 33 4.526 -13.639 6.383 1.00 30.50 C ATOM 490 CD1 LEU A 33 5.596 -13.860 7.441 1.00 34.14 C ATOM 491 CD2 LEU A 33 5.125 -12.989 5.145 1.00 53.44 C ATOM 0 H LEU A 33 2.265 -14.301 7.795 1.00 35.04 H new ATOM 0 HA LEU A 33 2.132 -14.225 4.958 1.00 12.34 H new ATOM 0 HB2 LEU A 33 4.046 -15.678 6.818 1.00 54.24 H new ATOM 0 HB3 LEU A 33 4.321 -15.352 5.118 1.00 54.24 H new ATOM 0 HG LEU A 33 3.771 -12.968 6.792 1.00 30.50 H new ATOM 0 HD11 LEU A 33 6.066 -12.908 7.687 1.00 34.14 H new ATOM 0 HD12 LEU A 33 5.140 -14.282 8.337 1.00 34.14 H new ATOM 0 HD13 LEU A 33 6.349 -14.549 7.058 1.00 34.14 H new ATOM 0 HD21 LEU A 33 5.602 -12.049 5.422 1.00 53.44 H new ATOM 0 HD22 LEU A 33 5.867 -13.656 4.706 1.00 53.44 H new ATOM 0 HD23 LEU A 33 4.336 -12.795 4.418 1.00 53.44 H new ATOM 503 N VAL A 34 1.563 -17.106 6.438 1.00 50.12 N ATOM 504 CA VAL A 34 1.054 -18.455 6.224 1.00 62.41 C ATOM 505 C VAL A 34 -0.194 -18.440 5.348 1.00 3.13 C ATOM 506 O VAL A 34 -0.242 -19.055 4.283 1.00 53.44 O ATOM 507 CB VAL A 34 0.723 -19.148 7.559 1.00 72.52 C ATOM 508 CG1 VAL A 34 -0.424 -20.132 7.380 1.00 42.11 C ATOM 509 CG2 VAL A 34 1.954 -19.848 8.116 1.00 53.43 C ATOM 0 H VAL A 34 1.704 -16.859 7.418 1.00 50.12 H new ATOM 0 HA VAL A 34 1.842 -19.014 5.718 1.00 62.41 H new ATOM 0 HB VAL A 34 0.410 -18.388 8.275 1.00 72.52 H new ATOM 0 HG11 VAL A 34 -0.644 -20.612 8.334 1.00 42.11 H new ATOM 0 HG12 VAL A 34 -1.308 -19.600 7.029 1.00 42.11 H new ATOM 0 HG13 VAL A 34 -0.143 -20.890 6.649 1.00 42.11 H new ATOM 0 HG21 VAL A 34 1.702 -20.332 9.059 1.00 53.43 H new ATOM 0 HG22 VAL A 34 2.299 -20.598 7.404 1.00 53.43 H new ATOM 0 HG23 VAL A 34 2.744 -19.116 8.284 1.00 53.43 H new ATOM 519 N PRO A 35 -1.229 -17.720 5.806 1.00 22.11 N ATOM 520 CA PRO A 35 -2.497 -17.606 5.079 1.00 4.12 C ATOM 521 C PRO A 35 -2.361 -16.782 3.803 1.00 11.55 C ATOM 522 O PRO A 35 -3.230 -16.822 2.932 1.00 43.00 O ATOM 523 CB PRO A 35 -3.416 -16.898 6.078 1.00 24.30 C ATOM 524 CG PRO A 35 -2.494 -16.137 6.967 1.00 31.02 C ATOM 525 CD PRO A 35 -1.241 -16.962 7.068 1.00 1.04 C ATOM 0 HA PRO A 35 -2.868 -18.577 4.752 1.00 4.12 H new ATOM 0 HB2 PRO A 35 -4.115 -16.233 5.571 1.00 24.30 H new ATOM 0 HB3 PRO A 35 -4.011 -17.614 6.645 1.00 24.30 H new ATOM 0 HG2 PRO A 35 -2.280 -15.151 6.555 1.00 31.02 H new ATOM 0 HG3 PRO A 35 -2.939 -15.982 7.950 1.00 31.02 H new ATOM 0 HD2 PRO A 35 -0.355 -16.336 7.169 1.00 1.04 H new ATOM 0 HD3 PRO A 35 -1.264 -17.624 7.934 1.00 1.04 H new ATOM 533 N ARG A 36 -1.267 -16.035 3.700 1.00 5.14 N ATOM 534 CA ARG A 36 -1.018 -15.200 2.531 1.00 73.41 C ATOM 535 C ARG A 36 -0.270 -15.981 1.455 1.00 72.54 C ATOM 536 O ARG A 36 0.108 -15.429 0.421 1.00 50.41 O ATOM 537 CB ARG A 36 -0.217 -13.959 2.925 1.00 3.50 C ATOM 538 CG ARG A 36 -1.078 -12.730 3.170 1.00 22.20 C ATOM 539 CD ARG A 36 -2.323 -13.074 3.973 1.00 3.30 C ATOM 540 NE ARG A 36 -2.733 -11.975 4.844 1.00 63.42 N ATOM 541 CZ ARG A 36 -3.914 -11.918 5.448 1.00 32.42 C ATOM 542 NH1 ARG A 36 -4.797 -12.892 5.277 1.00 35.35 N ATOM 543 NH2 ARG A 36 -4.214 -10.886 6.226 1.00 50.23 N ATOM 0 H ARG A 36 -0.538 -15.991 4.412 1.00 5.14 H new ATOM 0 HA ARG A 36 -1.981 -14.888 2.127 1.00 73.41 H new ATOM 0 HB2 ARG A 36 0.355 -14.177 3.827 1.00 3.50 H new ATOM 0 HB3 ARG A 36 0.503 -13.737 2.137 1.00 3.50 H new ATOM 0 HG2 ARG A 36 -0.497 -11.977 3.702 1.00 22.20 H new ATOM 0 HG3 ARG A 36 -1.369 -12.292 2.215 1.00 22.20 H new ATOM 0 HD2 ARG A 36 -3.137 -13.320 3.292 1.00 3.30 H new ATOM 0 HD3 ARG A 36 -2.132 -13.962 4.575 1.00 3.30 H new ATOM 0 HE ARG A 36 -2.076 -11.210 4.996 1.00 63.42 H new ATOM 0 HH11 ARG A 36 -4.570 -13.687 4.680 1.00 35.35 H new ATOM 0 HH12 ARG A 36 -5.704 -12.846 5.742 1.00 35.35 H new ATOM 0 HH21 ARG A 36 -3.537 -10.135 6.361 1.00 50.23 H new ATOM 0 HH22 ARG A 36 -5.122 -10.844 6.689 1.00 50.23 H new ATOM 557 N LEU A 37 -0.059 -17.269 1.704 1.00 34.13 N ATOM 558 CA LEU A 37 0.644 -18.127 0.757 1.00 2.10 C ATOM 559 C LEU A 37 1.917 -17.454 0.254 1.00 3.23 C ATOM 560 O LEU A 37 2.114 -17.295 -0.951 1.00 31.23 O ATOM 561 CB LEU A 37 -0.266 -18.470 -0.424 1.00 4.40 C ATOM 562 CG LEU A 37 -1.189 -19.673 -0.233 1.00 32.24 C ATOM 563 CD1 LEU A 37 -2.560 -19.223 0.247 1.00 53.11 C ATOM 564 CD2 LEU A 37 -1.308 -20.465 -1.527 1.00 32.14 C ATOM 0 H LEU A 37 -0.365 -17.742 2.554 1.00 34.13 H new ATOM 0 HA LEU A 37 0.920 -19.046 1.273 1.00 2.10 H new ATOM 0 HB2 LEU A 37 -0.880 -17.598 -0.648 1.00 4.40 H new ATOM 0 HB3 LEU A 37 0.360 -18.653 -1.298 1.00 4.40 H new ATOM 0 HG LEU A 37 -0.756 -20.322 0.528 1.00 32.24 H new ATOM 0 HD11 LEU A 37 -3.204 -20.093 0.377 1.00 53.11 H new ATOM 0 HD12 LEU A 37 -2.459 -18.701 1.198 1.00 53.11 H new ATOM 0 HD13 LEU A 37 -3.002 -18.552 -0.490 1.00 53.11 H new ATOM 0 HD21 LEU A 37 -1.969 -21.318 -1.372 1.00 32.14 H new ATOM 0 HD22 LEU A 37 -1.718 -19.825 -2.309 1.00 32.14 H new ATOM 0 HD23 LEU A 37 -0.322 -20.820 -1.828 1.00 32.14 H new ATOM 576 N PHE A 38 2.780 -17.061 1.186 1.00 63.44 N ATOM 577 CA PHE A 38 4.036 -16.407 0.837 1.00 13.52 C ATOM 578 C PHE A 38 4.958 -17.363 0.087 1.00 22.01 C ATOM 579 O PHE A 38 5.160 -18.503 0.505 1.00 24.13 O ATOM 580 CB PHE A 38 4.733 -15.891 2.097 1.00 3.55 C ATOM 581 CG PHE A 38 5.513 -14.626 1.876 1.00 12.10 C ATOM 582 CD1 PHE A 38 4.865 -13.405 1.778 1.00 72.22 C ATOM 583 CD2 PHE A 38 6.894 -14.658 1.766 1.00 54.05 C ATOM 584 CE1 PHE A 38 5.579 -12.239 1.574 1.00 21.54 C ATOM 585 CE2 PHE A 38 7.613 -13.496 1.563 1.00 42.45 C ATOM 586 CZ PHE A 38 6.955 -12.285 1.466 1.00 62.14 C ATOM 0 H PHE A 38 2.632 -17.184 2.188 1.00 63.44 H new ATOM 0 HA PHE A 38 3.809 -15.564 0.184 1.00 13.52 H new ATOM 0 HB2 PHE A 38 3.985 -15.717 2.871 1.00 3.55 H new ATOM 0 HB3 PHE A 38 5.406 -16.662 2.472 1.00 3.55 H new ATOM 0 HD1 PHE A 38 3.789 -13.364 1.862 1.00 72.22 H new ATOM 0 HD2 PHE A 38 7.414 -15.602 1.840 1.00 54.05 H new ATOM 0 HE1 PHE A 38 5.062 -11.294 1.499 1.00 21.54 H new ATOM 0 HE2 PHE A 38 8.689 -13.534 1.480 1.00 42.45 H new ATOM 0 HZ PHE A 38 7.516 -11.376 1.306 1.00 62.14 H new ATOM 596 N ARG A 39 5.514 -16.890 -1.023 1.00 64.14 N ATOM 597 CA ARG A 39 6.414 -17.703 -1.833 1.00 52.13 C ATOM 598 C ARG A 39 7.458 -16.832 -2.526 1.00 60.31 C ATOM 599 O ARG A 39 7.137 -15.778 -3.075 1.00 64.12 O ATOM 600 CB ARG A 39 5.621 -18.494 -2.875 1.00 63.25 C ATOM 601 CG ARG A 39 5.086 -19.819 -2.357 1.00 24.02 C ATOM 602 CD ARG A 39 4.946 -20.840 -3.475 1.00 43.55 C ATOM 603 NE ARG A 39 6.124 -21.696 -3.586 1.00 21.14 N ATOM 604 CZ ARG A 39 6.351 -22.738 -2.794 1.00 24.31 C ATOM 605 NH1 ARG A 39 5.486 -23.051 -1.840 1.00 32.44 N ATOM 606 NH2 ARG A 39 7.446 -23.470 -2.956 1.00 43.03 N ATOM 0 H ARG A 39 5.357 -15.948 -1.382 1.00 64.14 H new ATOM 0 HA ARG A 39 6.929 -18.400 -1.172 1.00 52.13 H new ATOM 0 HB2 ARG A 39 4.786 -17.886 -3.222 1.00 63.25 H new ATOM 0 HB3 ARG A 39 6.259 -18.682 -3.739 1.00 63.25 H new ATOM 0 HG2 ARG A 39 5.756 -20.208 -1.590 1.00 24.02 H new ATOM 0 HG3 ARG A 39 4.117 -19.661 -1.884 1.00 24.02 H new ATOM 0 HD2 ARG A 39 4.066 -21.457 -3.294 1.00 43.55 H new ATOM 0 HD3 ARG A 39 4.784 -20.322 -4.420 1.00 43.55 H new ATOM 0 HE ARG A 39 6.809 -21.482 -4.311 1.00 21.14 H new ATOM 0 HH11 ARG A 39 4.643 -22.491 -1.712 1.00 32.44 H new ATOM 0 HH12 ARG A 39 5.663 -23.852 -1.234 1.00 32.44 H new ATOM 0 HH21 ARG A 39 8.114 -23.233 -3.689 1.00 43.03 H new ATOM 0 HH22 ARG A 39 7.619 -24.270 -2.347 1.00 43.03 H new ATOM 620 N VAL A 40 8.709 -17.280 -2.496 1.00 21.41 N ATOM 621 CA VAL A 40 9.801 -16.543 -3.121 1.00 34.10 C ATOM 622 C VAL A 40 10.208 -17.181 -4.444 1.00 70.32 C ATOM 623 O VAL A 40 10.315 -18.403 -4.549 1.00 52.20 O ATOM 624 CB VAL A 40 11.031 -16.472 -2.198 1.00 23.25 C ATOM 625 CG1 VAL A 40 12.123 -15.619 -2.826 1.00 74.44 C ATOM 626 CG2 VAL A 40 10.641 -15.930 -0.831 1.00 33.12 C ATOM 0 H VAL A 40 8.992 -18.150 -2.045 1.00 21.41 H new ATOM 0 HA VAL A 40 9.436 -15.533 -3.305 1.00 34.10 H new ATOM 0 HB VAL A 40 11.422 -17.481 -2.066 1.00 23.25 H new ATOM 0 HG11 VAL A 40 12.984 -15.581 -2.159 1.00 74.44 H new ATOM 0 HG12 VAL A 40 12.422 -16.055 -3.779 1.00 74.44 H new ATOM 0 HG13 VAL A 40 11.747 -14.609 -2.991 1.00 74.44 H new ATOM 0 HG21 VAL A 40 11.523 -15.887 -0.192 1.00 33.12 H new ATOM 0 HG22 VAL A 40 10.224 -14.929 -0.942 1.00 33.12 H new ATOM 0 HG23 VAL A 40 9.897 -16.585 -0.379 1.00 33.12 H new ATOM 636 N ALA A 41 10.435 -16.346 -5.453 1.00 12.13 N ATOM 637 CA ALA A 41 10.833 -16.828 -6.769 1.00 61.23 C ATOM 638 C ALA A 41 11.630 -15.769 -7.524 1.00 30.42 C ATOM 639 O ALA A 41 11.863 -14.673 -7.014 1.00 35.41 O ATOM 640 CB ALA A 41 9.609 -17.242 -7.572 1.00 71.04 C ATOM 0 H ALA A 41 10.350 -15.332 -5.383 1.00 12.13 H new ATOM 0 HA ALA A 41 11.475 -17.698 -6.631 1.00 61.23 H new ATOM 0 HB1 ALA A 41 9.921 -17.600 -8.553 1.00 71.04 H new ATOM 0 HB2 ALA A 41 9.081 -18.038 -7.046 1.00 71.04 H new ATOM 0 HB3 ALA A 41 8.946 -16.385 -7.693 1.00 71.04 H new ATOM 646 N SER A 42 12.047 -16.104 -8.741 1.00 34.43 N ATOM 647 CA SER A 42 12.822 -15.184 -9.564 1.00 13.52 C ATOM 648 C SER A 42 12.778 -15.599 -11.031 1.00 44.43 C ATOM 649 O SER A 42 12.523 -16.759 -11.354 1.00 15.13 O ATOM 650 CB SER A 42 14.272 -15.131 -9.080 1.00 10.54 C ATOM 651 OG SER A 42 15.024 -14.187 -9.823 1.00 72.34 O ATOM 0 H SER A 42 11.861 -17.006 -9.179 1.00 34.43 H new ATOM 0 HA SER A 42 12.380 -14.192 -9.472 1.00 13.52 H new ATOM 0 HB2 SER A 42 14.296 -14.868 -8.022 1.00 10.54 H new ATOM 0 HB3 SER A 42 14.726 -16.117 -9.174 1.00 10.54 H new ATOM 0 HG SER A 42 15.947 -14.171 -9.493 1.00 72.34 H new ATOM 657 N LYS A 43 13.031 -14.642 -11.918 1.00 15.51 N ATOM 658 CA LYS A 43 13.022 -14.905 -13.352 1.00 3.10 C ATOM 659 C LYS A 43 14.349 -15.509 -13.802 1.00 34.42 C ATOM 660 O LYS A 43 14.420 -16.174 -14.835 1.00 74.35 O ATOM 661 CB LYS A 43 12.749 -13.614 -14.127 1.00 3.21 C ATOM 662 CG LYS A 43 11.276 -13.374 -14.410 1.00 64.42 C ATOM 663 CD LYS A 43 10.835 -14.065 -15.690 1.00 21.34 C ATOM 664 CE LYS A 43 10.178 -13.089 -16.652 1.00 54.53 C ATOM 665 NZ LYS A 43 10.395 -13.479 -18.073 1.00 1.41 N ATOM 0 H LYS A 43 13.245 -13.676 -11.668 1.00 15.51 H new ATOM 0 HA LYS A 43 12.227 -15.621 -13.560 1.00 3.10 H new ATOM 0 HB2 LYS A 43 13.144 -12.770 -13.561 1.00 3.21 H new ATOM 0 HB3 LYS A 43 13.291 -13.646 -15.072 1.00 3.21 H new ATOM 0 HG2 LYS A 43 10.680 -13.739 -13.574 1.00 64.42 H new ATOM 0 HG3 LYS A 43 11.090 -12.303 -14.491 1.00 64.42 H new ATOM 0 HD2 LYS A 43 11.697 -14.527 -16.171 1.00 21.34 H new ATOM 0 HD3 LYS A 43 10.137 -14.867 -15.450 1.00 21.34 H new ATOM 0 HE2 LYS A 43 9.108 -13.042 -16.448 1.00 54.53 H new ATOM 0 HE3 LYS A 43 10.578 -12.089 -16.485 1.00 54.53 H new ATOM 0 HZ1 LYS A 43 9.931 -12.788 -18.697 1.00 1.41 H new ATOM 0 HZ2 LYS A 43 11.415 -13.499 -18.276 1.00 1.41 H new ATOM 0 HZ3 LYS A 43 9.990 -14.422 -18.240 1.00 1.41 H new ATOM 679 N ASP A 44 15.396 -15.275 -13.019 1.00 32.43 N ATOM 680 CA ASP A 44 16.719 -15.799 -13.335 1.00 65.33 C ATOM 681 C ASP A 44 16.766 -17.311 -13.139 1.00 65.44 C ATOM 682 O ASP A 44 16.675 -18.075 -14.101 1.00 2.11 O ATOM 683 CB ASP A 44 17.780 -15.126 -12.463 1.00 31.34 C ATOM 684 CG ASP A 44 18.317 -13.852 -13.084 1.00 2.24 C ATOM 685 OD1 ASP A 44 17.607 -12.825 -13.040 1.00 61.12 O ATOM 686 OD2 ASP A 44 19.448 -13.881 -13.612 1.00 51.22 O ATOM 0 H ASP A 44 15.354 -14.726 -12.161 1.00 32.43 H new ATOM 0 HA ASP A 44 16.928 -15.580 -14.382 1.00 65.33 H new ATOM 0 HB2 ASP A 44 17.353 -14.899 -11.486 1.00 31.34 H new ATOM 0 HB3 ASP A 44 18.603 -15.821 -12.297 1.00 31.34 H new ATOM 691 N ARG A 45 16.911 -17.737 -11.889 1.00 15.34 N ATOM 692 CA ARG A 45 16.972 -19.157 -11.567 1.00 22.40 C ATOM 693 C ARG A 45 15.906 -19.529 -10.541 1.00 31.32 C ATOM 694 O ARG A 45 15.557 -20.699 -10.389 1.00 25.33 O ATOM 695 CB ARG A 45 18.359 -19.521 -11.032 1.00 74.44 C ATOM 696 CG ARG A 45 18.950 -20.767 -11.671 1.00 72.42 C ATOM 697 CD ARG A 45 19.755 -20.427 -12.915 1.00 44.02 C ATOM 698 NE ARG A 45 20.301 -21.620 -13.558 1.00 14.23 N ATOM 699 CZ ARG A 45 19.580 -22.443 -14.311 1.00 41.02 C ATOM 700 NH1 ARG A 45 18.292 -22.203 -14.516 1.00 62.41 N ATOM 701 NH2 ARG A 45 20.148 -23.508 -14.862 1.00 71.22 N ATOM 0 H ARG A 45 16.988 -17.118 -11.082 1.00 15.34 H new ATOM 0 HA ARG A 45 16.783 -19.719 -12.481 1.00 22.40 H new ATOM 0 HB2 ARG A 45 19.035 -18.682 -11.198 1.00 74.44 H new ATOM 0 HB3 ARG A 45 18.296 -19.671 -9.954 1.00 74.44 H new ATOM 0 HG2 ARG A 45 19.589 -21.278 -10.951 1.00 72.42 H new ATOM 0 HG3 ARG A 45 18.149 -21.458 -11.933 1.00 72.42 H new ATOM 0 HD2 ARG A 45 19.121 -19.892 -13.622 1.00 44.02 H new ATOM 0 HD3 ARG A 45 20.570 -19.755 -12.647 1.00 44.02 H new ATOM 0 HE ARG A 45 21.289 -21.832 -13.421 1.00 14.23 H new ATOM 0 HH11 ARG A 45 17.852 -21.385 -14.095 1.00 62.41 H new ATOM 0 HH12 ARG A 45 17.741 -22.837 -15.095 1.00 62.41 H new ATOM 0 HH21 ARG A 45 21.139 -23.695 -14.707 1.00 71.22 H new ATOM 0 HH22 ARG A 45 19.594 -24.140 -15.440 1.00 71.22 H new ATOM 715 N GLY A 46 15.392 -18.524 -9.838 1.00 74.33 N ATOM 716 CA GLY A 46 14.371 -18.766 -8.835 1.00 62.22 C ATOM 717 C GLY A 46 14.903 -19.532 -7.640 1.00 0.21 C ATOM 718 O GLY A 46 14.135 -19.977 -6.787 1.00 55.13 O ATOM 0 H GLY A 46 15.664 -17.547 -9.945 1.00 74.33 H new ATOM 0 HA2 GLY A 46 13.963 -17.813 -8.499 1.00 62.22 H new ATOM 0 HA3 GLY A 46 13.550 -19.324 -9.284 1.00 62.22 H new ATOM 722 N ASP A 47 16.221 -19.687 -7.578 1.00 31.13 N ATOM 723 CA ASP A 47 16.855 -20.405 -6.478 1.00 61.12 C ATOM 724 C ASP A 47 18.089 -19.658 -5.982 1.00 23.51 C ATOM 725 O ASP A 47 19.218 -20.124 -6.147 1.00 32.14 O ATOM 726 CB ASP A 47 17.241 -21.818 -6.919 1.00 3.21 C ATOM 727 CG ASP A 47 16.076 -22.785 -6.849 1.00 52.00 C ATOM 728 OD1 ASP A 47 15.094 -22.587 -7.595 1.00 42.45 O ATOM 729 OD2 ASP A 47 16.146 -23.741 -6.049 1.00 13.33 O ATOM 0 H ASP A 47 16.871 -19.325 -8.276 1.00 31.13 H new ATOM 0 HA ASP A 47 16.139 -20.472 -5.659 1.00 61.12 H new ATOM 0 HB2 ASP A 47 17.622 -21.786 -7.940 1.00 3.21 H new ATOM 0 HB3 ASP A 47 18.051 -22.184 -6.288 1.00 3.21 H new ATOM 734 N LEU A 48 17.868 -18.498 -5.375 1.00 11.22 N ATOM 735 CA LEU A 48 18.962 -17.685 -4.855 1.00 22.20 C ATOM 736 C LEU A 48 18.842 -17.512 -3.344 1.00 70.13 C ATOM 737 O LEU A 48 19.826 -17.637 -2.614 1.00 20.00 O ATOM 738 CB LEU A 48 18.976 -16.316 -5.537 1.00 73.12 C ATOM 739 CG LEU A 48 18.907 -16.327 -7.065 1.00 13.33 C ATOM 740 CD1 LEU A 48 17.808 -15.397 -7.556 1.00 4.42 C ATOM 741 CD2 LEU A 48 20.249 -15.931 -7.662 1.00 24.51 C ATOM 0 H LEU A 48 16.941 -18.099 -5.230 1.00 11.22 H new ATOM 0 HA LEU A 48 19.898 -18.200 -5.070 1.00 22.20 H new ATOM 0 HB2 LEU A 48 18.134 -15.735 -5.159 1.00 73.12 H new ATOM 0 HB3 LEU A 48 19.884 -15.792 -5.238 1.00 73.12 H new ATOM 0 HG LEU A 48 18.671 -17.340 -7.392 1.00 13.33 H new ATOM 0 HD11 LEU A 48 17.774 -15.418 -8.645 1.00 4.42 H new ATOM 0 HD12 LEU A 48 16.848 -15.725 -7.156 1.00 4.42 H new ATOM 0 HD13 LEU A 48 18.013 -14.381 -7.219 1.00 4.42 H new ATOM 0 HD21 LEU A 48 20.181 -15.944 -8.750 1.00 24.51 H new ATOM 0 HD22 LEU A 48 20.515 -14.928 -7.327 1.00 24.51 H new ATOM 0 HD23 LEU A 48 21.014 -16.636 -7.337 1.00 24.51 H new ATOM 753 N LEU A 49 17.630 -17.226 -2.882 1.00 21.15 N ATOM 754 CA LEU A 49 17.380 -17.038 -1.457 1.00 31.13 C ATOM 755 C LEU A 49 15.946 -17.419 -1.101 1.00 4.23 C ATOM 756 O LEU A 49 15.124 -17.667 -1.981 1.00 55.33 O ATOM 757 CB LEU A 49 17.648 -15.585 -1.059 1.00 74.50 C ATOM 758 CG LEU A 49 19.092 -15.105 -1.206 1.00 54.52 C ATOM 759 CD1 LEU A 49 19.330 -14.550 -2.602 1.00 61.42 C ATOM 760 CD2 LEU A 49 19.415 -14.056 -0.152 1.00 14.12 C ATOM 0 H LEU A 49 16.805 -17.119 -3.473 1.00 21.15 H new ATOM 0 HA LEU A 49 18.057 -17.690 -0.905 1.00 31.13 H new ATOM 0 HB2 LEU A 49 17.009 -14.940 -1.662 1.00 74.50 H new ATOM 0 HB3 LEU A 49 17.346 -15.452 -0.020 1.00 74.50 H new ATOM 0 HG LEU A 49 19.755 -15.957 -1.057 1.00 54.52 H new ATOM 0 HD11 LEU A 49 20.363 -14.213 -2.688 1.00 61.42 H new ATOM 0 HD12 LEU A 49 19.139 -15.329 -3.341 1.00 61.42 H new ATOM 0 HD13 LEU A 49 18.658 -13.710 -2.779 1.00 61.42 H new ATOM 0 HD21 LEU A 49 20.447 -13.726 -0.272 1.00 14.12 H new ATOM 0 HD22 LEU A 49 18.745 -13.204 -0.269 1.00 14.12 H new ATOM 0 HD23 LEU A 49 19.285 -14.486 0.841 1.00 14.12 H new ATOM 772 N GLU A 50 15.655 -17.461 0.196 1.00 42.22 N ATOM 773 CA GLU A 50 14.320 -17.810 0.667 1.00 1.32 C ATOM 774 C GLU A 50 14.040 -17.176 2.027 1.00 43.12 C ATOM 775 O GLU A 50 14.950 -16.984 2.834 1.00 32.41 O ATOM 776 CB GLU A 50 14.169 -19.330 0.760 1.00 51.51 C ATOM 777 CG GLU A 50 13.052 -19.884 -0.108 1.00 70.13 C ATOM 778 CD GLU A 50 12.882 -21.383 0.047 1.00 43.05 C ATOM 779 OE1 GLU A 50 12.597 -21.835 1.175 1.00 51.01 O ATOM 780 OE2 GLU A 50 13.035 -22.104 -0.962 1.00 11.11 O ATOM 0 H GLU A 50 16.325 -17.258 0.938 1.00 42.22 H new ATOM 0 HA GLU A 50 13.597 -17.423 -0.051 1.00 1.32 H new ATOM 0 HB2 GLU A 50 15.110 -19.799 0.470 1.00 51.51 H new ATOM 0 HB3 GLU A 50 13.982 -19.605 1.798 1.00 51.51 H new ATOM 0 HG2 GLU A 50 12.116 -19.387 0.149 1.00 70.13 H new ATOM 0 HG3 GLU A 50 13.259 -19.652 -1.153 1.00 70.13 H new ATOM 787 N VAL A 51 12.775 -16.852 2.273 1.00 51.31 N ATOM 788 CA VAL A 51 12.374 -16.240 3.534 1.00 32.01 C ATOM 789 C VAL A 51 11.918 -17.295 4.536 1.00 3.22 C ATOM 790 O VAL A 51 11.252 -18.263 4.174 1.00 72.15 O ATOM 791 CB VAL A 51 11.238 -15.220 3.327 1.00 22.12 C ATOM 792 CG1 VAL A 51 10.083 -15.854 2.566 1.00 4.35 C ATOM 793 CG2 VAL A 51 10.768 -14.669 4.665 1.00 52.45 C ATOM 0 H VAL A 51 12.010 -17.003 1.616 1.00 51.31 H new ATOM 0 HA VAL A 51 13.249 -15.723 3.927 1.00 32.01 H new ATOM 0 HB VAL A 51 11.621 -14.391 2.732 1.00 22.12 H new ATOM 0 HG11 VAL A 51 9.290 -15.119 2.429 1.00 4.35 H new ATOM 0 HG12 VAL A 51 10.433 -16.196 1.592 1.00 4.35 H new ATOM 0 HG13 VAL A 51 9.697 -16.703 3.131 1.00 4.35 H new ATOM 0 HG21 VAL A 51 9.965 -13.950 4.501 1.00 52.45 H new ATOM 0 HG22 VAL A 51 10.402 -15.486 5.286 1.00 52.45 H new ATOM 0 HG23 VAL A 51 11.600 -14.176 5.168 1.00 52.45 H new ATOM 803 N ASN A 52 12.283 -17.099 5.799 1.00 33.54 N ATOM 804 CA ASN A 52 11.911 -18.034 6.855 1.00 22.43 C ATOM 805 C ASN A 52 10.736 -17.499 7.667 1.00 0.35 C ATOM 806 O ASN A 52 10.849 -16.474 8.342 1.00 53.03 O ATOM 807 CB ASN A 52 13.105 -18.296 7.776 1.00 33.51 C ATOM 808 CG ASN A 52 12.781 -19.292 8.873 1.00 33.02 C ATOM 809 OD1 ASN A 52 11.695 -19.872 8.900 1.00 50.30 O ATOM 810 ND2 ASN A 52 13.724 -19.495 9.786 1.00 42.54 N ATOM 0 H ASN A 52 12.835 -16.302 6.116 1.00 33.54 H new ATOM 0 HA ASN A 52 11.609 -18.971 6.387 1.00 22.43 H new ATOM 0 HB2 ASN A 52 13.941 -18.670 7.185 1.00 33.51 H new ATOM 0 HB3 ASN A 52 13.427 -17.357 8.225 1.00 33.51 H new ATOM 0 HD21 ASN A 52 13.563 -20.153 10.548 1.00 42.54 H new ATOM 0 HD22 ASN A 52 14.610 -18.993 9.725 1.00 42.54 H new ATOM 817 N LEU A 53 9.609 -18.199 7.599 1.00 50.50 N ATOM 818 CA LEU A 53 8.412 -17.795 8.328 1.00 10.55 C ATOM 819 C LEU A 53 8.656 -17.825 9.834 1.00 75.01 C ATOM 820 O LEU A 53 7.883 -17.261 10.608 1.00 33.32 O ATOM 821 CB LEU A 53 7.240 -18.710 7.971 1.00 32.13 C ATOM 822 CG LEU A 53 6.647 -18.527 6.574 1.00 60.33 C ATOM 823 CD1 LEU A 53 5.478 -19.477 6.361 1.00 4.01 C ATOM 824 CD2 LEU A 53 6.209 -17.085 6.364 1.00 4.14 C ATOM 0 H LEU A 53 9.499 -19.049 7.046 1.00 50.50 H new ATOM 0 HA LEU A 53 8.168 -16.773 8.038 1.00 10.55 H new ATOM 0 HB2 LEU A 53 7.569 -19.744 8.072 1.00 32.13 H new ATOM 0 HB3 LEU A 53 6.448 -18.555 8.703 1.00 32.13 H new ATOM 0 HG LEU A 53 7.418 -18.762 5.840 1.00 60.33 H new ATOM 0 HD11 LEU A 53 5.069 -19.332 5.361 1.00 4.01 H new ATOM 0 HD12 LEU A 53 5.821 -20.506 6.467 1.00 4.01 H new ATOM 0 HD13 LEU A 53 4.705 -19.274 7.102 1.00 4.01 H new ATOM 0 HD21 LEU A 53 5.790 -16.974 5.364 1.00 4.14 H new ATOM 0 HD22 LEU A 53 5.454 -16.822 7.105 1.00 4.14 H new ATOM 0 HD23 LEU A 53 7.069 -16.424 6.472 1.00 4.14 H new ATOM 836 N GLN A 54 9.735 -18.485 10.240 1.00 22.02 N ATOM 837 CA GLN A 54 10.081 -18.587 11.653 1.00 31.11 C ATOM 838 C GLN A 54 10.099 -17.211 12.310 1.00 54.20 C ATOM 839 O GLN A 54 9.532 -17.018 13.385 1.00 62.21 O ATOM 840 CB GLN A 54 11.444 -19.262 11.819 1.00 34.00 C ATOM 841 CG GLN A 54 11.741 -19.689 13.247 1.00 20.23 C ATOM 842 CD GLN A 54 12.381 -21.061 13.325 1.00 61.23 C ATOM 843 OE1 GLN A 54 11.808 -22.053 12.872 1.00 1.24 O ATOM 844 NE2 GLN A 54 13.576 -21.126 13.900 1.00 42.50 N ATOM 0 H GLN A 54 10.385 -18.957 9.611 1.00 22.02 H new ATOM 0 HA GLN A 54 9.320 -19.194 12.144 1.00 31.11 H new ATOM 0 HB2 GLN A 54 11.488 -20.137 11.170 1.00 34.00 H new ATOM 0 HB3 GLN A 54 12.223 -18.577 11.484 1.00 34.00 H new ATOM 0 HG2 GLN A 54 12.402 -18.957 13.711 1.00 20.23 H new ATOM 0 HG3 GLN A 54 10.815 -19.691 13.822 1.00 20.23 H new ATOM 0 HE21 GLN A 54 14.015 -20.279 14.262 1.00 42.50 H new ATOM 0 HE22 GLN A 54 14.055 -22.023 13.980 1.00 42.50 H new ATOM 853 N ASN A 55 10.753 -16.257 11.656 1.00 42.31 N ATOM 854 CA ASN A 55 10.845 -14.898 12.177 1.00 5.23 C ATOM 855 C ASN A 55 10.779 -13.876 11.047 1.00 51.34 C ATOM 856 O ASN A 55 11.177 -12.724 11.213 1.00 51.40 O ATOM 857 CB ASN A 55 12.144 -14.719 12.966 1.00 45.13 C ATOM 858 CG ASN A 55 12.056 -15.299 14.364 1.00 4.53 C ATOM 859 OD1 ASN A 55 11.007 -15.244 15.006 1.00 61.11 O ATOM 860 ND2 ASN A 55 13.162 -15.857 14.844 1.00 74.23 N ATOM 0 H ASN A 55 11.227 -16.400 10.764 1.00 42.31 H new ATOM 0 HA ASN A 55 9.997 -14.733 12.842 1.00 5.23 H new ATOM 0 HB2 ASN A 55 12.962 -15.198 12.428 1.00 45.13 H new ATOM 0 HB3 ASN A 55 12.383 -13.658 13.030 1.00 45.13 H new ATOM 0 HD21 ASN A 55 13.164 -16.262 15.780 1.00 74.23 H new ATOM 0 HD22 ASN A 55 14.009 -15.880 14.276 1.00 74.23 H new ATOM 867 N GLY A 56 10.272 -14.307 9.895 1.00 13.45 N ATOM 868 CA GLY A 56 10.162 -13.417 8.754 1.00 34.11 C ATOM 869 C GLY A 56 11.498 -12.830 8.345 1.00 21.43 C ATOM 870 O GLY A 56 11.567 -11.693 7.878 1.00 22.12 O ATOM 0 H GLY A 56 9.936 -15.256 9.732 1.00 13.45 H new ATOM 0 HA2 GLY A 56 9.735 -13.962 7.912 1.00 34.11 H new ATOM 0 HA3 GLY A 56 9.471 -12.608 8.993 1.00 34.11 H new ATOM 874 N ILE A 57 12.562 -13.606 8.522 1.00 21.34 N ATOM 875 CA ILE A 57 13.903 -13.156 8.169 1.00 74.11 C ATOM 876 C ILE A 57 14.360 -13.772 6.851 1.00 31.42 C ATOM 877 O ILE A 57 13.961 -14.884 6.502 1.00 64.32 O ATOM 878 CB ILE A 57 14.923 -13.507 9.268 1.00 35.12 C ATOM 879 CG1 ILE A 57 16.271 -12.848 8.972 1.00 23.21 C ATOM 880 CG2 ILE A 57 15.078 -15.016 9.384 1.00 21.01 C ATOM 881 CD1 ILE A 57 16.189 -11.346 8.817 1.00 12.20 C ATOM 0 H ILE A 57 12.522 -14.549 8.908 1.00 21.34 H new ATOM 0 HA ILE A 57 13.854 -12.072 8.064 1.00 74.11 H new ATOM 0 HB ILE A 57 14.555 -13.125 10.220 1.00 35.12 H new ATOM 0 HG12 ILE A 57 16.966 -13.084 9.777 1.00 23.21 H new ATOM 0 HG13 ILE A 57 16.683 -13.277 8.059 1.00 23.21 H new ATOM 0 HG21 ILE A 57 15.802 -15.248 10.165 1.00 21.01 H new ATOM 0 HG22 ILE A 57 14.116 -15.462 9.637 1.00 21.01 H new ATOM 0 HG23 ILE A 57 15.427 -15.420 8.434 1.00 21.01 H new ATOM 0 HD11 ILE A 57 17.182 -10.947 8.609 1.00 12.20 H new ATOM 0 HD12 ILE A 57 15.519 -11.101 7.993 1.00 12.20 H new ATOM 0 HD13 ILE A 57 15.807 -10.906 9.738 1.00 12.20 H new ATOM 893 N LEU A 58 15.200 -13.044 6.124 1.00 20.31 N ATOM 894 CA LEU A 58 15.714 -13.520 4.844 1.00 4.15 C ATOM 895 C LEU A 58 17.085 -14.167 5.015 1.00 2.11 C ATOM 896 O LEU A 58 18.011 -13.554 5.547 1.00 51.52 O ATOM 897 CB LEU A 58 15.804 -12.364 3.847 1.00 2.40 C ATOM 898 CG LEU A 58 15.265 -12.644 2.444 1.00 14.01 C ATOM 899 CD1 LEU A 58 16.111 -13.698 1.747 1.00 5.42 C ATOM 900 CD2 LEU A 58 13.810 -13.085 2.510 1.00 13.15 C ATOM 0 H LEU A 58 15.540 -12.122 6.398 1.00 20.31 H new ATOM 0 HA LEU A 58 15.024 -14.271 4.459 1.00 4.15 H new ATOM 0 HB2 LEU A 58 15.263 -11.512 4.259 1.00 2.40 H new ATOM 0 HB3 LEU A 58 16.849 -12.066 3.760 1.00 2.40 H new ATOM 0 HG LEU A 58 15.319 -11.722 1.865 1.00 14.01 H new ATOM 0 HD11 LEU A 58 15.712 -13.884 0.750 1.00 5.42 H new ATOM 0 HD12 LEU A 58 17.139 -13.345 1.666 1.00 5.42 H new ATOM 0 HD13 LEU A 58 16.089 -14.622 2.325 1.00 5.42 H new ATOM 0 HD21 LEU A 58 13.443 -13.280 1.502 1.00 13.15 H new ATOM 0 HD22 LEU A 58 13.732 -13.994 3.107 1.00 13.15 H new ATOM 0 HD23 LEU A 58 13.212 -12.298 2.968 1.00 13.15 H new ATOM 912 N PHE A 59 17.208 -15.409 4.559 1.00 45.22 N ATOM 913 CA PHE A 59 18.467 -16.139 4.660 1.00 73.03 C ATOM 914 C PHE A 59 18.901 -16.666 3.295 1.00 53.10 C ATOM 915 O PHE A 59 18.073 -16.891 2.412 1.00 41.01 O ATOM 916 CB PHE A 59 18.329 -17.300 5.647 1.00 45.20 C ATOM 917 CG PHE A 59 17.522 -18.448 5.113 1.00 21.43 C ATOM 918 CD1 PHE A 59 16.139 -18.382 5.077 1.00 74.04 C ATOM 919 CD2 PHE A 59 18.147 -19.595 4.649 1.00 54.21 C ATOM 920 CE1 PHE A 59 15.393 -19.437 4.586 1.00 74.12 C ATOM 921 CE2 PHE A 59 17.406 -20.653 4.157 1.00 51.34 C ATOM 922 CZ PHE A 59 16.027 -20.574 4.126 1.00 22.31 C ATOM 0 H PHE A 59 16.452 -15.931 4.116 1.00 45.22 H new ATOM 0 HA PHE A 59 19.230 -15.450 5.023 1.00 73.03 H new ATOM 0 HB2 PHE A 59 19.323 -17.659 5.915 1.00 45.20 H new ATOM 0 HB3 PHE A 59 17.864 -16.935 6.563 1.00 45.20 H new ATOM 0 HD1 PHE A 59 15.638 -17.496 5.437 1.00 74.04 H new ATOM 0 HD2 PHE A 59 19.225 -19.663 4.672 1.00 54.21 H new ATOM 0 HE1 PHE A 59 14.315 -19.372 4.562 1.00 74.12 H new ATOM 0 HE2 PHE A 59 17.905 -21.541 3.797 1.00 51.34 H new ATOM 0 HZ PHE A 59 15.446 -21.400 3.743 1.00 22.31 H new ATOM 932 N VAL A 60 20.205 -16.860 3.130 1.00 44.23 N ATOM 933 CA VAL A 60 20.751 -17.361 1.874 1.00 52.53 C ATOM 934 C VAL A 60 20.219 -18.755 1.561 1.00 42.33 C ATOM 935 O VAL A 60 20.041 -19.578 2.457 1.00 2.25 O ATOM 936 CB VAL A 60 22.290 -17.406 1.909 1.00 50.24 C ATOM 937 CG1 VAL A 60 22.835 -18.036 0.636 1.00 32.20 C ATOM 938 CG2 VAL A 60 22.859 -16.009 2.108 1.00 63.24 C ATOM 0 H VAL A 60 20.904 -16.678 3.850 1.00 44.23 H new ATOM 0 HA VAL A 60 20.433 -16.670 1.093 1.00 52.53 H new ATOM 0 HB VAL A 60 22.599 -18.023 2.752 1.00 50.24 H new ATOM 0 HG11 VAL A 60 23.924 -18.059 0.679 1.00 32.20 H new ATOM 0 HG12 VAL A 60 22.454 -19.053 0.541 1.00 32.20 H new ATOM 0 HG13 VAL A 60 22.518 -17.448 -0.225 1.00 32.20 H new ATOM 0 HG21 VAL A 60 23.948 -16.059 2.130 1.00 63.24 H new ATOM 0 HG22 VAL A 60 22.542 -15.367 1.286 1.00 63.24 H new ATOM 0 HG23 VAL A 60 22.495 -15.599 3.050 1.00 63.24 H new ATOM 948 N ASN A 61 19.968 -19.013 0.281 1.00 10.24 N ATOM 949 CA ASN A 61 19.456 -20.308 -0.151 1.00 24.42 C ATOM 950 C ASN A 61 20.126 -20.753 -1.447 1.00 45.24 C ATOM 951 O ASN A 61 19.565 -21.539 -2.211 1.00 1.43 O ATOM 952 CB ASN A 61 17.940 -20.243 -0.344 1.00 0.33 C ATOM 953 CG ASN A 61 17.311 -21.618 -0.452 1.00 71.32 C ATOM 954 OD1 ASN A 61 16.597 -21.913 -1.411 1.00 43.22 O ATOM 955 ND2 ASN A 61 17.573 -22.468 0.534 1.00 63.11 N ATOM 0 H ASN A 61 20.111 -18.343 -0.474 1.00 10.24 H new ATOM 0 HA ASN A 61 19.685 -21.038 0.625 1.00 24.42 H new ATOM 0 HB2 ASN A 61 17.493 -19.707 0.493 1.00 0.33 H new ATOM 0 HB3 ASN A 61 17.715 -19.672 -1.245 1.00 0.33 H new ATOM 0 HD21 ASN A 61 17.177 -23.408 0.516 1.00 63.11 H new ATOM 0 HD22 ASN A 61 18.170 -22.181 1.310 1.00 63.11 H new ATOM 962 N SER A 62 21.331 -20.245 -1.689 1.00 53.42 N ATOM 963 CA SER A 62 22.077 -20.586 -2.895 1.00 34.23 C ATOM 964 C SER A 62 23.443 -19.908 -2.898 1.00 64.32 C ATOM 965 O SER A 62 23.868 -19.337 -1.894 1.00 33.24 O ATOM 966 CB SER A 62 21.289 -20.177 -4.141 1.00 34.24 C ATOM 967 OG SER A 62 21.429 -21.139 -5.172 1.00 22.24 O ATOM 0 H SER A 62 21.811 -19.596 -1.066 1.00 53.42 H new ATOM 0 HA SER A 62 22.226 -21.666 -2.907 1.00 34.23 H new ATOM 0 HB2 SER A 62 20.235 -20.062 -3.887 1.00 34.24 H new ATOM 0 HB3 SER A 62 21.639 -19.207 -4.494 1.00 34.24 H new ATOM 0 HG SER A 62 20.677 -21.062 -5.796 1.00 22.24 H new ATOM 973 N ARG A 63 24.128 -19.976 -4.036 1.00 34.34 N ATOM 974 CA ARG A 63 25.447 -19.371 -4.171 1.00 11.22 C ATOM 975 C ARG A 63 25.332 -17.879 -4.472 1.00 23.31 C ATOM 976 O ARG A 63 24.788 -17.485 -5.503 1.00 55.53 O ATOM 977 CB ARG A 63 26.239 -20.066 -5.279 1.00 65.32 C ATOM 978 CG ARG A 63 26.179 -21.584 -5.211 1.00 52.51 C ATOM 979 CD ARG A 63 25.138 -22.143 -6.168 1.00 14.11 C ATOM 980 NE ARG A 63 24.390 -23.249 -5.577 1.00 34.31 N ATOM 981 CZ ARG A 63 24.906 -24.455 -5.364 1.00 54.34 C ATOM 982 NH1 ARG A 63 26.165 -24.708 -5.692 1.00 41.44 N ATOM 983 NH2 ARG A 63 24.161 -25.410 -4.822 1.00 64.11 N ATOM 0 H ARG A 63 23.791 -20.444 -4.877 1.00 34.34 H new ATOM 0 HA ARG A 63 25.974 -19.494 -3.225 1.00 11.22 H new ATOM 0 HB2 ARG A 63 25.858 -19.739 -6.246 1.00 65.32 H new ATOM 0 HB3 ARG A 63 27.280 -19.749 -5.223 1.00 65.32 H new ATOM 0 HG2 ARG A 63 27.157 -21.999 -5.453 1.00 52.51 H new ATOM 0 HG3 ARG A 63 25.943 -21.895 -4.193 1.00 52.51 H new ATOM 0 HD2 ARG A 63 24.447 -21.351 -6.455 1.00 14.11 H new ATOM 0 HD3 ARG A 63 25.629 -22.484 -7.080 1.00 14.11 H new ATOM 0 HE ARG A 63 23.418 -23.087 -5.313 1.00 34.31 H new ATOM 0 HH11 ARG A 63 26.740 -23.976 -6.109 1.00 41.44 H new ATOM 0 HH12 ARG A 63 26.559 -25.635 -5.527 1.00 41.44 H new ATOM 0 HH21 ARG A 63 23.192 -25.219 -4.569 1.00 64.11 H new ATOM 0 HH22 ARG A 63 24.558 -26.335 -4.659 1.00 64.11 H new ATOM 997 N ILE A 64 25.848 -17.057 -3.565 1.00 43.41 N ATOM 998 CA ILE A 64 25.804 -15.610 -3.734 1.00 43.43 C ATOM 999 C ILE A 64 27.188 -15.050 -4.048 1.00 72.40 C ATOM 1000 O ILE A 64 27.319 -13.924 -4.526 1.00 44.34 O ATOM 1001 CB ILE A 64 25.254 -14.912 -2.476 1.00 62.11 C ATOM 1002 CG1 ILE A 64 24.796 -13.492 -2.813 1.00 2.41 C ATOM 1003 CG2 ILE A 64 26.309 -14.889 -1.380 1.00 12.51 C ATOM 1004 CD1 ILE A 64 23.326 -13.396 -3.154 1.00 54.12 C ATOM 0 H ILE A 64 26.301 -17.368 -2.706 1.00 43.41 H new ATOM 0 HA ILE A 64 25.135 -15.411 -4.572 1.00 43.43 H new ATOM 0 HB ILE A 64 24.393 -15.474 -2.113 1.00 62.11 H new ATOM 0 HG12 ILE A 64 25.007 -12.840 -1.965 1.00 2.41 H new ATOM 0 HG13 ILE A 64 25.381 -13.120 -3.654 1.00 2.41 H new ATOM 0 HG21 ILE A 64 25.906 -14.393 -0.497 1.00 12.51 H new ATOM 0 HG22 ILE A 64 26.591 -15.911 -1.125 1.00 12.51 H new ATOM 0 HG23 ILE A 64 27.187 -14.347 -1.732 1.00 12.51 H new ATOM 0 HD11 ILE A 64 23.072 -12.361 -3.382 1.00 54.12 H new ATOM 0 HD12 ILE A 64 23.112 -14.021 -4.021 1.00 54.12 H new ATOM 0 HD13 ILE A 64 22.733 -13.737 -2.305 1.00 54.12 H new ATOM 1016 N ASP A 65 28.217 -15.846 -3.777 1.00 54.11 N ATOM 1017 CA ASP A 65 29.591 -15.432 -4.033 1.00 63.12 C ATOM 1018 C ASP A 65 29.747 -14.917 -5.461 1.00 32.23 C ATOM 1019 O ASP A 65 29.081 -15.395 -6.379 1.00 62.34 O ATOM 1020 CB ASP A 65 30.551 -16.598 -3.791 1.00 60.10 C ATOM 1021 CG ASP A 65 30.010 -17.912 -4.319 1.00 62.31 C ATOM 1022 OD1 ASP A 65 29.170 -18.529 -3.630 1.00 5.42 O ATOM 1023 OD2 ASP A 65 30.426 -18.324 -5.422 1.00 70.11 O ATOM 0 H ASP A 65 28.125 -16.781 -3.380 1.00 54.11 H new ATOM 0 HA ASP A 65 29.834 -14.622 -3.345 1.00 63.12 H new ATOM 0 HB2 ASP A 65 31.507 -16.383 -4.269 1.00 60.10 H new ATOM 0 HB3 ASP A 65 30.743 -16.691 -2.722 1.00 60.10 H new ATOM 1028 N ARG A 66 30.629 -13.939 -5.639 1.00 20.32 N ATOM 1029 CA ARG A 66 30.870 -13.358 -6.954 1.00 1.11 C ATOM 1030 C ARG A 66 31.112 -14.448 -7.994 1.00 41.21 C ATOM 1031 O ARG A 66 30.779 -14.284 -9.167 1.00 53.11 O ATOM 1032 CB ARG A 66 32.070 -12.410 -6.904 1.00 31.21 C ATOM 1033 CG ARG A 66 33.247 -12.959 -6.113 1.00 53.45 C ATOM 1034 CD ARG A 66 34.490 -12.102 -6.299 1.00 34.44 C ATOM 1035 NE ARG A 66 34.970 -12.126 -7.678 1.00 1.14 N ATOM 1036 CZ ARG A 66 36.197 -11.763 -8.035 1.00 21.44 C ATOM 1037 NH1 ARG A 66 37.063 -11.352 -7.119 1.00 2.11 N ATOM 1038 NH2 ARG A 66 36.560 -11.812 -9.310 1.00 21.40 N ATOM 0 H ARG A 66 31.188 -13.532 -4.889 1.00 20.32 H new ATOM 0 HA ARG A 66 29.983 -12.795 -7.243 1.00 1.11 H new ATOM 0 HB2 ARG A 66 32.396 -12.195 -7.922 1.00 31.21 H new ATOM 0 HB3 ARG A 66 31.757 -11.464 -6.463 1.00 31.21 H new ATOM 0 HG2 ARG A 66 32.988 -13.002 -5.055 1.00 53.45 H new ATOM 0 HG3 ARG A 66 33.456 -13.980 -6.431 1.00 53.45 H new ATOM 0 HD2 ARG A 66 34.268 -11.075 -6.010 1.00 34.44 H new ATOM 0 HD3 ARG A 66 35.278 -12.457 -5.635 1.00 34.44 H new ATOM 0 HE ARG A 66 34.328 -12.438 -8.407 1.00 1.14 H new ATOM 0 HH11 ARG A 66 36.788 -11.314 -6.138 1.00 2.11 H new ATOM 0 HH12 ARG A 66 38.005 -11.074 -7.396 1.00 2.11 H new ATOM 0 HH21 ARG A 66 35.897 -12.129 -10.017 1.00 21.40 H new ATOM 0 HH22 ARG A 66 37.502 -11.533 -9.583 1.00 21.40 H new ATOM 1052 N GLU A 67 31.695 -15.559 -7.555 1.00 34.12 N ATOM 1053 CA GLU A 67 31.982 -16.675 -8.449 1.00 2.32 C ATOM 1054 C GLU A 67 30.709 -17.166 -9.132 1.00 65.23 C ATOM 1055 O GLU A 67 30.644 -17.249 -10.358 1.00 61.02 O ATOM 1056 CB GLU A 67 32.634 -17.822 -7.675 1.00 24.31 C ATOM 1057 CG GLU A 67 33.979 -18.249 -8.238 1.00 63.43 C ATOM 1058 CD GLU A 67 34.489 -19.536 -7.619 1.00 24.03 C ATOM 1059 OE1 GLU A 67 33.660 -20.326 -7.122 1.00 15.54 O ATOM 1060 OE2 GLU A 67 35.719 -19.753 -7.632 1.00 23.14 O ATOM 0 H GLU A 67 31.978 -15.710 -6.587 1.00 34.12 H new ATOM 0 HA GLU A 67 32.673 -16.325 -9.216 1.00 2.32 H new ATOM 0 HB2 GLU A 67 32.764 -17.520 -6.636 1.00 24.31 H new ATOM 0 HB3 GLU A 67 31.960 -18.679 -7.676 1.00 24.31 H new ATOM 0 HG2 GLU A 67 33.892 -18.379 -9.317 1.00 63.43 H new ATOM 0 HG3 GLU A 67 34.707 -17.456 -8.070 1.00 63.43 H new ATOM 1067 N GLU A 68 29.701 -17.491 -8.329 1.00 62.42 N ATOM 1068 CA GLU A 68 28.431 -17.976 -8.857 1.00 22.23 C ATOM 1069 C GLU A 68 27.544 -16.814 -9.293 1.00 41.13 C ATOM 1070 O GLU A 68 27.008 -16.810 -10.402 1.00 53.41 O ATOM 1071 CB GLU A 68 27.706 -18.819 -7.806 1.00 34.21 C ATOM 1072 CG GLU A 68 27.727 -20.310 -8.100 1.00 43.33 C ATOM 1073 CD GLU A 68 28.903 -21.015 -7.452 1.00 75.31 C ATOM 1074 OE1 GLU A 68 29.932 -20.351 -7.210 1.00 63.41 O ATOM 1075 OE2 GLU A 68 28.793 -22.231 -7.187 1.00 50.41 O ATOM 0 H GLU A 68 29.739 -17.427 -7.312 1.00 62.42 H new ATOM 0 HA GLU A 68 28.642 -18.596 -9.728 1.00 22.23 H new ATOM 0 HB2 GLU A 68 28.164 -18.643 -6.833 1.00 34.21 H new ATOM 0 HB3 GLU A 68 26.671 -18.486 -7.736 1.00 34.21 H new ATOM 0 HG2 GLU A 68 26.799 -20.759 -7.747 1.00 43.33 H new ATOM 0 HG3 GLU A 68 27.765 -20.464 -9.178 1.00 43.33 H new ATOM 1082 N LEU A 69 27.394 -15.830 -8.414 1.00 14.31 N ATOM 1083 CA LEU A 69 26.571 -14.661 -8.707 1.00 2.12 C ATOM 1084 C LEU A 69 26.880 -14.112 -10.096 1.00 72.43 C ATOM 1085 O LEU A 69 26.073 -14.237 -11.018 1.00 60.41 O ATOM 1086 CB LEU A 69 26.801 -13.575 -7.655 1.00 13.44 C ATOM 1087 CG LEU A 69 25.551 -12.850 -7.155 1.00 13.52 C ATOM 1088 CD1 LEU A 69 24.902 -12.064 -8.284 1.00 33.21 C ATOM 1089 CD2 LEU A 69 24.563 -13.840 -6.556 1.00 23.25 C ATOM 0 H LEU A 69 27.831 -15.818 -7.493 1.00 14.31 H new ATOM 0 HA LEU A 69 25.525 -14.968 -8.682 1.00 2.12 H new ATOM 0 HB2 LEU A 69 27.302 -14.027 -6.799 1.00 13.44 H new ATOM 0 HB3 LEU A 69 27.485 -12.834 -8.070 1.00 13.44 H new ATOM 0 HG LEU A 69 25.849 -12.149 -6.376 1.00 13.52 H new ATOM 0 HD11 LEU A 69 24.014 -11.555 -7.909 1.00 33.21 H new ATOM 0 HD12 LEU A 69 25.608 -11.327 -8.667 1.00 33.21 H new ATOM 0 HD13 LEU A 69 24.618 -12.746 -9.086 1.00 33.21 H new ATOM 0 HD21 LEU A 69 23.680 -13.306 -6.206 1.00 23.25 H new ATOM 0 HD22 LEU A 69 24.271 -14.566 -7.314 1.00 23.25 H new ATOM 0 HD23 LEU A 69 25.030 -14.358 -5.718 1.00 23.25 H new ATOM 1101 N CYS A 70 28.053 -13.506 -10.240 1.00 64.11 N ATOM 1102 CA CYS A 70 28.471 -12.940 -11.517 1.00 14.40 C ATOM 1103 C CYS A 70 29.977 -12.699 -11.539 1.00 4.01 C ATOM 1104 O CYS A 70 30.679 -13.169 -12.434 1.00 12.22 O ATOM 1105 CB CYS A 70 27.730 -11.628 -11.783 1.00 53.13 C ATOM 1106 SG CYS A 70 27.352 -10.669 -10.281 1.00 71.11 S ATOM 0 H CYS A 70 28.732 -13.394 -9.487 1.00 64.11 H new ATOM 0 HA CYS A 70 28.224 -13.656 -12.301 1.00 14.40 H new ATOM 0 HB2 CYS A 70 28.332 -11.013 -12.452 1.00 53.13 H new ATOM 0 HB3 CYS A 70 26.798 -11.849 -12.304 1.00 53.13 H new ATOM 1111 N GLY A 71 30.468 -11.963 -10.546 1.00 62.21 N ATOM 1112 CA GLY A 71 31.888 -11.673 -10.470 1.00 1.13 C ATOM 1113 C GLY A 71 32.370 -10.828 -11.632 1.00 65.23 C ATOM 1114 O GLY A 71 33.574 -10.707 -11.863 1.00 73.21 O ATOM 0 H GLY A 71 29.908 -11.563 -9.793 1.00 62.21 H new ATOM 0 HA2 GLY A 71 32.100 -11.154 -9.535 1.00 1.13 H new ATOM 0 HA3 GLY A 71 32.446 -12.609 -10.449 1.00 1.13 H new ATOM 1118 N ARG A 72 31.430 -10.244 -12.367 1.00 41.24 N ATOM 1119 CA ARG A 72 31.766 -9.409 -13.514 1.00 51.42 C ATOM 1120 C ARG A 72 32.285 -8.047 -13.062 1.00 1.02 C ATOM 1121 O ARG A 72 33.082 -7.414 -13.754 1.00 62.11 O ATOM 1122 CB ARG A 72 30.543 -9.226 -14.415 1.00 31.41 C ATOM 1123 CG ARG A 72 30.195 -10.463 -15.227 1.00 71.21 C ATOM 1124 CD ARG A 72 29.178 -10.149 -16.313 1.00 41.51 C ATOM 1125 NE ARG A 72 28.603 -11.360 -16.892 1.00 12.32 N ATOM 1126 CZ ARG A 72 29.262 -12.165 -17.718 1.00 3.54 C ATOM 1127 NH1 ARG A 72 30.513 -11.888 -18.059 1.00 62.44 N ATOM 1128 NH2 ARG A 72 28.671 -13.249 -18.203 1.00 14.41 N ATOM 0 H ARG A 72 30.430 -10.333 -12.189 1.00 41.24 H new ATOM 0 HA ARG A 72 32.553 -9.910 -14.078 1.00 51.42 H new ATOM 0 HB2 ARG A 72 29.686 -8.953 -13.799 1.00 31.41 H new ATOM 0 HB3 ARG A 72 30.725 -8.394 -15.095 1.00 31.41 H new ATOM 0 HG2 ARG A 72 31.100 -10.868 -15.680 1.00 71.21 H new ATOM 0 HG3 ARG A 72 29.797 -11.233 -14.566 1.00 71.21 H new ATOM 0 HD2 ARG A 72 28.381 -9.533 -15.896 1.00 41.51 H new ATOM 0 HD3 ARG A 72 29.656 -9.563 -17.098 1.00 41.51 H new ATOM 0 HE ARG A 72 27.642 -11.601 -16.649 1.00 12.32 H new ATOM 0 HH11 ARG A 72 30.971 -11.056 -17.687 1.00 62.44 H new ATOM 0 HH12 ARG A 72 31.018 -12.507 -18.693 1.00 62.44 H new ATOM 0 HH21 ARG A 72 27.709 -13.465 -17.942 1.00 14.41 H new ATOM 0 HH22 ARG A 72 29.178 -13.866 -18.837 1.00 14.41 H new ATOM 1142 N SER A 73 31.827 -7.602 -11.896 1.00 21.31 N ATOM 1143 CA SER A 73 32.242 -6.314 -11.353 1.00 33.00 C ATOM 1144 C SER A 73 32.074 -6.284 -9.837 1.00 23.32 C ATOM 1145 O SER A 73 31.279 -7.036 -9.274 1.00 54.14 O ATOM 1146 CB SER A 73 31.430 -5.184 -11.989 1.00 45.42 C ATOM 1147 OG SER A 73 32.131 -3.954 -11.923 1.00 12.51 O ATOM 0 H SER A 73 31.168 -8.115 -11.309 1.00 21.31 H new ATOM 0 HA SER A 73 33.297 -6.171 -11.587 1.00 33.00 H new ATOM 0 HB2 SER A 73 31.214 -5.428 -13.029 1.00 45.42 H new ATOM 0 HB3 SER A 73 30.472 -5.088 -11.478 1.00 45.42 H new ATOM 0 HG SER A 73 31.592 -3.248 -12.337 1.00 12.51 H new ATOM 1153 N ALA A 74 32.831 -5.410 -9.181 1.00 53.14 N ATOM 1154 CA ALA A 74 32.766 -5.280 -7.731 1.00 54.41 C ATOM 1155 C ALA A 74 31.328 -5.085 -7.261 1.00 51.44 C ATOM 1156 O ALA A 74 30.900 -5.689 -6.279 1.00 13.44 O ATOM 1157 CB ALA A 74 33.637 -4.122 -7.266 1.00 35.15 C ATOM 0 H ALA A 74 33.496 -4.782 -9.631 1.00 53.14 H new ATOM 0 HA ALA A 74 33.142 -6.203 -7.291 1.00 54.41 H new ATOM 0 HB1 ALA A 74 33.579 -4.036 -6.181 1.00 35.15 H new ATOM 0 HB2 ALA A 74 34.671 -4.303 -7.561 1.00 35.15 H new ATOM 0 HB3 ALA A 74 33.286 -3.197 -7.722 1.00 35.15 H new ATOM 1163 N GLU A 75 30.588 -4.237 -7.970 1.00 25.00 N ATOM 1164 CA GLU A 75 29.199 -3.962 -7.623 1.00 61.21 C ATOM 1165 C GLU A 75 28.248 -4.711 -8.552 1.00 50.24 C ATOM 1166 O GLU A 75 28.052 -4.321 -9.704 1.00 64.52 O ATOM 1167 CB GLU A 75 28.920 -2.459 -7.693 1.00 64.32 C ATOM 1168 CG GLU A 75 28.111 -1.935 -6.519 1.00 54.03 C ATOM 1169 CD GLU A 75 28.277 -0.441 -6.317 1.00 35.41 C ATOM 1170 OE1 GLU A 75 27.531 0.330 -6.957 1.00 30.23 O ATOM 1171 OE2 GLU A 75 29.151 -0.044 -5.520 1.00 3.35 O ATOM 0 H GLU A 75 30.927 -3.730 -8.787 1.00 25.00 H new ATOM 0 HA GLU A 75 29.031 -4.308 -6.603 1.00 61.21 H new ATOM 0 HB2 GLU A 75 29.868 -1.924 -7.738 1.00 64.32 H new ATOM 0 HB3 GLU A 75 28.386 -2.240 -8.618 1.00 64.32 H new ATOM 0 HG2 GLU A 75 27.057 -2.161 -6.679 1.00 54.03 H new ATOM 0 HG3 GLU A 75 28.415 -2.457 -5.611 1.00 54.03 H new ATOM 1178 N CYS A 76 27.659 -5.788 -8.044 1.00 23.11 N ATOM 1179 CA CYS A 76 26.729 -6.593 -8.826 1.00 64.35 C ATOM 1180 C CYS A 76 25.323 -6.526 -8.238 1.00 41.11 C ATOM 1181 O CYS A 76 25.119 -6.806 -7.057 1.00 70.10 O ATOM 1182 CB CYS A 76 27.202 -8.047 -8.881 1.00 62.30 C ATOM 1183 SG CYS A 76 27.327 -8.726 -10.567 1.00 44.31 S ATOM 0 H CYS A 76 27.810 -6.124 -7.093 1.00 23.11 H new ATOM 0 HA CYS A 76 26.700 -6.189 -9.838 1.00 64.35 H new ATOM 0 HB2 CYS A 76 28.177 -8.119 -8.399 1.00 62.30 H new ATOM 0 HB3 CYS A 76 26.514 -8.664 -8.303 1.00 62.30 H new ATOM 1188 N SER A 77 24.357 -6.152 -9.071 1.00 34.43 N ATOM 1189 CA SER A 77 22.970 -6.045 -8.633 1.00 12.41 C ATOM 1190 C SER A 77 22.189 -7.307 -8.985 1.00 61.13 C ATOM 1191 O SER A 77 22.518 -8.005 -9.945 1.00 33.52 O ATOM 1192 CB SER A 77 22.304 -4.825 -9.273 1.00 3.43 C ATOM 1193 OG SER A 77 22.812 -3.621 -8.725 1.00 2.45 O ATOM 0 H SER A 77 24.509 -5.918 -10.052 1.00 34.43 H new ATOM 0 HA SER A 77 22.966 -5.927 -7.549 1.00 12.41 H new ATOM 0 HB2 SER A 77 22.473 -4.838 -10.350 1.00 3.43 H new ATOM 0 HB3 SER A 77 21.226 -4.872 -9.119 1.00 3.43 H new ATOM 0 HG SER A 77 22.372 -2.856 -9.151 1.00 2.45 H new ATOM 1199 N ILE A 78 21.154 -7.593 -8.202 1.00 65.13 N ATOM 1200 CA ILE A 78 20.326 -8.770 -8.431 1.00 61.35 C ATOM 1201 C ILE A 78 18.845 -8.437 -8.287 1.00 41.11 C ATOM 1202 O ILE A 78 18.453 -7.670 -7.407 1.00 1.01 O ATOM 1203 CB ILE A 78 20.682 -9.908 -7.456 1.00 41.22 C ATOM 1204 CG1 ILE A 78 22.165 -10.265 -7.574 1.00 42.04 C ATOM 1205 CG2 ILE A 78 19.815 -11.128 -7.726 1.00 74.14 C ATOM 1206 CD1 ILE A 78 23.012 -9.709 -6.451 1.00 40.22 C ATOM 0 H ILE A 78 20.869 -7.026 -7.404 1.00 65.13 H new ATOM 0 HA ILE A 78 20.524 -9.101 -9.450 1.00 61.35 H new ATOM 0 HB ILE A 78 20.489 -9.568 -6.439 1.00 41.22 H new ATOM 0 HG12 ILE A 78 22.269 -11.350 -7.593 1.00 42.04 H new ATOM 0 HG13 ILE A 78 22.546 -9.891 -8.525 1.00 42.04 H new ATOM 0 HG21 ILE A 78 20.079 -11.923 -7.029 1.00 74.14 H new ATOM 0 HG22 ILE A 78 18.765 -10.865 -7.596 1.00 74.14 H new ATOM 0 HG23 ILE A 78 19.979 -11.472 -8.747 1.00 74.14 H new ATOM 0 HD11 ILE A 78 24.051 -10.002 -6.600 1.00 40.22 H new ATOM 0 HD12 ILE A 78 22.939 -8.621 -6.444 1.00 40.22 H new ATOM 0 HD13 ILE A 78 22.657 -10.103 -5.498 1.00 40.22 H new ATOM 1218 N HIS A 79 18.025 -9.020 -9.156 1.00 44.44 N ATOM 1219 CA HIS A 79 16.586 -8.786 -9.125 1.00 31.35 C ATOM 1220 C HIS A 79 15.842 -10.041 -8.677 1.00 10.23 C ATOM 1221 O HIS A 79 16.212 -11.158 -9.040 1.00 44.11 O ATOM 1222 CB HIS A 79 16.088 -8.349 -10.502 1.00 43.34 C ATOM 1223 CG HIS A 79 16.952 -7.310 -11.149 1.00 12.42 C ATOM 1224 ND1 HIS A 79 17.661 -7.536 -12.310 1.00 32.14 N ATOM 1225 CD2 HIS A 79 17.217 -6.031 -10.791 1.00 70.32 C ATOM 1226 CE1 HIS A 79 18.326 -6.443 -12.637 1.00 1.20 C ATOM 1227 NE2 HIS A 79 18.074 -5.515 -11.732 1.00 15.41 N ATOM 0 H HIS A 79 18.333 -9.658 -9.890 1.00 44.44 H new ATOM 0 HA HIS A 79 16.388 -7.990 -8.407 1.00 31.35 H new ATOM 0 HB2 HIS A 79 16.033 -9.221 -11.153 1.00 43.34 H new ATOM 0 HB3 HIS A 79 15.075 -7.959 -10.406 1.00 43.34 H new ATOM 0 HD2 HIS A 79 16.827 -5.513 -9.927 1.00 70.32 H new ATOM 0 HE1 HIS A 79 18.967 -6.328 -13.498 1.00 1.20 H new ATOM 0 HE2 HIS A 79 18.454 -4.568 -11.732 1.00 15.41 H new ATOM 1235 N LEU A 80 14.792 -9.849 -7.886 1.00 21.34 N ATOM 1236 CA LEU A 80 13.996 -10.966 -7.387 1.00 51.53 C ATOM 1237 C LEU A 80 12.513 -10.608 -7.362 1.00 62.53 C ATOM 1238 O LEU A 80 12.149 -9.435 -7.302 1.00 41.45 O ATOM 1239 CB LEU A 80 14.460 -11.363 -5.985 1.00 2.20 C ATOM 1240 CG LEU A 80 13.708 -12.523 -5.333 1.00 21.44 C ATOM 1241 CD1 LEU A 80 14.640 -13.330 -4.443 1.00 24.55 C ATOM 1242 CD2 LEU A 80 12.520 -12.007 -4.534 1.00 72.33 C ATOM 0 H LEU A 80 14.472 -8.931 -7.576 1.00 21.34 H new ATOM 0 HA LEU A 80 14.136 -11.811 -8.062 1.00 51.53 H new ATOM 0 HB2 LEU A 80 15.517 -11.624 -6.034 1.00 2.20 H new ATOM 0 HB3 LEU A 80 14.376 -10.491 -5.336 1.00 2.20 H new ATOM 0 HG LEU A 80 13.334 -13.177 -6.121 1.00 21.44 H new ATOM 0 HD11 LEU A 80 14.087 -14.151 -3.987 1.00 24.55 H new ATOM 0 HD12 LEU A 80 15.458 -13.731 -5.042 1.00 24.55 H new ATOM 0 HD13 LEU A 80 15.044 -12.687 -3.661 1.00 24.55 H new ATOM 0 HD21 LEU A 80 11.997 -12.847 -4.077 1.00 72.33 H new ATOM 0 HD22 LEU A 80 12.872 -11.331 -3.755 1.00 72.33 H new ATOM 0 HD23 LEU A 80 11.840 -11.473 -5.197 1.00 72.33 H new ATOM 1254 N GLU A 81 11.663 -11.629 -7.407 1.00 30.55 N ATOM 1255 CA GLU A 81 10.220 -11.422 -7.387 1.00 73.24 C ATOM 1256 C GLU A 81 9.547 -12.367 -6.396 1.00 24.24 C ATOM 1257 O GLU A 81 9.548 -13.584 -6.582 1.00 71.14 O ATOM 1258 CB GLU A 81 9.634 -11.631 -8.785 1.00 74.03 C ATOM 1259 CG GLU A 81 9.357 -10.335 -9.529 1.00 63.33 C ATOM 1260 CD GLU A 81 9.281 -10.530 -11.031 1.00 41.22 C ATOM 1261 OE1 GLU A 81 10.114 -11.284 -11.575 1.00 44.24 O ATOM 1262 OE2 GLU A 81 8.387 -9.928 -11.662 1.00 42.51 O ATOM 0 H GLU A 81 11.949 -12.607 -7.458 1.00 30.55 H new ATOM 0 HA GLU A 81 10.031 -10.397 -7.070 1.00 73.24 H new ATOM 0 HB2 GLU A 81 10.324 -12.237 -9.372 1.00 74.03 H new ATOM 0 HB3 GLU A 81 8.706 -12.197 -8.700 1.00 74.03 H new ATOM 0 HG2 GLU A 81 8.418 -9.910 -9.174 1.00 63.33 H new ATOM 0 HG3 GLU A 81 10.141 -9.614 -9.299 1.00 63.33 H new ATOM 1269 N VAL A 82 8.975 -11.798 -5.340 1.00 12.13 N ATOM 1270 CA VAL A 82 8.298 -12.588 -4.318 1.00 63.01 C ATOM 1271 C VAL A 82 6.812 -12.728 -4.627 1.00 31.34 C ATOM 1272 O VAL A 82 6.048 -11.770 -4.500 1.00 65.41 O ATOM 1273 CB VAL A 82 8.465 -11.960 -2.921 1.00 75.34 C ATOM 1274 CG1 VAL A 82 8.091 -12.961 -1.838 1.00 42.23 C ATOM 1275 CG2 VAL A 82 9.888 -11.460 -2.729 1.00 1.22 C ATOM 0 H VAL A 82 8.967 -10.792 -5.170 1.00 12.13 H new ATOM 0 HA VAL A 82 8.761 -13.575 -4.322 1.00 63.01 H new ATOM 0 HB VAL A 82 7.791 -11.107 -2.842 1.00 75.34 H new ATOM 0 HG11 VAL A 82 8.215 -12.500 -0.858 1.00 42.23 H new ATOM 0 HG12 VAL A 82 7.052 -13.265 -1.967 1.00 42.23 H new ATOM 0 HG13 VAL A 82 8.737 -13.836 -1.912 1.00 42.23 H new ATOM 0 HG21 VAL A 82 9.988 -11.019 -1.737 1.00 1.22 H new ATOM 0 HG22 VAL A 82 10.583 -12.294 -2.828 1.00 1.22 H new ATOM 0 HG23 VAL A 82 10.114 -10.708 -3.485 1.00 1.22 H new ATOM 1285 N ILE A 83 6.408 -13.928 -5.031 1.00 51.32 N ATOM 1286 CA ILE A 83 5.012 -14.194 -5.356 1.00 41.41 C ATOM 1287 C ILE A 83 4.200 -14.481 -4.098 1.00 12.21 C ATOM 1288 O ILE A 83 4.605 -15.279 -3.253 1.00 4.23 O ATOM 1289 CB ILE A 83 4.876 -15.384 -6.324 1.00 43.20 C ATOM 1290 CG1 ILE A 83 3.402 -15.739 -6.527 1.00 11.14 C ATOM 1291 CG2 ILE A 83 5.649 -16.585 -5.799 1.00 14.35 C ATOM 1292 CD1 ILE A 83 2.915 -16.841 -5.612 1.00 73.12 C ATOM 0 H ILE A 83 7.027 -14.731 -5.141 1.00 51.32 H new ATOM 0 HA ILE A 83 4.624 -13.297 -5.839 1.00 41.41 H new ATOM 0 HB ILE A 83 5.297 -15.099 -7.288 1.00 43.20 H new ATOM 0 HG12 ILE A 83 2.796 -14.848 -6.364 1.00 11.14 H new ATOM 0 HG13 ILE A 83 3.249 -16.043 -7.562 1.00 11.14 H new ATOM 0 HG21 ILE A 83 5.543 -17.418 -6.494 1.00 14.35 H new ATOM 0 HG22 ILE A 83 6.703 -16.325 -5.702 1.00 14.35 H new ATOM 0 HG23 ILE A 83 5.255 -16.873 -4.824 1.00 14.35 H new ATOM 0 HD11 ILE A 83 1.862 -17.040 -5.811 1.00 73.12 H new ATOM 0 HD12 ILE A 83 3.496 -17.746 -5.791 1.00 73.12 H new ATOM 0 HD13 ILE A 83 3.036 -16.532 -4.574 1.00 73.12 H new ATOM 1304 N VAL A 84 3.049 -13.826 -3.981 1.00 10.03 N ATOM 1305 CA VAL A 84 2.177 -14.013 -2.827 1.00 41.21 C ATOM 1306 C VAL A 84 0.740 -14.277 -3.262 1.00 31.24 C ATOM 1307 O VAL A 84 0.239 -13.655 -4.199 1.00 4.04 O ATOM 1308 CB VAL A 84 2.203 -12.784 -1.899 1.00 24.01 C ATOM 1309 CG1 VAL A 84 3.526 -12.707 -1.152 1.00 21.23 C ATOM 1310 CG2 VAL A 84 1.956 -11.511 -2.694 1.00 11.11 C ATOM 0 H VAL A 84 2.699 -13.161 -4.671 1.00 10.03 H new ATOM 0 HA VAL A 84 2.554 -14.879 -2.282 1.00 41.21 H new ATOM 0 HB VAL A 84 1.404 -12.888 -1.165 1.00 24.01 H new ATOM 0 HG11 VAL A 84 3.526 -11.833 -0.501 1.00 21.23 H new ATOM 0 HG12 VAL A 84 3.657 -13.607 -0.551 1.00 21.23 H new ATOM 0 HG13 VAL A 84 4.344 -12.627 -1.868 1.00 21.23 H new ATOM 0 HG21 VAL A 84 1.978 -10.653 -2.023 1.00 11.11 H new ATOM 0 HG22 VAL A 84 2.732 -11.399 -3.452 1.00 11.11 H new ATOM 0 HG23 VAL A 84 0.981 -11.568 -3.178 1.00 11.11 H new ATOM 1320 N ASP A 85 0.081 -15.204 -2.574 1.00 40.35 N ATOM 1321 CA ASP A 85 -1.300 -15.550 -2.888 1.00 15.01 C ATOM 1322 C ASP A 85 -2.245 -15.056 -1.797 1.00 34.33 C ATOM 1323 O ASP A 85 -2.185 -15.514 -0.656 1.00 22.44 O ATOM 1324 CB ASP A 85 -1.443 -17.063 -3.057 1.00 75.34 C ATOM 1325 CG ASP A 85 -2.108 -17.439 -4.367 1.00 54.11 C ATOM 1326 OD1 ASP A 85 -1.407 -17.474 -5.400 1.00 72.42 O ATOM 1327 OD2 ASP A 85 -3.330 -17.698 -4.359 1.00 23.11 O ATOM 0 H ASP A 85 0.481 -15.729 -1.796 1.00 40.35 H new ATOM 0 HA ASP A 85 -1.568 -15.061 -3.825 1.00 15.01 H new ATOM 0 HB2 ASP A 85 -0.457 -17.526 -3.007 1.00 75.34 H new ATOM 0 HB3 ASP A 85 -2.026 -17.465 -2.228 1.00 75.34 H new ATOM 1332 N ARG A 86 -3.117 -14.119 -2.155 1.00 62.12 N ATOM 1333 CA ARG A 86 -4.073 -13.562 -1.206 1.00 43.50 C ATOM 1334 C ARG A 86 -3.361 -12.735 -0.139 1.00 65.31 C ATOM 1335 O ARG A 86 -3.044 -13.220 0.948 1.00 43.25 O ATOM 1336 CB ARG A 86 -4.880 -14.681 -0.545 1.00 44.33 C ATOM 1337 CG ARG A 86 -6.353 -14.672 -0.920 1.00 64.51 C ATOM 1338 CD ARG A 86 -7.016 -16.003 -0.601 1.00 11.03 C ATOM 1339 NE ARG A 86 -8.459 -15.866 -0.424 1.00 34.31 N ATOM 1340 CZ ARG A 86 -9.315 -15.743 -1.433 1.00 1.14 C ATOM 1341 NH1 ARG A 86 -8.874 -15.739 -2.683 1.00 75.51 N ATOM 1342 NH2 ARG A 86 -10.614 -15.623 -1.191 1.00 72.12 N ATOM 0 H ARG A 86 -3.181 -13.730 -3.096 1.00 62.12 H new ATOM 0 HA ARG A 86 -4.752 -12.909 -1.754 1.00 43.50 H new ATOM 0 HB2 ARG A 86 -4.449 -15.642 -0.824 1.00 44.33 H new ATOM 0 HB3 ARG A 86 -4.789 -14.593 0.538 1.00 44.33 H new ATOM 0 HG2 ARG A 86 -6.862 -13.872 -0.382 1.00 64.51 H new ATOM 0 HG3 ARG A 86 -6.458 -14.457 -1.984 1.00 64.51 H new ATOM 0 HD2 ARG A 86 -6.815 -16.710 -1.405 1.00 11.03 H new ATOM 0 HD3 ARG A 86 -6.577 -16.419 0.306 1.00 11.03 H new ATOM 0 HE ARG A 86 -8.830 -15.865 0.526 1.00 34.31 H new ATOM 0 HH11 ARG A 86 -7.876 -15.830 -2.872 1.00 75.51 H new ATOM 0 HH12 ARG A 86 -9.533 -15.644 -3.456 1.00 75.51 H new ATOM 0 HH21 ARG A 86 -10.956 -15.625 -0.230 1.00 72.12 H new ATOM 0 HH22 ARG A 86 -11.271 -15.529 -1.966 1.00 72.12 H new ATOM 1356 N PRO A 87 -3.102 -11.458 -0.455 1.00 3.43 N ATOM 1357 CA PRO A 87 -3.474 -10.870 -1.745 1.00 45.02 C ATOM 1358 C PRO A 87 -2.642 -11.425 -2.896 1.00 63.32 C ATOM 1359 O PRO A 87 -1.545 -11.946 -2.688 1.00 42.24 O ATOM 1360 CB PRO A 87 -3.189 -9.379 -1.551 1.00 13.51 C ATOM 1361 CG PRO A 87 -2.145 -9.327 -0.489 1.00 53.04 C ATOM 1362 CD PRO A 87 -2.426 -10.488 0.424 1.00 65.32 C ATOM 0 HA PRO A 87 -4.508 -11.089 -2.010 1.00 45.02 H new ATOM 0 HB2 PRO A 87 -2.837 -8.920 -2.475 1.00 13.51 H new ATOM 0 HB3 PRO A 87 -4.087 -8.840 -1.250 1.00 13.51 H new ATOM 0 HG2 PRO A 87 -1.146 -9.402 -0.919 1.00 53.04 H new ATOM 0 HG3 PRO A 87 -2.188 -8.383 0.055 1.00 53.04 H new ATOM 0 HD2 PRO A 87 -1.509 -10.899 0.845 1.00 65.32 H new ATOM 0 HD3 PRO A 87 -3.059 -10.196 1.262 1.00 65.32 H new ATOM 1370 N LEU A 88 -3.169 -11.311 -4.110 1.00 32.20 N ATOM 1371 CA LEU A 88 -2.475 -11.802 -5.295 1.00 44.33 C ATOM 1372 C LEU A 88 -1.616 -10.705 -5.916 1.00 42.52 C ATOM 1373 O LEU A 88 -2.135 -9.742 -6.481 1.00 31.24 O ATOM 1374 CB LEU A 88 -3.482 -12.320 -6.323 1.00 51.43 C ATOM 1375 CG LEU A 88 -3.485 -13.831 -6.558 1.00 12.43 C ATOM 1376 CD1 LEU A 88 -2.088 -14.320 -6.906 1.00 0.41 C ATOM 1377 CD2 LEU A 88 -4.017 -14.559 -5.332 1.00 74.33 C ATOM 0 H LEU A 88 -4.075 -10.883 -4.300 1.00 32.20 H new ATOM 0 HA LEU A 88 -1.823 -12.621 -4.991 1.00 44.33 H new ATOM 0 HB2 LEU A 88 -4.481 -12.020 -6.006 1.00 51.43 H new ATOM 0 HB3 LEU A 88 -3.287 -11.825 -7.274 1.00 51.43 H new ATOM 0 HG LEU A 88 -4.143 -14.048 -7.399 1.00 12.43 H new ATOM 0 HD11 LEU A 88 -2.110 -15.397 -7.070 1.00 0.41 H new ATOM 0 HD12 LEU A 88 -1.744 -13.822 -7.812 1.00 0.41 H new ATOM 0 HD13 LEU A 88 -1.408 -14.091 -6.086 1.00 0.41 H new ATOM 0 HD21 LEU A 88 -4.012 -15.633 -5.516 1.00 74.33 H new ATOM 0 HD22 LEU A 88 -3.384 -14.335 -4.473 1.00 74.33 H new ATOM 0 HD23 LEU A 88 -5.036 -14.230 -5.127 1.00 74.33 H new ATOM 1389 N GLN A 89 -0.300 -10.858 -5.809 1.00 60.42 N ATOM 1390 CA GLN A 89 0.630 -9.881 -6.362 1.00 23.11 C ATOM 1391 C GLN A 89 2.075 -10.304 -6.115 1.00 33.21 C ATOM 1392 O GLN A 89 2.334 -11.375 -5.567 1.00 34.55 O ATOM 1393 CB GLN A 89 0.378 -8.502 -5.749 1.00 24.40 C ATOM 1394 CG GLN A 89 -0.123 -7.474 -6.750 1.00 21.00 C ATOM 1395 CD GLN A 89 0.886 -7.185 -7.844 1.00 75.14 C ATOM 1396 OE1 GLN A 89 0.919 -7.867 -8.869 1.00 51.34 O ATOM 1397 NE2 GLN A 89 1.715 -6.170 -7.633 1.00 11.14 N ATOM 0 H GLN A 89 0.146 -11.649 -5.345 1.00 60.42 H new ATOM 0 HA GLN A 89 0.465 -9.828 -7.438 1.00 23.11 H new ATOM 0 HB2 GLN A 89 -0.351 -8.599 -4.945 1.00 24.40 H new ATOM 0 HB3 GLN A 89 1.302 -8.139 -5.300 1.00 24.40 H new ATOM 0 HG2 GLN A 89 -1.049 -7.832 -7.200 1.00 21.00 H new ATOM 0 HG3 GLN A 89 -0.361 -6.548 -6.226 1.00 21.00 H new ATOM 0 HE21 GLN A 89 1.652 -5.632 -6.769 1.00 11.14 H new ATOM 0 HE22 GLN A 89 2.415 -5.929 -8.335 1.00 11.14 H new ATOM 1406 N VAL A 90 3.013 -9.456 -6.524 1.00 12.22 N ATOM 1407 CA VAL A 90 4.432 -9.741 -6.346 1.00 75.23 C ATOM 1408 C VAL A 90 5.150 -8.568 -5.690 1.00 2.12 C ATOM 1409 O VAL A 90 4.694 -7.427 -5.764 1.00 45.52 O ATOM 1410 CB VAL A 90 5.113 -10.059 -7.691 1.00 33.13 C ATOM 1411 CG1 VAL A 90 6.491 -10.660 -7.462 1.00 61.32 C ATOM 1412 CG2 VAL A 90 4.245 -10.994 -8.519 1.00 72.22 C ATOM 0 H VAL A 90 2.816 -8.566 -6.981 1.00 12.22 H new ATOM 0 HA VAL A 90 4.501 -10.614 -5.697 1.00 75.23 H new ATOM 0 HB VAL A 90 5.236 -9.129 -8.246 1.00 33.13 H new ATOM 0 HG11 VAL A 90 6.957 -10.878 -8.423 1.00 61.32 H new ATOM 0 HG12 VAL A 90 7.110 -9.952 -6.911 1.00 61.32 H new ATOM 0 HG13 VAL A 90 6.395 -11.581 -6.888 1.00 61.32 H new ATOM 0 HG21 VAL A 90 4.741 -11.208 -9.466 1.00 72.22 H new ATOM 0 HG22 VAL A 90 4.088 -11.924 -7.973 1.00 72.22 H new ATOM 0 HG23 VAL A 90 3.282 -10.521 -8.713 1.00 72.22 H new ATOM 1422 N PHE A 91 6.277 -8.856 -5.047 1.00 61.01 N ATOM 1423 CA PHE A 91 7.060 -7.825 -4.376 1.00 51.44 C ATOM 1424 C PHE A 91 8.429 -7.668 -5.032 1.00 72.30 C ATOM 1425 O PHE A 91 9.155 -8.645 -5.220 1.00 72.12 O ATOM 1426 CB PHE A 91 7.228 -8.165 -2.894 1.00 54.21 C ATOM 1427 CG PHE A 91 5.929 -8.218 -2.141 1.00 24.04 C ATOM 1428 CD1 PHE A 91 5.091 -7.116 -2.099 1.00 43.55 C ATOM 1429 CD2 PHE A 91 5.547 -9.371 -1.473 1.00 44.40 C ATOM 1430 CE1 PHE A 91 3.896 -7.161 -1.407 1.00 73.33 C ATOM 1431 CE2 PHE A 91 4.353 -9.422 -0.780 1.00 30.33 C ATOM 1432 CZ PHE A 91 3.527 -8.316 -0.746 1.00 33.03 C ATOM 0 H PHE A 91 6.668 -9.795 -4.977 1.00 61.01 H new ATOM 0 HA PHE A 91 6.523 -6.881 -4.466 1.00 51.44 H new ATOM 0 HB2 PHE A 91 7.730 -9.128 -2.805 1.00 54.21 H new ATOM 0 HB3 PHE A 91 7.878 -7.423 -2.430 1.00 54.21 H new ATOM 0 HD1 PHE A 91 5.375 -6.210 -2.614 1.00 43.55 H new ATOM 0 HD2 PHE A 91 6.190 -10.239 -1.495 1.00 44.40 H new ATOM 0 HE1 PHE A 91 3.252 -6.295 -1.383 1.00 73.33 H new ATOM 0 HE2 PHE A 91 4.066 -10.327 -0.265 1.00 30.33 H new ATOM 0 HZ PHE A 91 2.594 -8.354 -0.203 1.00 33.03 H new ATOM 1442 N HIS A 92 8.775 -6.432 -5.378 1.00 71.44 N ATOM 1443 CA HIS A 92 10.057 -6.147 -6.013 1.00 54.03 C ATOM 1444 C HIS A 92 11.190 -6.190 -4.993 1.00 11.33 C ATOM 1445 O HIS A 92 11.213 -5.407 -4.043 1.00 23.35 O ATOM 1446 CB HIS A 92 10.019 -4.778 -6.694 1.00 30.40 C ATOM 1447 CG HIS A 92 10.452 -4.810 -8.127 1.00 63.13 C ATOM 1448 ND1 HIS A 92 11.295 -3.869 -8.680 1.00 12.42 N ATOM 1449 CD2 HIS A 92 10.156 -5.678 -9.123 1.00 24.34 C ATOM 1450 CE1 HIS A 92 11.497 -4.155 -9.953 1.00 72.35 C ATOM 1451 NE2 HIS A 92 10.818 -5.249 -10.247 1.00 75.32 N ATOM 0 H HIS A 92 8.186 -5.612 -5.230 1.00 71.44 H new ATOM 0 HA HIS A 92 10.241 -6.914 -6.765 1.00 54.03 H new ATOM 0 HB2 HIS A 92 9.005 -4.382 -6.638 1.00 30.40 H new ATOM 0 HB3 HIS A 92 10.661 -4.090 -6.144 1.00 30.40 H new ATOM 0 HD2 HIS A 92 9.518 -6.546 -9.048 1.00 24.34 H new ATOM 0 HE1 HIS A 92 12.113 -3.590 -10.637 1.00 72.35 H new ATOM 0 HE2 HIS A 92 10.790 -5.702 -11.161 1.00 75.32 H new ATOM 1459 N VAL A 93 12.128 -7.109 -5.195 1.00 61.35 N ATOM 1460 CA VAL A 93 13.264 -7.254 -4.293 1.00 45.04 C ATOM 1461 C VAL A 93 14.584 -7.149 -5.050 1.00 73.23 C ATOM 1462 O VAL A 93 14.785 -7.822 -6.061 1.00 3.42 O ATOM 1463 CB VAL A 93 13.220 -8.600 -3.546 1.00 13.24 C ATOM 1464 CG1 VAL A 93 14.525 -8.842 -2.804 1.00 22.23 C ATOM 1465 CG2 VAL A 93 12.038 -8.638 -2.589 1.00 10.15 C ATOM 0 H VAL A 93 12.124 -7.765 -5.976 1.00 61.35 H new ATOM 0 HA VAL A 93 13.198 -6.442 -3.568 1.00 45.04 H new ATOM 0 HB VAL A 93 13.093 -9.398 -4.277 1.00 13.24 H new ATOM 0 HG11 VAL A 93 14.475 -9.798 -2.282 1.00 22.23 H new ATOM 0 HG12 VAL A 93 15.350 -8.860 -3.516 1.00 22.23 H new ATOM 0 HG13 VAL A 93 14.686 -8.042 -2.081 1.00 22.23 H new ATOM 0 HG21 VAL A 93 12.021 -9.596 -2.069 1.00 10.15 H new ATOM 0 HG22 VAL A 93 12.133 -7.832 -1.862 1.00 10.15 H new ATOM 0 HG23 VAL A 93 11.112 -8.514 -3.150 1.00 10.15 H new ATOM 1475 N GLU A 94 15.479 -6.301 -4.553 1.00 61.45 N ATOM 1476 CA GLU A 94 16.780 -6.109 -5.184 1.00 13.21 C ATOM 1477 C GLU A 94 17.906 -6.269 -4.167 1.00 63.42 C ATOM 1478 O GLU A 94 18.058 -5.453 -3.258 1.00 62.21 O ATOM 1479 CB GLU A 94 16.857 -4.725 -5.833 1.00 31.32 C ATOM 1480 CG GLU A 94 17.943 -4.608 -6.889 1.00 21.12 C ATOM 1481 CD GLU A 94 18.263 -3.168 -7.240 1.00 14.13 C ATOM 1482 OE1 GLU A 94 18.813 -2.455 -6.374 1.00 63.34 O ATOM 1483 OE2 GLU A 94 17.962 -2.753 -8.379 1.00 21.35 O ATOM 0 H GLU A 94 15.328 -5.737 -3.717 1.00 61.45 H new ATOM 0 HA GLU A 94 16.898 -6.871 -5.954 1.00 13.21 H new ATOM 0 HB2 GLU A 94 15.894 -4.492 -6.287 1.00 31.32 H new ATOM 0 HB3 GLU A 94 17.033 -3.979 -5.058 1.00 31.32 H new ATOM 0 HG2 GLU A 94 18.847 -5.100 -6.531 1.00 21.12 H new ATOM 0 HG3 GLU A 94 17.628 -5.136 -7.789 1.00 21.12 H new ATOM 1490 N VAL A 95 18.694 -7.328 -4.328 1.00 31.25 N ATOM 1491 CA VAL A 95 19.807 -7.597 -3.425 1.00 0.30 C ATOM 1492 C VAL A 95 21.144 -7.323 -4.105 1.00 11.34 C ATOM 1493 O VAL A 95 21.347 -7.684 -5.263 1.00 43.42 O ATOM 1494 CB VAL A 95 19.786 -9.054 -2.926 1.00 42.22 C ATOM 1495 CG1 VAL A 95 18.542 -9.315 -2.091 1.00 3.44 C ATOM 1496 CG2 VAL A 95 19.863 -10.019 -4.099 1.00 74.23 C ATOM 0 H VAL A 95 18.582 -8.013 -5.075 1.00 31.25 H new ATOM 0 HA VAL A 95 19.692 -6.928 -2.572 1.00 0.30 H new ATOM 0 HB VAL A 95 20.659 -9.216 -2.293 1.00 42.22 H new ATOM 0 HG11 VAL A 95 18.545 -10.349 -1.747 1.00 3.44 H new ATOM 0 HG12 VAL A 95 18.535 -8.647 -1.230 1.00 3.44 H new ATOM 0 HG13 VAL A 95 17.653 -9.136 -2.696 1.00 3.44 H new ATOM 0 HG21 VAL A 95 19.847 -11.044 -3.729 1.00 74.23 H new ATOM 0 HG22 VAL A 95 19.010 -9.858 -4.759 1.00 74.23 H new ATOM 0 HG23 VAL A 95 20.787 -9.847 -4.651 1.00 74.23 H new ATOM 1506 N GLU A 96 22.052 -6.683 -3.375 1.00 3.40 N ATOM 1507 CA GLU A 96 23.370 -6.360 -3.909 1.00 5.05 C ATOM 1508 C GLU A 96 24.460 -7.132 -3.170 1.00 61.34 C ATOM 1509 O GLU A 96 24.310 -7.471 -1.996 1.00 51.03 O ATOM 1510 CB GLU A 96 23.634 -4.857 -3.802 1.00 43.40 C ATOM 1511 CG GLU A 96 24.165 -4.239 -5.085 1.00 72.31 C ATOM 1512 CD GLU A 96 24.012 -2.731 -5.114 1.00 13.04 C ATOM 1513 OE1 GLU A 96 23.963 -2.118 -4.027 1.00 31.33 O ATOM 1514 OE2 GLU A 96 23.941 -2.163 -6.224 1.00 30.41 O ATOM 0 H GLU A 96 21.899 -6.378 -2.414 1.00 3.40 H new ATOM 0 HA GLU A 96 23.390 -6.651 -4.959 1.00 5.05 H new ATOM 0 HB2 GLU A 96 22.709 -4.353 -3.522 1.00 43.40 H new ATOM 0 HB3 GLU A 96 24.350 -4.679 -2.999 1.00 43.40 H new ATOM 0 HG2 GLU A 96 25.218 -4.496 -5.198 1.00 72.31 H new ATOM 0 HG3 GLU A 96 23.638 -4.670 -5.936 1.00 72.31 H new ATOM 1521 N VAL A 97 25.558 -7.408 -3.868 1.00 33.12 N ATOM 1522 CA VAL A 97 26.673 -8.140 -3.280 1.00 4.42 C ATOM 1523 C VAL A 97 27.750 -7.186 -2.774 1.00 62.22 C ATOM 1524 O VAL A 97 28.387 -6.482 -3.557 1.00 44.25 O ATOM 1525 CB VAL A 97 27.301 -9.115 -4.293 1.00 43.01 C ATOM 1526 CG1 VAL A 97 26.414 -10.337 -4.479 1.00 3.42 C ATOM 1527 CG2 VAL A 97 27.547 -8.417 -5.622 1.00 54.12 C ATOM 0 H VAL A 97 25.698 -7.136 -4.841 1.00 33.12 H new ATOM 0 HA VAL A 97 26.272 -8.709 -2.441 1.00 4.42 H new ATOM 0 HB VAL A 97 28.262 -9.450 -3.901 1.00 43.01 H new ATOM 0 HG11 VAL A 97 26.874 -11.014 -5.198 1.00 3.42 H new ATOM 0 HG12 VAL A 97 26.294 -10.848 -3.524 1.00 3.42 H new ATOM 0 HG13 VAL A 97 25.437 -10.025 -4.848 1.00 3.42 H new ATOM 0 HG21 VAL A 97 27.991 -9.121 -6.326 1.00 54.12 H new ATOM 0 HG22 VAL A 97 26.601 -8.052 -6.022 1.00 54.12 H new ATOM 0 HG23 VAL A 97 28.225 -7.577 -5.472 1.00 54.12 H new ATOM 1537 N ARG A 98 27.949 -7.170 -1.460 1.00 55.52 N ATOM 1538 CA ARG A 98 28.948 -6.302 -0.849 1.00 42.24 C ATOM 1539 C ARG A 98 30.315 -6.980 -0.826 1.00 0.25 C ATOM 1540 O ARG A 98 30.519 -7.964 -0.114 1.00 54.13 O ATOM 1541 CB ARG A 98 28.528 -5.927 0.573 1.00 43.30 C ATOM 1542 CG ARG A 98 28.202 -4.452 0.743 1.00 52.13 C ATOM 1543 CD ARG A 98 29.053 -3.814 1.830 1.00 62.44 C ATOM 1544 NE ARG A 98 29.147 -2.366 1.672 1.00 44.42 N ATOM 1545 CZ ARG A 98 29.604 -1.552 2.617 1.00 42.40 C ATOM 1546 NH1 ARG A 98 30.007 -2.042 3.781 1.00 33.02 N ATOM 1547 NH2 ARG A 98 29.660 -0.244 2.398 1.00 35.02 N ATOM 0 H ARG A 98 27.431 -7.748 -0.798 1.00 55.52 H new ATOM 0 HA ARG A 98 29.021 -5.395 -1.449 1.00 42.24 H new ATOM 0 HB2 ARG A 98 27.656 -6.518 0.853 1.00 43.30 H new ATOM 0 HB3 ARG A 98 29.329 -6.195 1.262 1.00 43.30 H new ATOM 0 HG2 ARG A 98 28.365 -3.931 -0.201 1.00 52.13 H new ATOM 0 HG3 ARG A 98 27.147 -4.338 0.992 1.00 52.13 H new ATOM 0 HD2 ARG A 98 28.627 -4.045 2.806 1.00 62.44 H new ATOM 0 HD3 ARG A 98 30.053 -4.247 1.808 1.00 62.44 H new ATOM 0 HE ARG A 98 28.845 -1.957 0.788 1.00 44.42 H new ATOM 0 HH11 ARG A 98 29.967 -3.047 3.953 1.00 33.02 H new ATOM 0 HH12 ARG A 98 30.357 -1.414 4.505 1.00 33.02 H new ATOM 0 HH21 ARG A 98 29.352 0.137 1.503 1.00 35.02 H new ATOM 0 HH22 ARG A 98 30.011 0.380 3.124 1.00 35.02 H new ATOM 1561 N ASP A 99 31.247 -6.447 -1.608 1.00 25.15 N ATOM 1562 CA ASP A 99 32.595 -7.000 -1.676 1.00 42.00 C ATOM 1563 C ASP A 99 33.465 -6.193 -2.635 1.00 24.33 C ATOM 1564 O ASP A 99 33.074 -5.117 -3.086 1.00 45.54 O ATOM 1565 CB ASP A 99 32.547 -8.463 -2.119 1.00 63.03 C ATOM 1566 CG ASP A 99 33.354 -9.370 -1.211 1.00 44.22 C ATOM 1567 OD1 ASP A 99 33.209 -9.255 0.024 1.00 0.11 O ATOM 1568 OD2 ASP A 99 34.131 -10.195 -1.736 1.00 31.14 O ATOM 0 H ASP A 99 31.094 -5.633 -2.204 1.00 25.15 H new ATOM 0 HA ASP A 99 33.035 -6.945 -0.680 1.00 42.00 H new ATOM 0 HB2 ASP A 99 31.511 -8.800 -2.137 1.00 63.03 H new ATOM 0 HB3 ASP A 99 32.926 -8.544 -3.138 1.00 63.03 H new ATOM 1573 N ILE A 100 34.646 -6.721 -2.940 1.00 2.42 N ATOM 1574 CA ILE A 100 35.571 -6.049 -3.845 1.00 22.44 C ATOM 1575 C ILE A 100 35.824 -6.887 -5.093 1.00 71.24 C ATOM 1576 O ILE A 100 35.651 -8.105 -5.081 1.00 63.14 O ATOM 1577 CB ILE A 100 36.917 -5.755 -3.157 1.00 2.33 C ATOM 1578 CG1 ILE A 100 37.502 -7.037 -2.561 1.00 60.01 C ATOM 1579 CG2 ILE A 100 36.740 -4.696 -2.078 1.00 65.05 C ATOM 1580 CD1 ILE A 100 38.924 -6.881 -2.069 1.00 12.03 C ATOM 0 H ILE A 100 34.985 -7.611 -2.574 1.00 2.42 H new ATOM 0 HA ILE A 100 35.104 -5.106 -4.131 1.00 22.44 H new ATOM 0 HB ILE A 100 37.614 -5.373 -3.904 1.00 2.33 H new ATOM 0 HG12 ILE A 100 36.873 -7.363 -1.732 1.00 60.01 H new ATOM 0 HG13 ILE A 100 37.471 -7.825 -3.314 1.00 60.01 H new ATOM 0 HG21 ILE A 100 37.700 -4.499 -1.601 1.00 65.05 H new ATOM 0 HG22 ILE A 100 36.363 -3.778 -2.528 1.00 65.05 H new ATOM 0 HG23 ILE A 100 36.030 -5.052 -1.332 1.00 65.05 H new ATOM 0 HD11 ILE A 100 39.273 -7.829 -1.660 1.00 12.03 H new ATOM 0 HD12 ILE A 100 39.566 -6.585 -2.899 1.00 12.03 H new ATOM 0 HD13 ILE A 100 38.959 -6.116 -1.293 1.00 12.03 H new