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 -31:sc= 0.00138 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.0077) USER MOD Single : A 7 TYR OH : rot 70:sc= -1.99 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= -0.493 K(o=-0.49,f=-1.2) USER MOD Single : A 17 THR OG1 : rot 58:sc= 1.25 USER MOD Single : A 24 GLN : amide:sc= -0.0864 K(o=-0.086,f=-0.64) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 63:sc= -0.338 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -1.32 K(o=-1.3,f=-11!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -0.211 X(o=-0.21,f=-0.39) USER MOD Single : A 62 SER OG : rot 180:sc= 0.257 USER MOD Single : A 73 SER OG : rot 180:sc= 0.128 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=-0.000498 X(o=-0.0005,f=-0.023) USER MOD Single : A 92 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.036) USER MOD ----------------------------------------------------------------- ATOM 22 N SER A 3 5.890 -1.530 -3.696 1.00 14.21 N ATOM 23 CA SER A 3 6.516 -2.798 -3.343 1.00 61.42 C ATOM 24 C SER A 3 8.020 -2.749 -3.593 1.00 63.52 C ATOM 25 O SER A 3 8.653 -3.777 -3.834 1.00 24.14 O ATOM 26 CB SER A 3 5.891 -3.941 -4.146 1.00 40.23 C ATOM 27 OG SER A 3 6.234 -3.847 -5.518 1.00 52.11 O ATOM 0 HA SER A 3 6.347 -2.975 -2.281 1.00 61.42 H new ATOM 0 HB2 SER A 3 6.230 -4.897 -3.748 1.00 40.23 H new ATOM 0 HB3 SER A 3 4.807 -3.916 -4.036 1.00 40.23 H new ATOM 0 HG SER A 3 6.352 -2.905 -5.762 1.00 52.11 H new ATOM 33 N GLN A 4 8.585 -1.548 -3.535 1.00 12.45 N ATOM 34 CA GLN A 4 10.014 -1.364 -3.755 1.00 63.03 C ATOM 35 C GLN A 4 10.809 -1.723 -2.504 1.00 31.00 C ATOM 36 O GLN A 4 10.884 -0.938 -1.558 1.00 41.24 O ATOM 37 CB GLN A 4 10.307 0.081 -4.163 1.00 24.12 C ATOM 38 CG GLN A 4 9.481 0.559 -5.346 1.00 30.03 C ATOM 39 CD GLN A 4 10.313 1.286 -6.383 1.00 44.04 C ATOM 40 OE1 GLN A 4 10.316 2.516 -6.443 1.00 64.00 O ATOM 41 NE2 GLN A 4 11.026 0.528 -7.208 1.00 72.25 N ATOM 0 H GLN A 4 8.075 -0.687 -3.337 1.00 12.45 H new ATOM 0 HA GLN A 4 10.320 -2.031 -4.561 1.00 63.03 H new ATOM 0 HB2 GLN A 4 10.119 0.735 -3.312 1.00 24.12 H new ATOM 0 HB3 GLN A 4 11.365 0.173 -4.409 1.00 24.12 H new ATOM 0 HG2 GLN A 4 8.993 -0.297 -5.812 1.00 30.03 H new ATOM 0 HG3 GLN A 4 8.692 1.221 -4.989 1.00 30.03 H new ATOM 0 HE21 GLN A 4 10.994 -0.488 -7.123 1.00 72.25 H new ATOM 0 HE22 GLN A 4 11.606 0.962 -7.927 1.00 72.25 H new ATOM 50 N ILE A 5 11.399 -2.913 -2.505 1.00 64.34 N ATOM 51 CA ILE A 5 12.189 -3.375 -1.370 1.00 74.34 C ATOM 52 C ILE A 5 13.523 -3.954 -1.828 1.00 4.51 C ATOM 53 O ILE A 5 13.595 -4.656 -2.837 1.00 32.01 O ATOM 54 CB ILE A 5 11.433 -4.441 -0.555 1.00 75.24 C ATOM 55 CG1 ILE A 5 9.986 -4.002 -0.319 1.00 20.24 C ATOM 56 CG2 ILE A 5 12.138 -4.695 0.768 1.00 22.12 C ATOM 57 CD1 ILE A 5 9.866 -2.724 0.481 1.00 33.15 C ATOM 0 H ILE A 5 11.345 -3.575 -3.279 1.00 64.34 H new ATOM 0 HA ILE A 5 12.371 -2.506 -0.737 1.00 74.34 H new ATOM 0 HB ILE A 5 11.423 -5.372 -1.123 1.00 75.24 H new ATOM 0 HG12 ILE A 5 9.494 -3.866 -1.282 1.00 20.24 H new ATOM 0 HG13 ILE A 5 9.453 -4.798 0.201 1.00 20.24 H new ATOM 0 HG21 ILE A 5 11.592 -5.451 1.332 1.00 22.12 H new ATOM 0 HG22 ILE A 5 13.152 -5.047 0.578 1.00 22.12 H new ATOM 0 HG23 ILE A 5 12.176 -3.770 1.343 1.00 22.12 H new ATOM 0 HD11 ILE A 5 8.813 -2.473 0.610 1.00 33.15 H new ATOM 0 HD12 ILE A 5 10.328 -2.862 1.458 1.00 33.15 H new ATOM 0 HD13 ILE A 5 10.370 -1.915 -0.048 1.00 33.15 H new ATOM 69 N HIS A 6 14.580 -3.655 -1.078 1.00 53.12 N ATOM 70 CA HIS A 6 15.913 -4.147 -1.405 1.00 62.23 C ATOM 71 C HIS A 6 16.658 -4.578 -0.145 1.00 75.11 C ATOM 72 O HIS A 6 16.410 -4.057 0.943 1.00 70.23 O ATOM 73 CB HIS A 6 16.711 -3.070 -2.140 1.00 45.10 C ATOM 74 CG HIS A 6 16.728 -1.750 -1.433 1.00 1.22 C ATOM 75 ND1 HIS A 6 16.121 -0.619 -1.936 1.00 13.30 N ATOM 76 CD2 HIS A 6 17.282 -1.384 -0.253 1.00 70.41 C ATOM 77 CE1 HIS A 6 16.302 0.386 -1.097 1.00 71.33 C ATOM 78 NE2 HIS A 6 17.003 -0.053 -0.067 1.00 42.34 N ATOM 0 H HIS A 6 14.538 -3.075 -0.240 1.00 53.12 H new ATOM 0 HA HIS A 6 15.803 -5.015 -2.055 1.00 62.23 H new ATOM 0 HB2 HIS A 6 17.736 -3.416 -2.272 1.00 45.10 H new ATOM 0 HB3 HIS A 6 16.290 -2.934 -3.136 1.00 45.10 H new ATOM 0 HD2 HIS A 6 17.840 -2.021 0.417 1.00 70.41 H new ATOM 0 HE1 HIS A 6 15.939 1.394 -1.231 1.00 71.33 H new ATOM 0 HE2 HIS A 6 17.290 0.506 0.736 1.00 42.34 H new ATOM 86 N TYR A 7 17.569 -5.532 -0.299 1.00 72.14 N ATOM 87 CA TYR A 7 18.347 -6.035 0.827 1.00 73.35 C ATOM 88 C TYR A 7 19.843 -5.925 0.548 1.00 74.43 C ATOM 89 O TYR A 7 20.260 -5.733 -0.594 1.00 41.32 O ATOM 90 CB TYR A 7 17.977 -7.490 1.119 1.00 33.34 C ATOM 91 CG TYR A 7 16.488 -7.754 1.093 1.00 1.41 C ATOM 92 CD1 TYR A 7 15.594 -6.858 1.667 1.00 72.51 C ATOM 93 CD2 TYR A 7 15.976 -8.898 0.493 1.00 12.52 C ATOM 94 CE1 TYR A 7 14.233 -7.096 1.646 1.00 41.43 C ATOM 95 CE2 TYR A 7 14.616 -9.142 0.466 1.00 23.10 C ATOM 96 CZ TYR A 7 13.749 -8.239 1.044 1.00 2.50 C ATOM 97 OH TYR A 7 12.394 -8.478 1.020 1.00 43.34 O ATOM 0 H TYR A 7 17.787 -5.973 -1.193 1.00 72.14 H new ATOM 0 HA TYR A 7 18.113 -5.425 1.699 1.00 73.35 H new ATOM 0 HB2 TYR A 7 18.464 -8.134 0.387 1.00 33.34 H new ATOM 0 HB3 TYR A 7 18.369 -7.766 2.098 1.00 33.34 H new ATOM 0 HD1 TYR A 7 15.969 -5.961 2.137 1.00 72.51 H new ATOM 0 HD2 TYR A 7 16.652 -9.608 0.040 1.00 12.52 H new ATOM 0 HE1 TYR A 7 13.552 -6.391 2.099 1.00 41.43 H new ATOM 0 HE2 TYR A 7 14.234 -10.035 -0.005 1.00 23.10 H new ATOM 0 HH TYR A 7 11.960 -7.840 0.416 1.00 43.34 H new ATOM 107 N SER A 8 20.645 -6.050 1.600 1.00 32.01 N ATOM 108 CA SER A 8 22.095 -5.962 1.471 1.00 54.30 C ATOM 109 C SER A 8 22.757 -7.274 1.878 1.00 22.32 C ATOM 110 O SER A 8 22.809 -7.616 3.060 1.00 15.42 O ATOM 111 CB SER A 8 22.635 -4.816 2.329 1.00 25.51 C ATOM 112 OG SER A 8 21.644 -3.827 2.542 1.00 11.24 O ATOM 0 H SER A 8 20.315 -6.213 2.552 1.00 32.01 H new ATOM 0 HA SER A 8 22.332 -5.766 0.425 1.00 54.30 H new ATOM 0 HB2 SER A 8 22.976 -5.205 3.288 1.00 25.51 H new ATOM 0 HB3 SER A 8 23.501 -4.369 1.840 1.00 25.51 H new ATOM 0 HG SER A 8 22.014 -3.107 3.094 1.00 11.24 H new ATOM 118 N ILE A 9 23.263 -8.006 0.891 1.00 51.42 N ATOM 119 CA ILE A 9 23.923 -9.280 1.146 1.00 43.25 C ATOM 120 C ILE A 9 25.356 -9.271 0.623 1.00 53.24 C ATOM 121 O ILE A 9 25.605 -9.129 -0.575 1.00 30.03 O ATOM 122 CB ILE A 9 23.159 -10.449 0.497 1.00 24.41 C ATOM 123 CG1 ILE A 9 24.008 -11.722 0.531 1.00 72.34 C ATOM 124 CG2 ILE A 9 22.773 -10.102 -0.933 1.00 13.44 C ATOM 125 CD1 ILE A 9 23.300 -12.935 -0.031 1.00 33.43 C ATOM 0 H ILE A 9 23.228 -7.738 -0.093 1.00 51.42 H new ATOM 0 HA ILE A 9 23.934 -9.419 2.227 1.00 43.25 H new ATOM 0 HB ILE A 9 22.246 -10.627 1.065 1.00 24.41 H new ATOM 0 HG12 ILE A 9 24.925 -11.553 -0.033 1.00 72.34 H new ATOM 0 HG13 ILE A 9 24.301 -11.927 1.561 1.00 72.34 H new ATOM 0 HG21 ILE A 9 22.234 -10.939 -1.378 1.00 13.44 H new ATOM 0 HG22 ILE A 9 22.135 -9.218 -0.933 1.00 13.44 H new ATOM 0 HG23 ILE A 9 23.673 -9.901 -1.514 1.00 13.44 H new ATOM 0 HD11 ILE A 9 23.961 -13.800 0.025 1.00 33.43 H new ATOM 0 HD12 ILE A 9 22.397 -13.130 0.548 1.00 33.43 H new ATOM 0 HD13 ILE A 9 23.031 -12.750 -1.071 1.00 33.43 H new ATOM 137 N PRO A 10 26.322 -9.427 1.540 1.00 35.41 N ATOM 138 CA PRO A 10 27.746 -9.443 1.195 1.00 21.30 C ATOM 139 C PRO A 10 28.141 -10.697 0.422 1.00 4.02 C ATOM 140 O PRO A 10 27.704 -11.800 0.747 1.00 70.32 O ATOM 141 CB PRO A 10 28.442 -9.414 2.558 1.00 13.13 C ATOM 142 CG PRO A 10 27.451 -10.003 3.502 1.00 71.32 C ATOM 143 CD PRO A 10 26.097 -9.602 2.985 1.00 41.40 C ATOM 0 HA PRO A 10 28.017 -8.611 0.545 1.00 21.30 H new ATOM 0 HB2 PRO A 10 29.366 -9.992 2.543 1.00 13.13 H new ATOM 0 HB3 PRO A 10 28.707 -8.397 2.846 1.00 13.13 H new ATOM 0 HG2 PRO A 10 27.548 -11.088 3.542 1.00 71.32 H new ATOM 0 HG3 PRO A 10 27.608 -9.631 4.515 1.00 71.32 H new ATOM 0 HD2 PRO A 10 25.347 -10.368 3.185 1.00 41.40 H new ATOM 0 HD3 PRO A 10 25.745 -8.682 3.451 1.00 41.40 H new ATOM 151 N GLU A 11 28.971 -10.519 -0.601 1.00 4.11 N ATOM 152 CA GLU A 11 29.425 -11.637 -1.419 1.00 73.35 C ATOM 153 C GLU A 11 29.931 -12.781 -0.546 1.00 31.25 C ATOM 154 O GLU A 11 30.286 -12.578 0.615 1.00 30.30 O ATOM 155 CB GLU A 11 30.530 -11.184 -2.375 1.00 50.53 C ATOM 156 CG GLU A 11 30.008 -10.507 -3.632 1.00 2.44 C ATOM 157 CD GLU A 11 30.866 -10.795 -4.849 1.00 12.44 C ATOM 158 OE1 GLU A 11 32.066 -10.451 -4.822 1.00 63.23 O ATOM 159 OE2 GLU A 11 30.337 -11.363 -5.827 1.00 1.23 O ATOM 0 H GLU A 11 29.342 -9.612 -0.883 1.00 4.11 H new ATOM 0 HA GLU A 11 28.576 -11.995 -2.001 1.00 73.35 H new ATOM 0 HB2 GLU A 11 31.193 -10.496 -1.851 1.00 50.53 H new ATOM 0 HB3 GLU A 11 31.129 -12.049 -2.660 1.00 50.53 H new ATOM 0 HG2 GLU A 11 28.988 -10.841 -3.824 1.00 2.44 H new ATOM 0 HG3 GLU A 11 29.965 -9.430 -3.469 1.00 2.44 H new ATOM 166 N GLU A 12 29.960 -13.983 -1.112 1.00 71.35 N ATOM 167 CA GLU A 12 30.421 -15.160 -0.384 1.00 41.45 C ATOM 168 C GLU A 12 29.502 -15.464 0.795 1.00 70.51 C ATOM 169 O GLU A 12 29.938 -16.004 1.812 1.00 54.53 O ATOM 170 CB GLU A 12 31.853 -14.951 0.112 1.00 44.43 C ATOM 171 CG GLU A 12 32.717 -16.197 0.021 1.00 70.41 C ATOM 172 CD GLU A 12 33.249 -16.638 1.371 1.00 74.52 C ATOM 173 OE1 GLU A 12 32.432 -16.825 2.297 1.00 11.32 O ATOM 174 OE2 GLU A 12 34.480 -16.797 1.501 1.00 22.11 O ATOM 0 H GLU A 12 29.670 -14.168 -2.072 1.00 71.35 H new ATOM 0 HA GLU A 12 30.401 -16.010 -1.067 1.00 41.45 H new ATOM 0 HB2 GLU A 12 32.317 -14.154 -0.469 1.00 44.43 H new ATOM 0 HB3 GLU A 12 31.824 -14.614 1.148 1.00 44.43 H new ATOM 0 HG2 GLU A 12 32.135 -17.007 -0.418 1.00 70.41 H new ATOM 0 HG3 GLU A 12 33.554 -16.006 -0.650 1.00 70.41 H new ATOM 181 N ALA A 13 28.228 -15.115 0.650 1.00 0.35 N ATOM 182 CA ALA A 13 27.247 -15.352 1.702 1.00 12.30 C ATOM 183 C ALA A 13 26.743 -16.791 1.669 1.00 40.45 C ATOM 184 O ALA A 13 25.844 -17.127 0.897 1.00 21.14 O ATOM 185 CB ALA A 13 26.084 -14.380 1.567 1.00 12.04 C ATOM 0 H ALA A 13 27.851 -14.667 -0.185 1.00 0.35 H new ATOM 0 HA ALA A 13 27.734 -15.188 2.663 1.00 12.30 H new ATOM 0 HB1 ALA A 13 25.359 -14.568 2.359 1.00 12.04 H new ATOM 0 HB2 ALA A 13 26.453 -13.358 1.648 1.00 12.04 H new ATOM 0 HB3 ALA A 13 25.606 -14.517 0.597 1.00 12.04 H new ATOM 191 N LYS A 14 27.328 -17.637 2.509 1.00 21.11 N ATOM 192 CA LYS A 14 26.939 -19.041 2.577 1.00 52.41 C ATOM 193 C LYS A 14 25.449 -19.178 2.876 1.00 64.34 C ATOM 194 O LYS A 14 24.834 -18.275 3.443 1.00 33.31 O ATOM 195 CB LYS A 14 27.754 -19.766 3.650 1.00 61.12 C ATOM 196 CG LYS A 14 29.157 -20.136 3.201 1.00 61.42 C ATOM 197 CD LYS A 14 29.142 -21.312 2.238 1.00 44.31 C ATOM 198 CE LYS A 14 30.086 -21.085 1.067 1.00 51.43 C ATOM 199 NZ LYS A 14 30.948 -22.272 0.810 1.00 12.35 N ATOM 0 H LYS A 14 28.074 -17.375 3.153 1.00 21.11 H new ATOM 0 HA LYS A 14 27.141 -19.496 1.607 1.00 52.41 H new ATOM 0 HB2 LYS A 14 27.820 -19.132 4.534 1.00 61.12 H new ATOM 0 HB3 LYS A 14 27.225 -20.672 3.946 1.00 61.12 H new ATOM 0 HG2 LYS A 14 29.625 -19.277 2.720 1.00 61.42 H new ATOM 0 HG3 LYS A 14 29.765 -20.385 4.071 1.00 61.42 H new ATOM 0 HD2 LYS A 14 29.429 -22.221 2.767 1.00 44.31 H new ATOM 0 HD3 LYS A 14 28.129 -21.466 1.866 1.00 44.31 H new ATOM 0 HE2 LYS A 14 29.506 -20.857 0.173 1.00 51.43 H new ATOM 0 HE3 LYS A 14 30.714 -20.217 1.270 1.00 51.43 H new ATOM 0 HZ1 LYS A 14 31.576 -22.077 0.005 1.00 12.35 H new ATOM 0 HZ2 LYS A 14 31.520 -22.475 1.654 1.00 12.35 H new ATOM 0 HZ3 LYS A 14 30.350 -23.094 0.591 1.00 12.35 H new ATOM 213 N HIS A 15 24.876 -20.314 2.491 1.00 32.23 N ATOM 214 CA HIS A 15 23.458 -20.571 2.720 1.00 3.43 C ATOM 215 C HIS A 15 23.094 -20.342 4.184 1.00 24.33 C ATOM 216 O HIS A 15 23.661 -20.968 5.080 1.00 53.43 O ATOM 217 CB HIS A 15 23.105 -22.001 2.312 1.00 55.12 C ATOM 218 CG HIS A 15 23.352 -22.289 0.863 1.00 3.30 C ATOM 219 ND1 HIS A 15 23.597 -23.556 0.379 1.00 64.32 N ATOM 220 CD2 HIS A 15 23.390 -21.464 -0.210 1.00 2.14 C ATOM 221 CE1 HIS A 15 23.777 -23.499 -0.929 1.00 1.43 C ATOM 222 NE2 HIS A 15 23.656 -22.240 -1.311 1.00 20.02 N ATOM 0 H HIS A 15 25.371 -21.071 2.019 1.00 32.23 H new ATOM 0 HA HIS A 15 22.884 -19.875 2.108 1.00 3.43 H new ATOM 0 HB2 HIS A 15 23.687 -22.697 2.917 1.00 55.12 H new ATOM 0 HB3 HIS A 15 22.054 -22.185 2.537 1.00 55.12 H new ATOM 0 HD1 HIS A 15 23.634 -24.405 0.943 1.00 64.32 H new ATOM 0 HD2 HIS A 15 23.239 -20.395 -0.201 1.00 2.14 H new ATOM 0 HE1 HIS A 15 23.987 -24.338 -1.575 1.00 1.43 H new ATOM 230 N GLY A 16 22.146 -19.441 4.420 1.00 74.11 N ATOM 231 CA GLY A 16 21.723 -19.146 5.777 1.00 44.24 C ATOM 232 C GLY A 16 22.261 -17.819 6.275 1.00 21.13 C ATOM 233 O GLY A 16 22.125 -17.488 7.454 1.00 72.13 O ATOM 0 H GLY A 16 21.663 -18.910 3.696 1.00 74.11 H new ATOM 0 HA2 GLY A 16 20.634 -19.133 5.820 1.00 44.24 H new ATOM 0 HA3 GLY A 16 22.059 -19.943 6.441 1.00 44.24 H new ATOM 237 N THR A 17 22.876 -17.056 5.377 1.00 25.30 N ATOM 238 CA THR A 17 23.439 -15.760 5.732 1.00 3.24 C ATOM 239 C THR A 17 22.375 -14.670 5.696 1.00 15.52 C ATOM 240 O THR A 17 21.484 -14.686 4.846 1.00 0.41 O ATOM 241 CB THR A 17 24.591 -15.369 4.787 1.00 54.23 C ATOM 242 OG1 THR A 17 25.666 -16.306 4.911 1.00 43.21 O ATOM 243 CG2 THR A 17 25.094 -13.967 5.097 1.00 33.23 C ATOM 0 H THR A 17 22.997 -17.314 4.398 1.00 25.30 H new ATOM 0 HA THR A 17 23.827 -15.852 6.746 1.00 3.24 H new ATOM 0 HB THR A 17 24.213 -15.384 3.765 1.00 54.23 H new ATOM 0 HG1 THR A 17 25.340 -17.207 4.706 1.00 43.21 H new ATOM 0 HG21 THR A 17 25.907 -13.714 4.417 1.00 33.23 H new ATOM 0 HG22 THR A 17 24.280 -13.253 4.972 1.00 33.23 H new ATOM 0 HG23 THR A 17 25.455 -13.929 6.125 1.00 33.23 H new ATOM 251 N PHE A 18 22.472 -13.723 6.623 1.00 1.44 N ATOM 252 CA PHE A 18 21.516 -12.624 6.697 1.00 3.33 C ATOM 253 C PHE A 18 21.545 -11.791 5.419 1.00 4.32 C ATOM 254 O PHE A 18 22.607 -11.559 4.840 1.00 54.41 O ATOM 255 CB PHE A 18 21.821 -11.735 7.905 1.00 33.44 C ATOM 256 CG PHE A 18 21.142 -10.397 7.851 1.00 1.43 C ATOM 257 CD1 PHE A 18 19.762 -10.308 7.764 1.00 2.42 C ATOM 258 CD2 PHE A 18 21.884 -9.227 7.887 1.00 62.01 C ATOM 259 CE1 PHE A 18 19.134 -9.077 7.715 1.00 64.15 C ATOM 260 CE2 PHE A 18 21.262 -7.994 7.838 1.00 0.11 C ATOM 261 CZ PHE A 18 19.886 -7.919 7.751 1.00 54.25 C ATOM 0 H PHE A 18 23.203 -13.694 7.334 1.00 1.44 H new ATOM 0 HA PHE A 18 20.519 -13.050 6.810 1.00 3.33 H new ATOM 0 HB2 PHE A 18 21.514 -12.253 8.814 1.00 33.44 H new ATOM 0 HB3 PHE A 18 22.898 -11.584 7.972 1.00 33.44 H new ATOM 0 HD1 PHE A 18 19.170 -11.211 7.734 1.00 2.42 H new ATOM 0 HD2 PHE A 18 22.961 -9.280 7.954 1.00 62.01 H new ATOM 0 HE1 PHE A 18 18.057 -9.021 7.649 1.00 64.15 H new ATOM 0 HE2 PHE A 18 21.852 -7.090 7.868 1.00 0.11 H new ATOM 0 HZ PHE A 18 19.398 -6.956 7.711 1.00 54.25 H new ATOM 271 N VAL A 19 20.371 -11.344 4.984 1.00 4.34 N ATOM 272 CA VAL A 19 20.261 -10.536 3.776 1.00 71.15 C ATOM 273 C VAL A 19 19.459 -9.265 4.035 1.00 64.52 C ATOM 274 O VAL A 19 19.907 -8.163 3.723 1.00 14.52 O ATOM 275 CB VAL A 19 19.596 -11.325 2.632 1.00 34.33 C ATOM 276 CG1 VAL A 19 19.574 -10.499 1.355 1.00 33.23 C ATOM 277 CG2 VAL A 19 20.314 -12.647 2.410 1.00 62.45 C ATOM 0 H VAL A 19 19.483 -11.528 5.451 1.00 4.34 H new ATOM 0 HA VAL A 19 21.276 -10.268 3.481 1.00 71.15 H new ATOM 0 HB VAL A 19 18.565 -11.540 2.914 1.00 34.33 H new ATOM 0 HG11 VAL A 19 19.101 -11.073 0.558 1.00 33.23 H new ATOM 0 HG12 VAL A 19 19.011 -9.581 1.525 1.00 33.23 H new ATOM 0 HG13 VAL A 19 20.595 -10.250 1.065 1.00 33.23 H new ATOM 0 HG21 VAL A 19 19.831 -13.191 1.598 1.00 62.45 H new ATOM 0 HG22 VAL A 19 21.355 -12.456 2.150 1.00 62.45 H new ATOM 0 HG23 VAL A 19 20.271 -13.242 3.322 1.00 62.45 H new ATOM 287 N GLY A 20 18.271 -9.428 4.609 1.00 70.45 N ATOM 288 CA GLY A 20 17.425 -8.286 4.901 1.00 45.32 C ATOM 289 C GLY A 20 15.996 -8.686 5.209 1.00 4.24 C ATOM 290 O GLY A 20 15.351 -9.370 4.415 1.00 52.30 O ATOM 0 H GLY A 20 17.879 -10.331 4.877 1.00 70.45 H new ATOM 0 HA2 GLY A 20 17.837 -7.740 5.750 1.00 45.32 H new ATOM 0 HA3 GLY A 20 17.433 -7.605 4.050 1.00 45.32 H new ATOM 294 N ARG A 21 15.501 -8.260 6.367 1.00 23.41 N ATOM 295 CA ARG A 21 14.140 -8.581 6.780 1.00 43.00 C ATOM 296 C ARG A 21 13.150 -8.301 5.653 1.00 1.34 C ATOM 297 O ARG A 21 12.796 -7.149 5.397 1.00 31.54 O ATOM 298 CB ARG A 21 13.758 -7.774 8.022 1.00 11.10 C ATOM 299 CG ARG A 21 14.213 -6.325 7.971 1.00 43.34 C ATOM 300 CD ARG A 21 15.451 -6.099 8.825 1.00 61.13 C ATOM 301 NE ARG A 21 15.135 -5.421 10.079 1.00 53.23 N ATOM 302 CZ ARG A 21 16.026 -5.194 11.037 1.00 43.22 C ATOM 303 NH1 ARG A 21 17.283 -5.589 10.885 1.00 51.54 N ATOM 304 NH2 ARG A 21 15.662 -4.570 12.150 1.00 72.11 N ATOM 0 H ARG A 21 16.022 -7.692 7.035 1.00 23.41 H new ATOM 0 HA ARG A 21 14.100 -9.644 7.019 1.00 43.00 H new ATOM 0 HB2 ARG A 21 12.675 -7.802 8.144 1.00 11.10 H new ATOM 0 HB3 ARG A 21 14.190 -8.251 8.902 1.00 11.10 H new ATOM 0 HG2 ARG A 21 14.426 -6.045 6.939 1.00 43.34 H new ATOM 0 HG3 ARG A 21 13.408 -5.677 8.317 1.00 43.34 H new ATOM 0 HD2 ARG A 21 15.923 -7.058 9.040 1.00 61.13 H new ATOM 0 HD3 ARG A 21 16.174 -5.506 8.265 1.00 61.13 H new ATOM 0 HE ARG A 21 14.177 -5.104 10.227 1.00 53.23 H new ATOM 0 HH11 ARG A 21 17.567 -6.068 10.031 1.00 51.54 H new ATOM 0 HH12 ARG A 21 17.965 -5.413 11.622 1.00 51.54 H new ATOM 0 HH21 ARG A 21 14.697 -4.264 12.271 1.00 72.11 H new ATOM 0 HH22 ARG A 21 16.348 -4.396 12.885 1.00 72.11 H new ATOM 318 N ILE A 22 12.708 -9.360 4.984 1.00 1.00 N ATOM 319 CA ILE A 22 11.759 -9.228 3.886 1.00 52.51 C ATOM 320 C ILE A 22 10.359 -8.915 4.404 1.00 41.31 C ATOM 321 O ILE A 22 9.625 -8.130 3.804 1.00 61.23 O ATOM 322 CB ILE A 22 11.704 -10.508 3.032 1.00 74.01 C ATOM 323 CG1 ILE A 22 10.534 -10.441 2.047 1.00 4.43 C ATOM 324 CG2 ILE A 22 11.582 -11.735 3.924 1.00 41.42 C ATOM 325 CD1 ILE A 22 10.715 -11.325 0.833 1.00 10.33 C ATOM 0 H ILE A 22 12.992 -10.319 5.183 1.00 1.00 H new ATOM 0 HA ILE A 22 12.107 -8.402 3.266 1.00 52.51 H new ATOM 0 HB ILE A 22 12.630 -10.587 2.462 1.00 74.01 H new ATOM 0 HG12 ILE A 22 9.618 -10.729 2.563 1.00 4.43 H new ATOM 0 HG13 ILE A 22 10.404 -9.410 1.719 1.00 4.43 H new ATOM 0 HG21 ILE A 22 11.544 -12.632 3.306 1.00 41.42 H new ATOM 0 HG22 ILE A 22 12.444 -11.789 4.589 1.00 41.42 H new ATOM 0 HG23 ILE A 22 10.670 -11.664 4.517 1.00 41.42 H new ATOM 0 HD11 ILE A 22 9.848 -11.227 0.179 1.00 10.33 H new ATOM 0 HD12 ILE A 22 11.613 -11.023 0.294 1.00 10.33 H new ATOM 0 HD13 ILE A 22 10.815 -12.363 1.150 1.00 10.33 H new ATOM 337 N ALA A 23 9.997 -9.532 5.523 1.00 34.53 N ATOM 338 CA ALA A 23 8.687 -9.317 6.125 1.00 74.01 C ATOM 339 C ALA A 23 8.576 -7.914 6.712 1.00 21.11 C ATOM 340 O ALA A 23 7.657 -7.165 6.383 1.00 11.01 O ATOM 341 CB ALA A 23 8.420 -10.363 7.197 1.00 11.35 C ATOM 0 H ALA A 23 10.593 -10.185 6.032 1.00 34.53 H new ATOM 0 HA ALA A 23 7.935 -9.415 5.342 1.00 74.01 H new ATOM 0 HB1 ALA A 23 7.438 -10.190 7.638 1.00 11.35 H new ATOM 0 HB2 ALA A 23 8.447 -11.357 6.750 1.00 11.35 H new ATOM 0 HB3 ALA A 23 9.183 -10.293 7.972 1.00 11.35 H new ATOM 347 N GLN A 24 9.518 -7.566 7.583 1.00 61.22 N ATOM 348 CA GLN A 24 9.525 -6.253 8.216 1.00 15.05 C ATOM 349 C GLN A 24 9.492 -5.144 7.170 1.00 4.44 C ATOM 350 O GLN A 24 8.790 -4.145 7.331 1.00 23.25 O ATOM 351 CB GLN A 24 10.761 -6.098 9.104 1.00 14.40 C ATOM 352 CG GLN A 24 10.458 -5.502 10.470 1.00 61.24 C ATOM 353 CD GLN A 24 10.594 -3.992 10.491 1.00 33.40 C ATOM 354 OE1 GLN A 24 11.541 -3.435 9.936 1.00 1.34 O ATOM 355 NE2 GLN A 24 9.644 -3.322 11.133 1.00 4.41 N ATOM 0 H GLN A 24 10.286 -8.175 7.866 1.00 61.22 H new ATOM 0 HA GLN A 24 8.631 -6.170 8.834 1.00 15.05 H new ATOM 0 HB2 GLN A 24 11.227 -7.074 9.238 1.00 14.40 H new ATOM 0 HB3 GLN A 24 11.488 -5.466 8.594 1.00 14.40 H new ATOM 0 HG2 GLN A 24 9.445 -5.776 10.765 1.00 61.24 H new ATOM 0 HG3 GLN A 24 11.133 -5.934 11.209 1.00 61.24 H new ATOM 0 HE21 GLN A 24 8.877 -3.826 11.579 1.00 4.41 H new ATOM 0 HE22 GLN A 24 9.681 -2.304 11.180 1.00 4.41 H new ATOM 364 N ASP A 25 10.257 -5.325 6.099 1.00 31.13 N ATOM 365 CA ASP A 25 10.316 -4.340 5.026 1.00 54.31 C ATOM 366 C ASP A 25 9.027 -4.348 4.209 1.00 21.32 C ATOM 367 O ASP A 25 8.690 -3.363 3.552 1.00 73.05 O ATOM 368 CB ASP A 25 11.513 -4.617 4.115 1.00 10.55 C ATOM 369 CG ASP A 25 12.838 -4.380 4.814 1.00 71.54 C ATOM 370 OD1 ASP A 25 12.829 -4.142 6.040 1.00 73.14 O ATOM 371 OD2 ASP A 25 13.884 -4.435 4.134 1.00 10.01 O ATOM 0 H ASP A 25 10.845 -6.145 5.951 1.00 31.13 H new ATOM 0 HA ASP A 25 10.433 -3.355 5.477 1.00 54.31 H new ATOM 0 HB2 ASP A 25 11.469 -5.648 3.765 1.00 10.55 H new ATOM 0 HB3 ASP A 25 11.451 -3.979 3.234 1.00 10.55 H new ATOM 376 N LEU A 26 8.312 -5.467 4.255 1.00 54.43 N ATOM 377 CA LEU A 26 7.060 -5.604 3.518 1.00 31.52 C ATOM 378 C LEU A 26 5.910 -4.943 4.271 1.00 73.05 C ATOM 379 O LEU A 26 5.043 -4.311 3.669 1.00 74.14 O ATOM 380 CB LEU A 26 6.746 -7.082 3.280 1.00 35.50 C ATOM 381 CG LEU A 26 6.957 -7.592 1.854 1.00 73.20 C ATOM 382 CD1 LEU A 26 8.364 -7.270 1.375 1.00 74.32 C ATOM 383 CD2 LEU A 26 6.695 -9.089 1.779 1.00 61.44 C ATOM 0 H LEU A 26 8.577 -6.291 4.794 1.00 54.43 H new ATOM 0 HA LEU A 26 7.175 -5.103 2.557 1.00 31.52 H new ATOM 0 HB2 LEU A 26 7.364 -7.677 3.952 1.00 35.50 H new ATOM 0 HB3 LEU A 26 5.708 -7.262 3.559 1.00 35.50 H new ATOM 0 HG LEU A 26 6.248 -7.086 1.199 1.00 73.20 H new ATOM 0 HD11 LEU A 26 8.496 -7.640 0.358 1.00 74.32 H new ATOM 0 HD12 LEU A 26 8.516 -6.191 1.390 1.00 74.32 H new ATOM 0 HD13 LEU A 26 9.090 -7.748 2.032 1.00 74.32 H new ATOM 0 HD21 LEU A 26 6.850 -9.435 0.757 1.00 61.44 H new ATOM 0 HD22 LEU A 26 7.380 -9.612 2.447 1.00 61.44 H new ATOM 0 HD23 LEU A 26 5.668 -9.294 2.080 1.00 61.44 H new ATOM 395 N GLY A 27 5.910 -5.092 5.592 1.00 43.51 N ATOM 396 CA GLY A 27 4.863 -4.501 6.405 1.00 24.22 C ATOM 397 C GLY A 27 3.702 -5.449 6.633 1.00 42.54 C ATOM 398 O GLY A 27 2.540 -5.060 6.507 1.00 41.14 O ATOM 0 H GLY A 27 6.616 -5.611 6.114 1.00 43.51 H new ATOM 0 HA2 GLY A 27 5.279 -4.203 7.367 1.00 24.22 H new ATOM 0 HA3 GLY A 27 4.499 -3.595 5.921 1.00 24.22 H new ATOM 402 N LEU A 28 4.015 -6.696 6.967 1.00 11.50 N ATOM 403 CA LEU A 28 2.988 -7.703 7.211 1.00 42.30 C ATOM 404 C LEU A 28 3.234 -8.422 8.533 1.00 24.22 C ATOM 405 O LEU A 28 4.130 -8.055 9.293 1.00 50.32 O ATOM 406 CB LEU A 28 2.956 -8.715 6.065 1.00 63.04 C ATOM 407 CG LEU A 28 3.691 -8.306 4.788 1.00 64.34 C ATOM 408 CD1 LEU A 28 3.777 -9.479 3.823 1.00 42.44 C ATOM 409 CD2 LEU A 28 3.000 -7.121 4.130 1.00 75.30 C ATOM 0 H LEU A 28 4.971 -7.034 7.075 1.00 11.50 H new ATOM 0 HA LEU A 28 2.024 -7.197 7.268 1.00 42.30 H new ATOM 0 HB2 LEU A 28 3.383 -9.652 6.422 1.00 63.04 H new ATOM 0 HB3 LEU A 28 1.915 -8.915 5.813 1.00 63.04 H new ATOM 0 HG LEU A 28 4.704 -8.006 5.055 1.00 64.34 H new ATOM 0 HD11 LEU A 28 4.303 -9.169 2.920 1.00 42.44 H new ATOM 0 HD12 LEU A 28 4.318 -10.299 4.295 1.00 42.44 H new ATOM 0 HD13 LEU A 28 2.772 -9.810 3.562 1.00 42.44 H new ATOM 0 HD21 LEU A 28 3.537 -6.844 3.223 1.00 75.30 H new ATOM 0 HD22 LEU A 28 1.975 -7.392 3.876 1.00 75.30 H new ATOM 0 HD23 LEU A 28 2.992 -6.276 4.819 1.00 75.30 H new ATOM 421 N GLU A 29 2.435 -9.450 8.800 1.00 73.23 N ATOM 422 CA GLU A 29 2.568 -10.222 10.030 1.00 54.32 C ATOM 423 C GLU A 29 3.266 -11.552 9.765 1.00 72.53 C ATOM 424 O GLU A 29 2.947 -12.253 8.803 1.00 62.01 O ATOM 425 CB GLU A 29 1.193 -10.470 10.653 1.00 34.04 C ATOM 426 CG GLU A 29 1.119 -10.111 12.128 1.00 23.41 C ATOM 427 CD GLU A 29 -0.306 -9.961 12.622 1.00 55.53 C ATOM 428 OE1 GLU A 29 -1.024 -10.981 12.683 1.00 64.34 O ATOM 429 OE2 GLU A 29 -0.705 -8.823 12.947 1.00 52.24 O ATOM 0 H GLU A 29 1.689 -9.768 8.181 1.00 73.23 H new ATOM 0 HA GLU A 29 3.176 -9.645 10.727 1.00 54.32 H new ATOM 0 HB2 GLU A 29 0.447 -9.891 10.109 1.00 34.04 H new ATOM 0 HB3 GLU A 29 0.932 -11.521 10.530 1.00 34.04 H new ATOM 0 HG2 GLU A 29 1.622 -10.882 12.711 1.00 23.41 H new ATOM 0 HG3 GLU A 29 1.658 -9.179 12.299 1.00 23.41 H new ATOM 436 N LEU A 30 4.220 -11.895 10.623 1.00 12.55 N ATOM 437 CA LEU A 30 4.965 -13.141 10.483 1.00 34.00 C ATOM 438 C LEU A 30 4.029 -14.344 10.545 1.00 23.34 C ATOM 439 O LEU A 30 4.325 -15.404 9.992 1.00 31.24 O ATOM 440 CB LEU A 30 6.027 -13.249 11.578 1.00 21.31 C ATOM 441 CG LEU A 30 7.481 -13.238 11.106 1.00 64.42 C ATOM 442 CD1 LEU A 30 7.835 -14.556 10.434 1.00 35.44 C ATOM 443 CD2 LEU A 30 7.726 -12.073 10.158 1.00 14.14 C ATOM 0 H LEU A 30 4.496 -11.327 11.424 1.00 12.55 H new ATOM 0 HA LEU A 30 5.456 -13.135 9.510 1.00 34.00 H new ATOM 0 HB2 LEU A 30 5.886 -12.423 12.276 1.00 21.31 H new ATOM 0 HB3 LEU A 30 5.854 -14.170 12.135 1.00 21.31 H new ATOM 0 HG LEU A 30 8.124 -13.113 11.978 1.00 64.42 H new ATOM 0 HD11 LEU A 30 8.874 -14.529 10.105 1.00 35.44 H new ATOM 0 HD12 LEU A 30 7.700 -15.373 11.142 1.00 35.44 H new ATOM 0 HD13 LEU A 30 7.185 -14.711 9.573 1.00 35.44 H new ATOM 0 HD21 LEU A 30 8.766 -12.081 9.832 1.00 14.14 H new ATOM 0 HD22 LEU A 30 7.073 -12.167 9.290 1.00 14.14 H new ATOM 0 HD23 LEU A 30 7.514 -11.135 10.672 1.00 14.14 H new ATOM 455 N THR A 31 2.897 -14.173 11.221 1.00 61.00 N ATOM 456 CA THR A 31 1.917 -15.244 11.355 1.00 45.22 C ATOM 457 C THR A 31 0.830 -15.131 10.292 1.00 5.51 C ATOM 458 O THR A 31 -0.118 -15.915 10.276 1.00 44.32 O ATOM 459 CB THR A 31 1.261 -15.233 12.748 1.00 34.20 C ATOM 460 OG1 THR A 31 0.804 -13.913 13.064 1.00 31.54 O ATOM 461 CG2 THR A 31 2.240 -15.705 13.812 1.00 43.11 C ATOM 0 H THR A 31 2.636 -13.303 11.684 1.00 61.00 H new ATOM 0 HA THR A 31 2.454 -16.183 11.222 1.00 45.22 H new ATOM 0 HB THR A 31 0.412 -15.916 12.730 1.00 34.20 H new ATOM 0 HG1 THR A 31 0.387 -13.915 13.951 1.00 31.54 H new ATOM 0 HG21 THR A 31 1.753 -15.688 14.787 1.00 43.11 H new ATOM 0 HG22 THR A 31 2.562 -16.721 13.585 1.00 43.11 H new ATOM 0 HG23 THR A 31 3.107 -15.044 13.828 1.00 43.11 H new ATOM 469 N GLU A 32 0.975 -14.150 9.406 1.00 23.20 N ATOM 470 CA GLU A 32 0.004 -13.936 8.340 1.00 42.43 C ATOM 471 C GLU A 32 0.528 -14.471 7.010 1.00 5.14 C ATOM 472 O GLU A 32 -0.216 -14.579 6.035 1.00 45.04 O ATOM 473 CB GLU A 32 -0.322 -12.446 8.209 1.00 34.41 C ATOM 474 CG GLU A 32 -1.283 -11.939 9.271 1.00 11.42 C ATOM 475 CD GLU A 32 -2.731 -12.254 8.947 1.00 5.41 C ATOM 476 OE1 GLU A 32 -3.046 -13.442 8.731 1.00 23.44 O ATOM 477 OE2 GLU A 32 -3.548 -11.310 8.910 1.00 73.33 O ATOM 0 H GLU A 32 1.754 -13.492 9.406 1.00 23.20 H new ATOM 0 HA GLU A 32 -0.905 -14.479 8.598 1.00 42.43 H new ATOM 0 HB2 GLU A 32 0.604 -11.874 8.265 1.00 34.41 H new ATOM 0 HB3 GLU A 32 -0.751 -12.262 7.224 1.00 34.41 H new ATOM 0 HG2 GLU A 32 -1.025 -12.384 10.232 1.00 11.42 H new ATOM 0 HG3 GLU A 32 -1.165 -10.861 9.377 1.00 11.42 H new ATOM 484 N LEU A 33 1.814 -14.804 6.979 1.00 21.15 N ATOM 485 CA LEU A 33 2.440 -15.328 5.770 1.00 12.12 C ATOM 486 C LEU A 33 1.877 -16.701 5.417 1.00 25.01 C ATOM 487 O LEU A 33 1.611 -16.993 4.251 1.00 31.43 O ATOM 488 CB LEU A 33 3.956 -15.417 5.954 1.00 12.14 C ATOM 489 CG LEU A 33 4.675 -14.099 6.244 1.00 63.13 C ATOM 490 CD1 LEU A 33 5.801 -14.314 7.243 1.00 1.14 C ATOM 491 CD2 LEU A 33 5.212 -13.491 4.956 1.00 12.52 C ATOM 0 H LEU A 33 2.443 -14.720 7.777 1.00 21.15 H new ATOM 0 HA LEU A 33 2.220 -14.644 4.951 1.00 12.12 H new ATOM 0 HB2 LEU A 33 4.163 -16.108 6.771 1.00 12.14 H new ATOM 0 HB3 LEU A 33 4.387 -15.852 5.052 1.00 12.14 H new ATOM 0 HG LEU A 33 3.958 -13.404 6.680 1.00 63.13 H new ATOM 0 HD11 LEU A 33 6.301 -13.365 7.437 1.00 1.14 H new ATOM 0 HD12 LEU A 33 5.391 -14.705 8.174 1.00 1.14 H new ATOM 0 HD13 LEU A 33 6.519 -15.026 6.835 1.00 1.14 H new ATOM 0 HD21 LEU A 33 5.721 -12.554 5.181 1.00 12.52 H new ATOM 0 HD22 LEU A 33 5.915 -14.183 4.492 1.00 12.52 H new ATOM 0 HD23 LEU A 33 4.385 -13.300 4.271 1.00 12.52 H new ATOM 503 N VAL A 34 1.697 -17.540 6.432 1.00 23.13 N ATOM 504 CA VAL A 34 1.163 -18.881 6.230 1.00 61.52 C ATOM 505 C VAL A 34 -0.152 -18.839 5.460 1.00 14.15 C ATOM 506 O VAL A 34 -0.296 -19.436 4.393 1.00 3.42 O ATOM 507 CB VAL A 34 0.937 -19.604 7.571 1.00 25.12 C ATOM 508 CG1 VAL A 34 -0.227 -20.577 7.465 1.00 51.33 C ATOM 509 CG2 VAL A 34 2.205 -20.323 8.009 1.00 52.25 C ATOM 0 H VAL A 34 1.913 -17.314 7.403 1.00 23.13 H new ATOM 0 HA VAL A 34 1.903 -19.432 5.650 1.00 61.52 H new ATOM 0 HB VAL A 34 0.689 -18.859 8.327 1.00 25.12 H new ATOM 0 HG11 VAL A 34 -0.371 -21.078 8.422 1.00 51.33 H new ATOM 0 HG12 VAL A 34 -1.133 -20.032 7.201 1.00 51.33 H new ATOM 0 HG13 VAL A 34 -0.012 -21.319 6.696 1.00 51.33 H new ATOM 0 HG21 VAL A 34 2.027 -20.828 8.958 1.00 52.25 H new ATOM 0 HG22 VAL A 34 2.486 -21.057 7.254 1.00 52.25 H new ATOM 0 HG23 VAL A 34 3.011 -19.599 8.129 1.00 52.25 H new ATOM 519 N PRO A 35 -1.138 -18.116 6.013 1.00 2.01 N ATOM 520 CA PRO A 35 -2.460 -17.977 5.395 1.00 2.21 C ATOM 521 C PRO A 35 -2.420 -17.133 4.125 1.00 32.24 C ATOM 522 O PRO A 35 -3.356 -17.155 3.325 1.00 4.44 O ATOM 523 CB PRO A 35 -3.285 -17.276 6.477 1.00 32.01 C ATOM 524 CG PRO A 35 -2.285 -16.539 7.299 1.00 43.02 C ATOM 525 CD PRO A 35 -1.037 -17.378 7.284 1.00 72.34 C ATOM 0 HA PRO A 35 -2.868 -18.939 5.084 1.00 2.21 H new ATOM 0 HB2 PRO A 35 -4.016 -16.596 6.039 1.00 32.01 H new ATOM 0 HB3 PRO A 35 -3.840 -17.995 7.080 1.00 32.01 H new ATOM 0 HG2 PRO A 35 -2.094 -15.549 6.886 1.00 43.02 H new ATOM 0 HG3 PRO A 35 -2.647 -16.396 8.317 1.00 43.02 H new ATOM 0 HD2 PRO A 35 -0.138 -16.762 7.321 1.00 72.34 H new ATOM 0 HD3 PRO A 35 -0.996 -18.053 8.139 1.00 72.34 H new ATOM 533 N ARG A 36 -1.332 -16.392 3.947 1.00 42.22 N ATOM 534 CA ARG A 36 -1.171 -15.540 2.774 1.00 33.52 C ATOM 535 C ARG A 36 -0.524 -16.311 1.627 1.00 22.24 C ATOM 536 O ARG A 36 -0.205 -15.740 0.583 1.00 31.44 O ATOM 537 CB ARG A 36 -0.325 -14.314 3.120 1.00 13.31 C ATOM 538 CG ARG A 36 -1.135 -13.151 3.670 1.00 51.24 C ATOM 539 CD ARG A 36 -0.269 -11.918 3.878 1.00 31.33 C ATOM 540 NE ARG A 36 -0.665 -11.165 5.065 1.00 34.42 N ATOM 541 CZ ARG A 36 -1.814 -10.506 5.168 1.00 71.23 C ATOM 542 NH1 ARG A 36 -2.675 -10.508 4.160 1.00 53.43 N ATOM 543 NH2 ARG A 36 -2.104 -9.844 6.281 1.00 65.23 N ATOM 0 H ARG A 36 -0.549 -16.364 4.600 1.00 42.22 H new ATOM 0 HA ARG A 36 -2.160 -15.212 2.456 1.00 33.52 H new ATOM 0 HB2 ARG A 36 0.430 -14.599 3.853 1.00 13.31 H new ATOM 0 HB3 ARG A 36 0.206 -13.986 2.227 1.00 13.31 H new ATOM 0 HG2 ARG A 36 -1.947 -12.915 2.983 1.00 51.24 H new ATOM 0 HG3 ARG A 36 -1.592 -13.440 4.616 1.00 51.24 H new ATOM 0 HD2 ARG A 36 0.774 -12.219 3.971 1.00 31.33 H new ATOM 0 HD3 ARG A 36 -0.338 -11.275 3.001 1.00 31.33 H new ATOM 0 HE ARG A 36 -0.024 -11.144 5.858 1.00 34.42 H new ATOM 0 HH11 ARG A 36 -2.456 -11.016 3.303 1.00 53.43 H new ATOM 0 HH12 ARG A 36 -3.557 -10.001 4.241 1.00 53.43 H new ATOM 0 HH21 ARG A 36 -1.444 -9.841 7.059 1.00 65.23 H new ATOM 0 HH22 ARG A 36 -2.987 -9.339 6.358 1.00 65.23 H new ATOM 557 N LEU A 37 -0.332 -17.610 1.829 1.00 62.14 N ATOM 558 CA LEU A 37 0.278 -18.460 0.812 1.00 42.12 C ATOM 559 C LEU A 37 1.539 -17.813 0.247 1.00 71.45 C ATOM 560 O LEU A 37 1.663 -17.623 -0.964 1.00 35.24 O ATOM 561 CB LEU A 37 -0.718 -18.734 -0.316 1.00 62.23 C ATOM 562 CG LEU A 37 -1.670 -19.910 -0.099 1.00 74.44 C ATOM 563 CD1 LEU A 37 -0.892 -21.210 0.033 1.00 31.24 C ATOM 564 CD2 LEU A 37 -2.535 -19.676 1.131 1.00 72.43 C ATOM 0 H LEU A 37 -0.590 -18.098 2.687 1.00 62.14 H new ATOM 0 HA LEU A 37 0.555 -19.404 1.281 1.00 42.12 H new ATOM 0 HB2 LEU A 37 -1.313 -17.835 -0.474 1.00 62.23 H new ATOM 0 HB3 LEU A 37 -0.157 -18.911 -1.234 1.00 62.23 H new ATOM 0 HG LEU A 37 -2.323 -19.989 -0.968 1.00 74.44 H new ATOM 0 HD11 LEU A 37 -1.587 -22.036 0.187 1.00 31.24 H new ATOM 0 HD12 LEU A 37 -0.317 -21.384 -0.877 1.00 31.24 H new ATOM 0 HD13 LEU A 37 -0.214 -21.143 0.884 1.00 31.24 H new ATOM 0 HD21 LEU A 37 -3.207 -20.523 1.270 1.00 72.43 H new ATOM 0 HD22 LEU A 37 -1.898 -19.570 2.009 1.00 72.43 H new ATOM 0 HD23 LEU A 37 -3.121 -18.767 0.996 1.00 72.43 H new ATOM 576 N PHE A 38 2.474 -17.479 1.130 1.00 35.52 N ATOM 577 CA PHE A 38 3.726 -16.856 0.719 1.00 11.44 C ATOM 578 C PHE A 38 4.503 -17.767 -0.225 1.00 65.24 C ATOM 579 O PHE A 38 4.633 -18.967 0.019 1.00 0.21 O ATOM 580 CB PHE A 38 4.581 -16.524 1.944 1.00 13.43 C ATOM 581 CG PHE A 38 5.221 -15.166 1.879 1.00 74.34 C ATOM 582 CD1 PHE A 38 4.445 -14.018 1.895 1.00 73.50 C ATOM 583 CD2 PHE A 38 6.598 -15.038 1.800 1.00 20.31 C ATOM 584 CE1 PHE A 38 5.030 -12.768 1.835 1.00 4.11 C ATOM 585 CE2 PHE A 38 7.189 -13.790 1.740 1.00 23.54 C ATOM 586 CZ PHE A 38 6.405 -12.654 1.757 1.00 55.13 C ATOM 0 H PHE A 38 2.388 -17.630 2.135 1.00 35.52 H new ATOM 0 HA PHE A 38 3.487 -15.933 0.190 1.00 11.44 H new ATOM 0 HB2 PHE A 38 3.959 -16.581 2.837 1.00 13.43 H new ATOM 0 HB3 PHE A 38 5.360 -17.279 2.049 1.00 13.43 H new ATOM 0 HD1 PHE A 38 3.370 -14.102 1.955 1.00 73.50 H new ATOM 0 HD2 PHE A 38 7.217 -15.923 1.785 1.00 20.31 H new ATOM 0 HE1 PHE A 38 4.414 -11.881 1.849 1.00 4.11 H new ATOM 0 HE2 PHE A 38 8.264 -13.704 1.680 1.00 23.54 H new ATOM 0 HZ PHE A 38 6.865 -11.678 1.709 1.00 55.13 H new ATOM 596 N ARG A 39 5.018 -17.189 -1.306 1.00 3.14 N ATOM 597 CA ARG A 39 5.781 -17.949 -2.289 1.00 4.44 C ATOM 598 C ARG A 39 6.850 -17.076 -2.940 1.00 3.33 C ATOM 599 O ARG A 39 6.602 -15.917 -3.274 1.00 72.32 O ATOM 600 CB ARG A 39 4.850 -18.517 -3.360 1.00 74.33 C ATOM 601 CG ARG A 39 4.420 -19.951 -3.095 1.00 52.13 C ATOM 602 CD ARG A 39 3.725 -20.557 -4.305 1.00 13.44 C ATOM 603 NE ARG A 39 3.162 -21.872 -4.011 1.00 1.14 N ATOM 604 CZ ARG A 39 2.444 -22.575 -4.879 1.00 53.32 C ATOM 605 NH1 ARG A 39 2.202 -22.091 -6.090 1.00 1.13 N ATOM 606 NH2 ARG A 39 1.966 -23.765 -4.538 1.00 13.54 N ATOM 0 H ARG A 39 4.921 -16.197 -1.523 1.00 3.14 H new ATOM 0 HA ARG A 39 6.274 -18.772 -1.772 1.00 4.44 H new ATOM 0 HB2 ARG A 39 3.963 -17.887 -3.429 1.00 74.33 H new ATOM 0 HB3 ARG A 39 5.351 -18.470 -4.327 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.292 -20.552 -2.836 1.00 52.13 H new ATOM 0 HG3 ARG A 39 3.748 -19.978 -2.237 1.00 52.13 H new ATOM 0 HD2 ARG A 39 2.931 -19.889 -4.639 1.00 13.44 H new ATOM 0 HD3 ARG A 39 4.436 -20.643 -5.126 1.00 13.44 H new ATOM 0 HE ARG A 39 3.330 -22.273 -3.088 1.00 1.14 H new ATOM 0 HH11 ARG A 39 2.568 -21.177 -6.356 1.00 1.13 H new ATOM 0 HH12 ARG A 39 1.650 -22.633 -6.755 1.00 1.13 H new ATOM 0 HH21 ARG A 39 2.150 -24.141 -3.608 1.00 13.54 H new ATOM 0 HH22 ARG A 39 1.415 -24.304 -5.206 1.00 13.54 H new ATOM 620 N VAL A 40 8.041 -17.640 -3.116 1.00 50.21 N ATOM 621 CA VAL A 40 9.148 -16.914 -3.727 1.00 52.23 C ATOM 622 C VAL A 40 9.362 -17.353 -5.172 1.00 0.45 C ATOM 623 O VAL A 40 9.321 -18.543 -5.482 1.00 13.31 O ATOM 624 CB VAL A 40 10.456 -17.119 -2.941 1.00 1.34 C ATOM 625 CG1 VAL A 40 11.574 -16.275 -3.534 1.00 11.22 C ATOM 626 CG2 VAL A 40 10.250 -16.788 -1.470 1.00 63.31 C ATOM 0 H VAL A 40 8.264 -18.597 -2.844 1.00 50.21 H new ATOM 0 HA VAL A 40 8.883 -15.857 -3.707 1.00 52.23 H new ATOM 0 HB VAL A 40 10.745 -18.167 -3.018 1.00 1.34 H new ATOM 0 HG11 VAL A 40 12.490 -16.433 -2.965 1.00 11.22 H new ATOM 0 HG12 VAL A 40 11.737 -16.564 -4.572 1.00 11.22 H new ATOM 0 HG13 VAL A 40 11.297 -15.222 -3.490 1.00 11.22 H new ATOM 0 HG21 VAL A 40 11.184 -16.938 -0.929 1.00 63.31 H new ATOM 0 HG22 VAL A 40 9.937 -15.749 -1.371 1.00 63.31 H new ATOM 0 HG23 VAL A 40 9.481 -17.440 -1.055 1.00 63.31 H new ATOM 636 N ALA A 41 9.592 -16.383 -6.051 1.00 35.00 N ATOM 637 CA ALA A 41 9.815 -16.669 -7.463 1.00 30.24 C ATOM 638 C ALA A 41 10.851 -15.722 -8.058 1.00 2.24 C ATOM 639 O ALA A 41 10.573 -14.544 -8.282 1.00 73.04 O ATOM 640 CB ALA A 41 8.507 -16.575 -8.234 1.00 33.13 C ATOM 0 H ALA A 41 9.629 -15.393 -5.810 1.00 35.00 H new ATOM 0 HA ALA A 41 10.200 -17.685 -7.546 1.00 30.24 H new ATOM 0 HB1 ALA A 41 8.689 -16.791 -9.287 1.00 33.13 H new ATOM 0 HB2 ALA A 41 7.796 -17.297 -7.833 1.00 33.13 H new ATOM 0 HB3 ALA A 41 8.098 -15.570 -8.135 1.00 33.13 H new ATOM 646 N SER A 42 12.047 -16.243 -8.310 1.00 25.44 N ATOM 647 CA SER A 42 13.127 -15.442 -8.874 1.00 61.34 C ATOM 648 C SER A 42 13.213 -15.635 -10.385 1.00 42.25 C ATOM 649 O SER A 42 12.752 -16.642 -10.923 1.00 15.15 O ATOM 650 CB SER A 42 14.461 -15.815 -8.225 1.00 20.14 C ATOM 651 OG SER A 42 15.493 -15.900 -9.192 1.00 23.43 O ATOM 0 H SER A 42 12.293 -17.217 -8.132 1.00 25.44 H new ATOM 0 HA SER A 42 12.913 -14.393 -8.670 1.00 61.34 H new ATOM 0 HB2 SER A 42 14.724 -15.071 -7.473 1.00 20.14 H new ATOM 0 HB3 SER A 42 14.363 -16.770 -7.708 1.00 20.14 H new ATOM 0 HG SER A 42 15.625 -15.022 -9.607 1.00 23.43 H new ATOM 657 N LYS A 43 13.808 -14.661 -11.067 1.00 30.25 N ATOM 658 CA LYS A 43 13.957 -14.721 -12.516 1.00 22.33 C ATOM 659 C LYS A 43 15.268 -15.400 -12.900 1.00 21.10 C ATOM 660 O LYS A 43 15.303 -16.238 -13.801 1.00 21.41 O ATOM 661 CB LYS A 43 13.905 -13.313 -13.113 1.00 64.32 C ATOM 662 CG LYS A 43 12.666 -13.053 -13.951 1.00 75.41 C ATOM 663 CD LYS A 43 12.878 -13.456 -15.401 1.00 33.12 C ATOM 664 CE LYS A 43 11.862 -12.793 -16.318 1.00 12.40 C ATOM 665 NZ LYS A 43 10.500 -13.372 -16.148 1.00 43.54 N ATOM 0 H LYS A 43 14.195 -13.820 -10.638 1.00 30.25 H new ATOM 0 HA LYS A 43 13.132 -15.310 -12.918 1.00 22.33 H new ATOM 0 HB2 LYS A 43 13.946 -12.583 -12.305 1.00 64.32 H new ATOM 0 HB3 LYS A 43 14.790 -13.156 -13.730 1.00 64.32 H new ATOM 0 HG2 LYS A 43 11.823 -13.608 -13.538 1.00 75.41 H new ATOM 0 HG3 LYS A 43 12.407 -11.995 -13.901 1.00 75.41 H new ATOM 0 HD2 LYS A 43 13.885 -13.180 -15.713 1.00 33.12 H new ATOM 0 HD3 LYS A 43 12.801 -14.539 -15.494 1.00 33.12 H new ATOM 0 HE2 LYS A 43 11.830 -11.723 -16.111 1.00 12.40 H new ATOM 0 HE3 LYS A 43 12.179 -12.908 -17.355 1.00 12.40 H new ATOM 0 HZ1 LYS A 43 9.837 -12.893 -16.790 1.00 43.54 H new ATOM 0 HZ2 LYS A 43 10.524 -14.388 -16.370 1.00 43.54 H new ATOM 0 HZ3 LYS A 43 10.187 -13.240 -15.165 1.00 43.54 H new ATOM 679 N ASP A 44 16.343 -15.034 -12.211 1.00 11.24 N ATOM 680 CA ASP A 44 17.656 -15.610 -12.478 1.00 53.41 C ATOM 681 C ASP A 44 17.594 -17.134 -12.464 1.00 53.21 C ATOM 682 O ASP A 44 17.623 -17.776 -13.514 1.00 41.32 O ATOM 683 CB ASP A 44 18.672 -15.119 -11.445 1.00 54.45 C ATOM 684 CG ASP A 44 19.621 -14.083 -12.015 1.00 1.24 C ATOM 685 OD1 ASP A 44 20.339 -14.405 -12.985 1.00 11.23 O ATOM 686 OD2 ASP A 44 19.646 -12.950 -11.490 1.00 52.24 O ATOM 0 H ASP A 44 16.331 -14.341 -11.463 1.00 11.24 H new ATOM 0 HA ASP A 44 17.972 -15.286 -13.470 1.00 53.41 H new ATOM 0 HB2 ASP A 44 18.143 -14.693 -10.593 1.00 54.45 H new ATOM 0 HB3 ASP A 44 19.246 -15.967 -11.072 1.00 54.45 H new ATOM 691 N ARG A 45 17.509 -17.706 -11.268 1.00 33.52 N ATOM 692 CA ARG A 45 17.445 -19.155 -11.117 1.00 61.21 C ATOM 693 C ARG A 45 16.127 -19.578 -10.476 1.00 14.43 C ATOM 694 O ARG A 45 15.733 -20.741 -10.549 1.00 43.03 O ATOM 695 CB ARG A 45 18.619 -19.653 -10.272 1.00 34.44 C ATOM 696 CG ARG A 45 19.679 -20.389 -11.075 1.00 33.24 C ATOM 697 CD ARG A 45 20.666 -19.423 -11.710 1.00 64.32 C ATOM 698 NE ARG A 45 20.645 -19.499 -13.168 1.00 54.15 N ATOM 699 CZ ARG A 45 21.196 -18.585 -13.960 1.00 73.51 C ATOM 700 NH1 ARG A 45 21.809 -17.533 -13.437 1.00 12.14 N ATOM 701 NH2 ARG A 45 21.135 -18.724 -15.278 1.00 75.43 N ATOM 0 H ARG A 45 17.483 -17.189 -10.389 1.00 33.52 H new ATOM 0 HA ARG A 45 17.505 -19.601 -12.110 1.00 61.21 H new ATOM 0 HB2 ARG A 45 19.081 -18.803 -9.770 1.00 34.44 H new ATOM 0 HB3 ARG A 45 18.240 -20.315 -9.494 1.00 34.44 H new ATOM 0 HG2 ARG A 45 20.213 -21.082 -10.425 1.00 33.24 H new ATOM 0 HG3 ARG A 45 19.200 -20.985 -11.852 1.00 33.24 H new ATOM 0 HD2 ARG A 45 20.430 -18.406 -11.397 1.00 64.32 H new ATOM 0 HD3 ARG A 45 21.671 -19.643 -11.350 1.00 64.32 H new ATOM 0 HE ARG A 45 20.182 -20.297 -13.602 1.00 54.15 H new ATOM 0 HH11 ARG A 45 21.859 -17.423 -12.424 1.00 12.14 H new ATOM 0 HH12 ARG A 45 22.231 -16.833 -14.047 1.00 12.14 H new ATOM 0 HH21 ARG A 45 20.665 -19.533 -15.684 1.00 75.43 H new ATOM 0 HH22 ARG A 45 21.558 -18.022 -15.885 1.00 75.43 H new ATOM 715 N GLY A 46 15.448 -18.623 -9.846 1.00 21.34 N ATOM 716 CA GLY A 46 14.182 -18.916 -9.200 1.00 31.21 C ATOM 717 C GLY A 46 14.353 -19.348 -7.757 1.00 62.31 C ATOM 718 O GLY A 46 13.387 -19.391 -6.996 1.00 14.32 O ATOM 0 H GLY A 46 15.752 -17.652 -9.772 1.00 21.34 H new ATOM 0 HA2 GLY A 46 13.545 -18.032 -9.238 1.00 31.21 H new ATOM 0 HA3 GLY A 46 13.669 -19.703 -9.753 1.00 31.21 H new ATOM 722 N ASP A 47 15.585 -19.671 -7.380 1.00 64.34 N ATOM 723 CA ASP A 47 15.880 -20.103 -6.019 1.00 62.30 C ATOM 724 C ASP A 47 17.142 -19.425 -5.495 1.00 63.11 C ATOM 725 O ASP A 47 18.075 -20.090 -5.043 1.00 23.10 O ATOM 726 CB ASP A 47 16.044 -21.623 -5.968 1.00 21.04 C ATOM 727 CG ASP A 47 16.052 -22.157 -4.549 1.00 2.23 C ATOM 728 OD1 ASP A 47 15.011 -22.049 -3.869 1.00 13.54 O ATOM 729 OD2 ASP A 47 17.100 -22.682 -4.118 1.00 24.11 O ATOM 0 H ASP A 47 16.396 -19.642 -7.998 1.00 64.34 H new ATOM 0 HA ASP A 47 15.043 -19.814 -5.383 1.00 62.30 H new ATOM 0 HB2 ASP A 47 15.233 -22.092 -6.525 1.00 21.04 H new ATOM 0 HB3 ASP A 47 16.974 -21.902 -6.463 1.00 21.04 H new ATOM 734 N LEU A 48 17.165 -18.098 -5.560 1.00 20.52 N ATOM 735 CA LEU A 48 18.313 -17.329 -5.093 1.00 23.32 C ATOM 736 C LEU A 48 18.333 -17.250 -3.570 1.00 32.33 C ATOM 737 O LEU A 48 19.378 -17.426 -2.941 1.00 74.55 O ATOM 738 CB LEU A 48 18.284 -15.920 -5.688 1.00 22.24 C ATOM 739 CG LEU A 48 18.045 -15.833 -7.195 1.00 42.14 C ATOM 740 CD1 LEU A 48 17.432 -14.491 -7.562 1.00 14.53 C ATOM 741 CD2 LEU A 48 19.345 -16.052 -7.955 1.00 24.20 C ATOM 0 H LEU A 48 16.402 -17.533 -5.932 1.00 20.52 H new ATOM 0 HA LEU A 48 19.218 -17.838 -5.424 1.00 23.32 H new ATOM 0 HB2 LEU A 48 17.504 -15.350 -5.183 1.00 22.24 H new ATOM 0 HB3 LEU A 48 19.232 -15.432 -5.462 1.00 22.24 H new ATOM 0 HG LEU A 48 17.345 -16.619 -7.478 1.00 42.14 H new ATOM 0 HD11 LEU A 48 17.269 -14.448 -8.639 1.00 14.53 H new ATOM 0 HD12 LEU A 48 16.479 -14.373 -7.046 1.00 14.53 H new ATOM 0 HD13 LEU A 48 18.108 -13.689 -7.265 1.00 14.53 H new ATOM 0 HD21 LEU A 48 19.156 -15.987 -9.026 1.00 24.20 H new ATOM 0 HD22 LEU A 48 20.068 -15.289 -7.667 1.00 24.20 H new ATOM 0 HD23 LEU A 48 19.744 -17.038 -7.717 1.00 24.20 H new ATOM 753 N LEU A 49 17.171 -16.987 -2.981 1.00 44.33 N ATOM 754 CA LEU A 49 17.054 -16.887 -1.531 1.00 11.24 C ATOM 755 C LEU A 49 15.722 -17.455 -1.052 1.00 14.41 C ATOM 756 O LEU A 49 14.924 -17.947 -1.849 1.00 61.11 O ATOM 757 CB LEU A 49 17.189 -15.429 -1.088 1.00 14.15 C ATOM 758 CG LEU A 49 18.600 -14.841 -1.132 1.00 74.44 C ATOM 759 CD1 LEU A 49 18.950 -14.401 -2.545 1.00 54.51 C ATOM 760 CD2 LEU A 49 18.723 -13.676 -0.162 1.00 1.21 C ATOM 0 H LEU A 49 16.297 -16.839 -3.486 1.00 44.33 H new ATOM 0 HA LEU A 49 17.859 -17.472 -1.085 1.00 11.24 H new ATOM 0 HB2 LEU A 49 16.543 -14.818 -1.718 1.00 14.15 H new ATOM 0 HB3 LEU A 49 16.813 -15.344 -0.068 1.00 14.15 H new ATOM 0 HG LEU A 49 19.305 -15.615 -0.829 1.00 74.44 H new ATOM 0 HD11 LEU A 49 19.957 -13.985 -2.558 1.00 54.51 H new ATOM 0 HD12 LEU A 49 18.903 -15.259 -3.215 1.00 54.51 H new ATOM 0 HD13 LEU A 49 18.240 -13.643 -2.876 1.00 54.51 H new ATOM 0 HD21 LEU A 49 19.734 -13.270 -0.207 1.00 1.21 H new ATOM 0 HD22 LEU A 49 18.008 -12.899 -0.433 1.00 1.21 H new ATOM 0 HD23 LEU A 49 18.516 -14.022 0.851 1.00 1.21 H new ATOM 772 N GLU A 50 15.488 -17.380 0.255 1.00 55.04 N ATOM 773 CA GLU A 50 14.251 -17.886 0.839 1.00 53.45 C ATOM 774 C GLU A 50 13.955 -17.196 2.167 1.00 15.12 C ATOM 775 O GLU A 50 14.863 -16.914 2.949 1.00 53.51 O ATOM 776 CB GLU A 50 14.340 -19.399 1.046 1.00 72.04 C ATOM 777 CG GLU A 50 13.163 -19.979 1.812 1.00 54.15 C ATOM 778 CD GLU A 50 13.260 -21.483 1.980 1.00 53.24 C ATOM 779 OE1 GLU A 50 14.216 -22.079 1.441 1.00 3.42 O ATOM 780 OE2 GLU A 50 12.380 -22.064 2.649 1.00 50.42 O ATOM 0 H GLU A 50 16.138 -16.974 0.928 1.00 55.04 H new ATOM 0 HA GLU A 50 13.437 -17.669 0.147 1.00 53.45 H new ATOM 0 HB2 GLU A 50 14.406 -19.887 0.074 1.00 72.04 H new ATOM 0 HB3 GLU A 50 15.261 -19.630 1.582 1.00 72.04 H new ATOM 0 HG2 GLU A 50 13.107 -19.510 2.795 1.00 54.15 H new ATOM 0 HG3 GLU A 50 12.238 -19.734 1.289 1.00 54.15 H new ATOM 787 N VAL A 51 12.677 -16.927 2.416 1.00 53.13 N ATOM 788 CA VAL A 51 12.259 -16.271 3.649 1.00 4.01 C ATOM 789 C VAL A 51 11.826 -17.292 4.695 1.00 2.01 C ATOM 790 O VAL A 51 11.242 -18.323 4.366 1.00 64.53 O ATOM 791 CB VAL A 51 11.101 -15.287 3.398 1.00 63.15 C ATOM 792 CG1 VAL A 51 9.952 -15.985 2.686 1.00 23.31 C ATOM 793 CG2 VAL A 51 10.633 -14.671 4.707 1.00 53.52 C ATOM 0 H VAL A 51 11.913 -17.154 1.779 1.00 53.13 H new ATOM 0 HA VAL A 51 13.121 -15.717 4.020 1.00 4.01 H new ATOM 0 HB VAL A 51 11.461 -14.485 2.754 1.00 63.15 H new ATOM 0 HG11 VAL A 51 9.143 -15.274 2.517 1.00 23.31 H new ATOM 0 HG12 VAL A 51 10.299 -16.373 1.729 1.00 23.31 H new ATOM 0 HG13 VAL A 51 9.589 -16.808 3.301 1.00 23.31 H new ATOM 0 HG21 VAL A 51 9.815 -13.978 4.511 1.00 53.52 H new ATOM 0 HG22 VAL A 51 10.289 -15.459 5.377 1.00 53.52 H new ATOM 0 HG23 VAL A 51 11.459 -14.134 5.172 1.00 53.52 H new ATOM 803 N ASN A 52 12.116 -16.996 5.958 1.00 20.41 N ATOM 804 CA ASN A 52 11.756 -17.889 7.054 1.00 61.12 C ATOM 805 C ASN A 52 10.505 -17.392 7.772 1.00 5.43 C ATOM 806 O ASN A 52 10.465 -16.262 8.261 1.00 53.53 O ATOM 807 CB ASN A 52 12.915 -18.006 8.046 1.00 42.03 C ATOM 808 CG ASN A 52 12.609 -18.962 9.182 1.00 24.32 C ATOM 809 OD1 ASN A 52 11.583 -19.642 9.177 1.00 11.12 O ATOM 810 ND2 ASN A 52 13.502 -19.019 10.164 1.00 13.31 N ATOM 0 H ASN A 52 12.599 -16.146 6.248 1.00 20.41 H new ATOM 0 HA ASN A 52 11.546 -18.873 6.634 1.00 61.12 H new ATOM 0 HB2 ASN A 52 13.807 -18.345 7.520 1.00 42.03 H new ATOM 0 HB3 ASN A 52 13.141 -17.021 8.455 1.00 42.03 H new ATOM 0 HD21 ASN A 52 13.351 -19.645 10.955 1.00 13.31 H new ATOM 0 HD22 ASN A 52 14.339 -18.437 10.127 1.00 13.31 H new ATOM 817 N LEU A 53 9.487 -18.243 7.834 1.00 44.34 N ATOM 818 CA LEU A 53 8.235 -17.891 8.493 1.00 13.23 C ATOM 819 C LEU A 53 8.411 -17.846 10.008 1.00 53.12 C ATOM 820 O LEU A 53 7.515 -17.415 10.733 1.00 33.32 O ATOM 821 CB LEU A 53 7.142 -18.896 8.125 1.00 53.40 C ATOM 822 CG LEU A 53 6.471 -18.690 6.766 1.00 24.20 C ATOM 823 CD1 LEU A 53 6.801 -19.841 5.829 1.00 64.43 C ATOM 824 CD2 LEU A 53 4.965 -18.549 6.930 1.00 2.43 C ATOM 0 H LEU A 53 9.504 -19.182 7.436 1.00 44.34 H new ATOM 0 HA LEU A 53 7.939 -16.900 8.150 1.00 13.23 H new ATOM 0 HB2 LEU A 53 7.574 -19.897 8.147 1.00 53.40 H new ATOM 0 HB3 LEU A 53 6.372 -18.864 8.896 1.00 53.40 H new ATOM 0 HG LEU A 53 6.856 -17.769 6.328 1.00 24.20 H new ATOM 0 HD11 LEU A 53 6.315 -19.678 4.867 1.00 64.43 H new ATOM 0 HD12 LEU A 53 7.880 -19.896 5.686 1.00 64.43 H new ATOM 0 HD13 LEU A 53 6.444 -20.776 6.261 1.00 64.43 H new ATOM 0 HD21 LEU A 53 4.505 -18.403 5.953 1.00 2.43 H new ATOM 0 HD22 LEU A 53 4.563 -19.452 7.389 1.00 2.43 H new ATOM 0 HD23 LEU A 53 4.747 -17.691 7.565 1.00 2.43 H new ATOM 836 N GLN A 54 9.572 -18.292 10.477 1.00 54.41 N ATOM 837 CA GLN A 54 9.865 -18.300 11.905 1.00 20.42 C ATOM 838 C GLN A 54 9.895 -16.882 12.464 1.00 53.44 C ATOM 839 O GLN A 54 9.094 -16.528 13.328 1.00 51.41 O ATOM 840 CB GLN A 54 11.204 -18.993 12.168 1.00 15.20 C ATOM 841 CG GLN A 54 11.348 -19.519 13.587 1.00 72.43 C ATOM 842 CD GLN A 54 12.449 -20.553 13.716 1.00 2.04 C ATOM 843 OE1 GLN A 54 12.193 -21.757 13.684 1.00 64.04 O ATOM 844 NE2 GLN A 54 13.684 -20.087 13.864 1.00 31.45 N ATOM 0 H GLN A 54 10.324 -18.652 9.890 1.00 54.41 H new ATOM 0 HA GLN A 54 9.072 -18.852 12.409 1.00 20.42 H new ATOM 0 HB2 GLN A 54 11.318 -19.821 11.469 1.00 15.20 H new ATOM 0 HB3 GLN A 54 12.013 -18.291 11.966 1.00 15.20 H new ATOM 0 HG2 GLN A 54 11.555 -18.687 14.260 1.00 72.43 H new ATOM 0 HG3 GLN A 54 10.403 -19.958 13.905 1.00 72.43 H new ATOM 0 HE21 GLN A 54 13.850 -19.081 13.885 1.00 31.45 H new ATOM 0 HE22 GLN A 54 14.466 -20.735 13.957 1.00 31.45 H new ATOM 853 N ASN A 55 10.824 -16.073 11.964 1.00 60.52 N ATOM 854 CA ASN A 55 10.959 -14.693 12.414 1.00 55.21 C ATOM 855 C ASN A 55 10.700 -13.719 11.268 1.00 65.43 C ATOM 856 O ASN A 55 10.385 -12.551 11.490 1.00 34.54 O ATOM 857 CB ASN A 55 12.355 -14.457 12.993 1.00 31.13 C ATOM 858 CG ASN A 55 12.311 -13.789 14.354 1.00 31.21 C ATOM 859 OD1 ASN A 55 11.927 -12.626 14.475 1.00 42.43 O ATOM 860 ND2 ASN A 55 12.705 -14.525 15.387 1.00 3.30 N ATOM 0 H ASN A 55 11.494 -16.350 11.247 1.00 60.52 H new ATOM 0 HA ASN A 55 10.216 -14.517 13.192 1.00 55.21 H new ATOM 0 HB2 ASN A 55 12.877 -15.410 13.076 1.00 31.13 H new ATOM 0 HB3 ASN A 55 12.931 -13.837 12.305 1.00 31.13 H new ATOM 0 HD21 ASN A 55 12.697 -14.130 16.327 1.00 3.30 H new ATOM 0 HD22 ASN A 55 13.016 -15.485 15.240 1.00 3.30 H new ATOM 867 N GLY A 56 10.837 -14.210 10.039 1.00 30.24 N ATOM 868 CA GLY A 56 10.615 -13.371 8.876 1.00 33.14 C ATOM 869 C GLY A 56 11.909 -12.959 8.203 1.00 73.21 C ATOM 870 O GLY A 56 11.904 -12.516 7.054 1.00 64.51 O ATOM 0 H GLY A 56 11.098 -15.173 9.829 1.00 30.24 H new ATOM 0 HA2 GLY A 56 9.991 -13.906 8.160 1.00 33.14 H new ATOM 0 HA3 GLY A 56 10.065 -12.479 9.175 1.00 33.14 H new ATOM 874 N ILE A 57 13.019 -13.103 8.919 1.00 35.22 N ATOM 875 CA ILE A 57 14.325 -12.742 8.383 1.00 1.04 C ATOM 876 C ILE A 57 14.592 -13.452 7.061 1.00 62.14 C ATOM 877 O ILE A 57 14.139 -14.577 6.844 1.00 14.42 O ATOM 878 CB ILE A 57 15.454 -13.084 9.374 1.00 72.02 C ATOM 879 CG1 ILE A 57 16.786 -12.520 8.877 1.00 44.12 C ATOM 880 CG2 ILE A 57 15.549 -14.590 9.568 1.00 5.14 C ATOM 881 CD1 ILE A 57 16.764 -11.024 8.654 1.00 52.10 C ATOM 0 H ILE A 57 13.040 -13.467 9.872 1.00 35.22 H new ATOM 0 HA ILE A 57 14.312 -11.665 8.218 1.00 1.04 H new ATOM 0 HB ILE A 57 15.224 -12.627 10.337 1.00 72.02 H new ATOM 0 HG12 ILE A 57 17.565 -12.760 9.600 1.00 44.12 H new ATOM 0 HG13 ILE A 57 17.055 -13.014 7.943 1.00 44.12 H new ATOM 0 HG21 ILE A 57 16.351 -14.816 10.271 1.00 5.14 H new ATOM 0 HG22 ILE A 57 14.605 -14.966 9.961 1.00 5.14 H new ATOM 0 HG23 ILE A 57 15.759 -15.068 8.611 1.00 5.14 H new ATOM 0 HD11 ILE A 57 17.742 -10.694 8.302 1.00 52.10 H new ATOM 0 HD12 ILE A 57 16.008 -10.778 7.908 1.00 52.10 H new ATOM 0 HD13 ILE A 57 16.527 -10.520 9.591 1.00 52.10 H new ATOM 893 N LEU A 58 15.333 -12.789 6.179 1.00 73.41 N ATOM 894 CA LEU A 58 15.663 -13.358 4.877 1.00 51.45 C ATOM 895 C LEU A 58 17.059 -13.972 4.889 1.00 71.13 C ATOM 896 O LEU A 58 18.045 -13.294 5.178 1.00 12.30 O ATOM 897 CB LEU A 58 15.576 -12.282 3.792 1.00 21.21 C ATOM 898 CG LEU A 58 15.166 -12.764 2.400 1.00 22.21 C ATOM 899 CD1 LEU A 58 16.219 -13.701 1.828 1.00 11.11 C ATOM 900 CD2 LEU A 58 13.810 -13.452 2.452 1.00 55.32 C ATOM 0 H LEU A 58 15.716 -11.858 6.342 1.00 73.41 H new ATOM 0 HA LEU A 58 14.942 -14.146 4.659 1.00 51.45 H new ATOM 0 HB2 LEU A 58 14.863 -11.524 4.117 1.00 21.21 H new ATOM 0 HB3 LEU A 58 16.547 -11.794 3.714 1.00 21.21 H new ATOM 0 HG LEU A 58 15.086 -11.896 1.745 1.00 22.21 H new ATOM 0 HD11 LEU A 58 15.910 -14.034 0.837 1.00 11.11 H new ATOM 0 HD12 LEU A 58 17.171 -13.176 1.754 1.00 11.11 H new ATOM 0 HD13 LEU A 58 16.331 -14.565 2.483 1.00 11.11 H new ATOM 0 HD21 LEU A 58 13.534 -13.788 1.453 1.00 55.32 H new ATOM 0 HD22 LEU A 58 13.863 -14.310 3.122 1.00 55.32 H new ATOM 0 HD23 LEU A 58 13.060 -12.751 2.819 1.00 55.32 H new ATOM 912 N PHE A 59 17.136 -15.260 4.571 1.00 74.15 N ATOM 913 CA PHE A 59 18.411 -15.966 4.544 1.00 62.35 C ATOM 914 C PHE A 59 18.790 -16.351 3.116 1.00 34.13 C ATOM 915 O PHE A 59 17.935 -16.422 2.233 1.00 20.40 O ATOM 916 CB PHE A 59 18.344 -17.218 5.421 1.00 71.25 C ATOM 917 CG PHE A 59 17.244 -18.164 5.031 1.00 24.52 C ATOM 918 CD1 PHE A 59 15.958 -17.989 5.515 1.00 71.10 C ATOM 919 CD2 PHE A 59 17.497 -19.229 4.181 1.00 1.10 C ATOM 920 CE1 PHE A 59 14.945 -18.859 5.159 1.00 54.12 C ATOM 921 CE2 PHE A 59 16.488 -20.102 3.821 1.00 54.20 C ATOM 922 CZ PHE A 59 15.209 -19.916 4.310 1.00 44.22 C ATOM 0 H PHE A 59 16.330 -15.836 4.328 1.00 74.15 H new ATOM 0 HA PHE A 59 19.177 -15.297 4.936 1.00 62.35 H new ATOM 0 HB2 PHE A 59 19.299 -17.741 5.367 1.00 71.25 H new ATOM 0 HB3 PHE A 59 18.203 -16.918 6.459 1.00 71.25 H new ATOM 0 HD1 PHE A 59 15.745 -17.164 6.178 1.00 71.10 H new ATOM 0 HD2 PHE A 59 18.495 -19.378 3.795 1.00 1.10 H new ATOM 0 HE1 PHE A 59 13.947 -18.712 5.545 1.00 54.12 H new ATOM 0 HE2 PHE A 59 16.699 -20.928 3.158 1.00 54.20 H new ATOM 0 HZ PHE A 59 14.418 -20.595 4.029 1.00 44.22 H new ATOM 932 N VAL A 60 20.077 -16.598 2.898 1.00 45.00 N ATOM 933 CA VAL A 60 20.571 -16.976 1.579 1.00 35.20 C ATOM 934 C VAL A 60 20.136 -18.391 1.215 1.00 61.50 C ATOM 935 O VAL A 60 20.063 -19.269 2.074 1.00 65.44 O ATOM 936 CB VAL A 60 22.107 -16.888 1.508 1.00 74.05 C ATOM 937 CG1 VAL A 60 22.606 -17.355 0.149 1.00 72.52 C ATOM 938 CG2 VAL A 60 22.572 -15.469 1.797 1.00 64.05 C ATOM 0 H VAL A 60 20.797 -16.543 3.618 1.00 45.00 H new ATOM 0 HA VAL A 60 20.142 -16.272 0.866 1.00 35.20 H new ATOM 0 HB VAL A 60 22.528 -17.546 2.268 1.00 74.05 H new ATOM 0 HG11 VAL A 60 23.693 -17.286 0.117 1.00 72.52 H new ATOM 0 HG12 VAL A 60 22.303 -18.389 -0.014 1.00 72.52 H new ATOM 0 HG13 VAL A 60 22.179 -16.725 -0.631 1.00 72.52 H new ATOM 0 HG21 VAL A 60 23.660 -15.424 1.743 1.00 64.05 H new ATOM 0 HG22 VAL A 60 22.144 -14.789 1.061 1.00 64.05 H new ATOM 0 HG23 VAL A 60 22.246 -15.175 2.795 1.00 64.05 H new ATOM 948 N ASN A 61 19.849 -18.606 -0.065 1.00 14.41 N ATOM 949 CA ASN A 61 19.421 -19.915 -0.543 1.00 61.25 C ATOM 950 C ASN A 61 19.968 -20.189 -1.941 1.00 50.43 C ATOM 951 O ASN A 61 19.256 -20.694 -2.809 1.00 45.15 O ATOM 952 CB ASN A 61 17.894 -20.003 -0.555 1.00 33.41 C ATOM 953 CG ASN A 61 17.397 -21.436 -0.551 1.00 63.44 C ATOM 954 OD1 ASN A 61 17.867 -22.266 0.227 1.00 3.14 O ATOM 955 ND2 ASN A 61 16.442 -21.734 -1.425 1.00 44.30 N ATOM 0 H ASN A 61 19.905 -17.890 -0.790 1.00 14.41 H new ATOM 0 HA ASN A 61 19.816 -20.669 0.137 1.00 61.25 H new ATOM 0 HB2 ASN A 61 17.496 -19.481 0.315 1.00 33.41 H new ATOM 0 HB3 ASN A 61 17.510 -19.491 -1.437 1.00 33.41 H new ATOM 0 HD21 ASN A 61 16.069 -22.682 -1.470 1.00 44.30 H new ATOM 0 HD22 ASN A 61 16.081 -21.014 -2.051 1.00 44.30 H new ATOM 962 N SER A 62 21.237 -19.852 -2.151 1.00 15.31 N ATOM 963 CA SER A 62 21.879 -20.058 -3.444 1.00 14.31 C ATOM 964 C SER A 62 23.366 -19.724 -3.371 1.00 74.52 C ATOM 965 O SER A 62 23.915 -19.519 -2.289 1.00 14.43 O ATOM 966 CB SER A 62 21.204 -19.199 -4.515 1.00 15.31 C ATOM 967 OG SER A 62 21.583 -19.614 -5.816 1.00 1.25 O ATOM 0 H SER A 62 21.841 -19.435 -1.442 1.00 15.31 H new ATOM 0 HA SER A 62 21.773 -21.109 -3.711 1.00 14.31 H new ATOM 0 HB2 SER A 62 20.121 -19.266 -4.410 1.00 15.31 H new ATOM 0 HB3 SER A 62 21.475 -18.153 -4.370 1.00 15.31 H new ATOM 0 HG SER A 62 21.137 -19.050 -6.482 1.00 1.25 H new ATOM 973 N ARG A 63 24.011 -19.673 -4.532 1.00 24.43 N ATOM 974 CA ARG A 63 25.435 -19.367 -4.601 1.00 0.41 C ATOM 975 C ARG A 63 25.666 -17.858 -4.625 1.00 73.52 C ATOM 976 O ARG A 63 25.234 -17.170 -5.550 1.00 43.42 O ATOM 977 CB ARG A 63 26.057 -20.008 -5.842 1.00 70.54 C ATOM 978 CG ARG A 63 25.587 -21.432 -6.092 1.00 72.14 C ATOM 979 CD ARG A 63 24.595 -21.497 -7.243 1.00 62.34 C ATOM 980 NE ARG A 63 23.411 -22.281 -6.902 1.00 11.31 N ATOM 981 CZ ARG A 63 22.450 -22.577 -7.770 1.00 41.30 C ATOM 982 NH1 ARG A 63 22.534 -22.157 -9.025 1.00 34.10 N ATOM 983 NH2 ARG A 63 21.403 -23.294 -7.384 1.00 21.44 N ATOM 0 H ARG A 63 23.571 -19.839 -5.437 1.00 24.43 H new ATOM 0 HA ARG A 63 25.912 -19.777 -3.711 1.00 0.41 H new ATOM 0 HB2 ARG A 63 25.820 -19.398 -6.713 1.00 70.54 H new ATOM 0 HB3 ARG A 63 27.142 -20.006 -5.737 1.00 70.54 H new ATOM 0 HG2 ARG A 63 26.445 -22.066 -6.314 1.00 72.14 H new ATOM 0 HG3 ARG A 63 25.124 -21.827 -5.188 1.00 72.14 H new ATOM 0 HD2 ARG A 63 24.293 -20.487 -7.519 1.00 62.34 H new ATOM 0 HD3 ARG A 63 25.080 -21.934 -8.116 1.00 62.34 H new ATOM 0 HE ARG A 63 23.317 -22.620 -5.945 1.00 11.31 H new ATOM 0 HH11 ARG A 63 23.338 -21.606 -9.326 1.00 34.10 H new ATOM 0 HH12 ARG A 63 21.795 -22.385 -9.690 1.00 34.10 H new ATOM 0 HH21 ARG A 63 21.335 -23.619 -6.420 1.00 21.44 H new ATOM 0 HH22 ARG A 63 20.666 -23.520 -8.052 1.00 21.44 H new ATOM 997 N ILE A 64 26.347 -17.353 -3.603 1.00 4.11 N ATOM 998 CA ILE A 64 26.635 -15.927 -3.508 1.00 24.22 C ATOM 999 C ILE A 64 28.113 -15.647 -3.758 1.00 25.15 C ATOM 1000 O ILE A 64 28.502 -14.514 -4.043 1.00 75.21 O ATOM 1001 CB ILE A 64 26.244 -15.364 -2.129 1.00 33.53 C ATOM 1002 CG1 ILE A 64 24.786 -15.703 -1.811 1.00 20.54 C ATOM 1003 CG2 ILE A 64 26.464 -13.860 -2.089 1.00 2.34 C ATOM 1004 CD1 ILE A 64 23.795 -15.044 -2.743 1.00 52.35 C ATOM 0 H ILE A 64 26.710 -17.909 -2.829 1.00 4.11 H new ATOM 0 HA ILE A 64 26.039 -15.433 -4.275 1.00 24.22 H new ATOM 0 HB ILE A 64 26.879 -15.824 -1.372 1.00 33.53 H new ATOM 0 HG12 ILE A 64 24.654 -16.784 -1.859 1.00 20.54 H new ATOM 0 HG13 ILE A 64 24.566 -15.400 -0.787 1.00 20.54 H new ATOM 0 HG21 ILE A 64 26.183 -13.477 -1.108 1.00 2.34 H new ATOM 0 HG22 ILE A 64 27.515 -13.641 -2.277 1.00 2.34 H new ATOM 0 HG23 ILE A 64 25.852 -13.382 -2.854 1.00 2.34 H new ATOM 0 HD11 ILE A 64 22.782 -15.329 -2.458 1.00 52.35 H new ATOM 0 HD12 ILE A 64 23.899 -13.961 -2.678 1.00 52.35 H new ATOM 0 HD13 ILE A 64 23.988 -15.366 -3.766 1.00 52.35 H new ATOM 1016 N ASP A 65 28.933 -16.687 -3.650 1.00 3.24 N ATOM 1017 CA ASP A 65 30.369 -16.554 -3.867 1.00 22.02 C ATOM 1018 C ASP A 65 30.655 -15.783 -5.151 1.00 45.25 C ATOM 1019 O ASP A 65 29.986 -15.978 -6.166 1.00 44.13 O ATOM 1020 CB ASP A 65 31.027 -17.933 -3.928 1.00 20.50 C ATOM 1021 CG ASP A 65 30.246 -18.910 -4.785 1.00 51.12 C ATOM 1022 OD1 ASP A 65 29.153 -19.335 -4.355 1.00 21.10 O ATOM 1023 OD2 ASP A 65 30.727 -19.248 -5.887 1.00 31.13 O ATOM 0 H ASP A 65 28.628 -17.631 -3.414 1.00 3.24 H new ATOM 0 HA ASP A 65 30.788 -15.997 -3.029 1.00 22.02 H new ATOM 0 HB2 ASP A 65 32.037 -17.833 -4.325 1.00 20.50 H new ATOM 0 HB3 ASP A 65 31.119 -18.333 -2.918 1.00 20.50 H new ATOM 1028 N ARG A 66 31.653 -14.906 -5.099 1.00 72.05 N ATOM 1029 CA ARG A 66 32.026 -14.104 -6.258 1.00 50.32 C ATOM 1030 C ARG A 66 32.223 -14.984 -7.489 1.00 23.45 C ATOM 1031 O ARG A 66 31.996 -14.550 -8.617 1.00 41.20 O ATOM 1032 CB ARG A 66 33.306 -13.317 -5.970 1.00 22.51 C ATOM 1033 CG ARG A 66 34.385 -14.140 -5.284 1.00 33.00 C ATOM 1034 CD ARG A 66 35.747 -13.474 -5.393 1.00 43.11 C ATOM 1035 NE ARG A 66 36.643 -14.203 -6.287 1.00 30.01 N ATOM 1036 CZ ARG A 66 37.221 -15.356 -5.968 1.00 40.31 C ATOM 1037 NH1 ARG A 66 36.998 -15.908 -4.783 1.00 51.34 N ATOM 1038 NH2 ARG A 66 38.024 -15.959 -6.835 1.00 71.04 N ATOM 0 H ARG A 66 32.217 -14.733 -4.267 1.00 72.05 H new ATOM 0 HA ARG A 66 31.215 -13.404 -6.460 1.00 50.32 H new ATOM 0 HB2 ARG A 66 33.701 -12.925 -6.908 1.00 22.51 H new ATOM 0 HB3 ARG A 66 33.062 -12.459 -5.344 1.00 22.51 H new ATOM 0 HG2 ARG A 66 34.128 -14.275 -4.233 1.00 33.00 H new ATOM 0 HG3 ARG A 66 34.427 -15.133 -5.732 1.00 33.00 H new ATOM 0 HD2 ARG A 66 35.624 -12.454 -5.756 1.00 43.11 H new ATOM 0 HD3 ARG A 66 36.198 -13.407 -4.403 1.00 43.11 H new ATOM 0 HE ARG A 66 36.835 -13.805 -7.206 1.00 30.01 H new ATOM 0 HH11 ARG A 66 36.381 -15.447 -4.114 1.00 51.34 H new ATOM 0 HH12 ARG A 66 37.443 -16.793 -4.541 1.00 51.34 H new ATOM 0 HH21 ARG A 66 38.198 -15.537 -7.747 1.00 71.04 H new ATOM 0 HH22 ARG A 66 38.467 -16.844 -6.589 1.00 71.04 H new ATOM 1052 N GLU A 67 32.648 -16.223 -7.261 1.00 61.51 N ATOM 1053 CA GLU A 67 32.877 -17.164 -8.352 1.00 2.14 C ATOM 1054 C GLU A 67 31.563 -17.544 -9.028 1.00 11.32 C ATOM 1055 O GLU A 67 31.482 -17.613 -10.254 1.00 32.44 O ATOM 1056 CB GLU A 67 33.578 -18.421 -7.832 1.00 11.01 C ATOM 1057 CG GLU A 67 35.055 -18.483 -8.182 1.00 61.32 C ATOM 1058 CD GLU A 67 35.485 -19.858 -8.656 1.00 73.13 C ATOM 1059 OE1 GLU A 67 35.170 -20.849 -7.964 1.00 4.22 O ATOM 1060 OE2 GLU A 67 36.135 -19.943 -9.719 1.00 31.41 O ATOM 0 H GLU A 67 32.840 -16.598 -6.332 1.00 61.51 H new ATOM 0 HA GLU A 67 33.517 -16.678 -9.088 1.00 2.14 H new ATOM 0 HB2 GLU A 67 33.468 -18.466 -6.749 1.00 11.01 H new ATOM 0 HB3 GLU A 67 33.079 -19.300 -8.240 1.00 11.01 H new ATOM 0 HG2 GLU A 67 35.271 -17.751 -8.960 1.00 61.32 H new ATOM 0 HG3 GLU A 67 35.644 -18.203 -7.308 1.00 61.32 H new ATOM 1067 N GLU A 68 30.537 -17.788 -8.219 1.00 30.55 N ATOM 1068 CA GLU A 68 29.227 -18.163 -8.739 1.00 1.34 C ATOM 1069 C GLU A 68 28.434 -16.927 -9.156 1.00 22.43 C ATOM 1070 O GLU A 68 28.001 -16.812 -10.303 1.00 43.31 O ATOM 1071 CB GLU A 68 28.444 -18.954 -7.689 1.00 62.41 C ATOM 1072 CG GLU A 68 28.740 -20.445 -7.705 1.00 42.41 C ATOM 1073 CD GLU A 68 27.726 -21.232 -8.512 1.00 64.12 C ATOM 1074 OE1 GLU A 68 26.991 -20.611 -9.308 1.00 0.10 O ATOM 1075 OE2 GLU A 68 27.668 -22.469 -8.348 1.00 50.42 O ATOM 0 H GLU A 68 30.587 -17.733 -7.202 1.00 30.55 H new ATOM 0 HA GLU A 68 29.379 -18.790 -9.617 1.00 1.34 H new ATOM 0 HB2 GLU A 68 28.675 -18.557 -6.700 1.00 62.41 H new ATOM 0 HB3 GLU A 68 27.377 -18.802 -7.853 1.00 62.41 H new ATOM 0 HG2 GLU A 68 29.735 -20.610 -8.119 1.00 42.41 H new ATOM 0 HG3 GLU A 68 28.754 -20.820 -6.682 1.00 42.41 H new ATOM 1082 N LEU A 69 28.247 -16.007 -8.216 1.00 40.04 N ATOM 1083 CA LEU A 69 27.506 -14.780 -8.485 1.00 14.42 C ATOM 1084 C LEU A 69 28.004 -14.111 -9.762 1.00 54.11 C ATOM 1085 O LEU A 69 27.327 -14.132 -10.791 1.00 2.32 O ATOM 1086 CB LEU A 69 27.636 -13.814 -7.306 1.00 12.32 C ATOM 1087 CG LEU A 69 26.339 -13.161 -6.826 1.00 73.14 C ATOM 1088 CD1 LEU A 69 25.778 -12.238 -7.897 1.00 70.32 C ATOM 1089 CD2 LEU A 69 25.317 -14.222 -6.446 1.00 33.42 C ATOM 0 H LEU A 69 28.598 -16.087 -7.262 1.00 40.04 H new ATOM 0 HA LEU A 69 26.456 -15.041 -8.620 1.00 14.42 H new ATOM 0 HB2 LEU A 69 28.080 -14.352 -6.468 1.00 12.32 H new ATOM 0 HB3 LEU A 69 28.335 -13.025 -7.584 1.00 12.32 H new ATOM 0 HG LEU A 69 26.561 -12.565 -5.941 1.00 73.14 H new ATOM 0 HD11 LEU A 69 24.855 -11.782 -7.538 1.00 70.32 H new ATOM 0 HD12 LEU A 69 26.505 -11.457 -8.122 1.00 70.32 H new ATOM 0 HD13 LEU A 69 25.571 -12.812 -8.800 1.00 70.32 H new ATOM 0 HD21 LEU A 69 24.400 -13.739 -6.107 1.00 33.42 H new ATOM 0 HD22 LEU A 69 25.099 -14.845 -7.314 1.00 33.42 H new ATOM 0 HD23 LEU A 69 25.718 -14.843 -5.645 1.00 33.42 H new ATOM 1101 N CYS A 70 29.192 -13.520 -9.690 1.00 15.11 N ATOM 1102 CA CYS A 70 29.782 -12.846 -10.840 1.00 22.30 C ATOM 1103 C CYS A 70 31.278 -12.626 -10.632 1.00 71.24 C ATOM 1104 O CYS A 70 32.094 -13.008 -11.470 1.00 4.31 O ATOM 1105 CB CYS A 70 29.087 -11.505 -11.084 1.00 64.34 C ATOM 1106 SG CYS A 70 28.548 -10.659 -9.564 1.00 20.32 S ATOM 0 H CYS A 70 29.765 -13.494 -8.847 1.00 15.11 H new ATOM 0 HA CYS A 70 29.644 -13.483 -11.714 1.00 22.30 H new ATOM 0 HB2 CYS A 70 29.766 -10.850 -11.630 1.00 64.34 H new ATOM 0 HB3 CYS A 70 28.219 -11.669 -11.723 1.00 64.34 H new ATOM 1111 N GLY A 71 31.629 -12.008 -9.509 1.00 3.20 N ATOM 1112 CA GLY A 71 33.026 -11.748 -9.211 1.00 14.41 C ATOM 1113 C GLY A 71 33.583 -10.587 -10.011 1.00 53.10 C ATOM 1114 O GLY A 71 33.957 -9.559 -9.447 1.00 45.31 O ATOM 0 H GLY A 71 30.972 -11.683 -8.800 1.00 3.20 H new ATOM 0 HA2 GLY A 71 33.134 -11.537 -8.147 1.00 14.41 H new ATOM 0 HA3 GLY A 71 33.612 -12.643 -9.420 1.00 14.41 H new ATOM 1118 N ARG A 72 33.639 -10.751 -11.329 1.00 31.44 N ATOM 1119 CA ARG A 72 34.157 -9.710 -12.207 1.00 43.22 C ATOM 1120 C ARG A 72 33.476 -8.373 -11.927 1.00 71.50 C ATOM 1121 O ARG A 72 34.067 -7.479 -11.322 1.00 52.23 O ATOM 1122 CB ARG A 72 33.954 -10.101 -13.672 1.00 41.31 C ATOM 1123 CG ARG A 72 34.943 -11.144 -14.167 1.00 11.31 C ATOM 1124 CD ARG A 72 34.584 -11.634 -15.561 1.00 24.10 C ATOM 1125 NE ARG A 72 33.738 -12.823 -15.522 1.00 35.31 N ATOM 1126 CZ ARG A 72 33.580 -13.647 -16.552 1.00 33.22 C ATOM 1127 NH1 ARG A 72 34.208 -13.412 -17.695 1.00 64.53 N ATOM 1128 NH2 ARG A 72 32.792 -14.709 -16.439 1.00 30.01 N ATOM 0 H ARG A 72 33.332 -11.595 -11.812 1.00 31.44 H new ATOM 0 HA ARG A 72 35.224 -9.603 -12.011 1.00 43.22 H new ATOM 0 HB2 ARG A 72 32.941 -10.483 -13.800 1.00 41.31 H new ATOM 0 HB3 ARG A 72 34.039 -9.209 -14.292 1.00 41.31 H new ATOM 0 HG2 ARG A 72 35.947 -10.720 -14.177 1.00 11.31 H new ATOM 0 HG3 ARG A 72 34.960 -11.987 -13.477 1.00 11.31 H new ATOM 0 HD2 ARG A 72 34.069 -10.840 -16.103 1.00 24.10 H new ATOM 0 HD3 ARG A 72 35.497 -11.857 -16.113 1.00 24.10 H new ATOM 0 HE ARG A 72 33.241 -13.033 -14.656 1.00 35.31 H new ATOM 0 HH11 ARG A 72 34.814 -12.597 -17.785 1.00 64.53 H new ATOM 0 HH12 ARG A 72 34.085 -14.046 -18.484 1.00 64.53 H new ATOM 0 HH21 ARG A 72 32.307 -14.893 -15.561 1.00 30.01 H new ATOM 0 HH22 ARG A 72 32.671 -15.341 -17.230 1.00 30.01 H new ATOM 1142 N SER A 73 32.230 -8.246 -12.371 1.00 53.25 N ATOM 1143 CA SER A 73 31.469 -7.018 -12.173 1.00 3.44 C ATOM 1144 C SER A 73 31.477 -6.605 -10.704 1.00 25.43 C ATOM 1145 O SER A 73 30.853 -7.252 -9.863 1.00 3.31 O ATOM 1146 CB SER A 73 30.029 -7.201 -12.655 1.00 11.24 C ATOM 1147 OG SER A 73 29.881 -8.415 -13.371 1.00 3.43 O ATOM 0 H SER A 73 31.726 -8.979 -12.870 1.00 53.25 H new ATOM 0 HA SER A 73 31.942 -6.229 -12.757 1.00 3.44 H new ATOM 0 HB2 SER A 73 29.353 -7.195 -11.800 1.00 11.24 H new ATOM 0 HB3 SER A 73 29.746 -6.363 -13.292 1.00 11.24 H new ATOM 0 HG SER A 73 28.951 -8.509 -13.667 1.00 3.43 H new ATOM 1153 N ALA A 74 32.190 -5.524 -10.403 1.00 33.41 N ATOM 1154 CA ALA A 74 32.278 -5.024 -9.037 1.00 3.41 C ATOM 1155 C ALA A 74 30.893 -4.853 -8.424 1.00 15.12 C ATOM 1156 O ALA A 74 30.635 -5.316 -7.313 1.00 55.52 O ATOM 1157 CB ALA A 74 33.037 -3.705 -9.006 1.00 61.23 C ATOM 0 H ALA A 74 32.715 -4.978 -11.087 1.00 33.41 H new ATOM 0 HA ALA A 74 32.821 -5.758 -8.442 1.00 3.41 H new ATOM 0 HB1 ALA A 74 33.095 -3.343 -7.980 1.00 61.23 H new ATOM 0 HB2 ALA A 74 34.044 -3.855 -9.395 1.00 61.23 H new ATOM 0 HB3 ALA A 74 32.516 -2.971 -9.621 1.00 61.23 H new ATOM 1163 N GLU A 75 30.005 -4.185 -9.155 1.00 21.43 N ATOM 1164 CA GLU A 75 28.646 -3.953 -8.680 1.00 50.14 C ATOM 1165 C GLU A 75 27.668 -4.924 -9.336 1.00 14.45 C ATOM 1166 O GLU A 75 27.372 -4.816 -10.526 1.00 12.10 O ATOM 1167 CB GLU A 75 28.221 -2.511 -8.968 1.00 61.43 C ATOM 1168 CG GLU A 75 28.817 -1.498 -8.006 1.00 13.40 C ATOM 1169 CD GLU A 75 27.981 -0.237 -7.896 1.00 30.15 C ATOM 1170 OE1 GLU A 75 27.875 0.494 -8.903 1.00 22.14 O ATOM 1171 OE2 GLU A 75 27.433 0.018 -6.803 1.00 2.41 O ATOM 0 H GLU A 75 30.202 -3.796 -10.077 1.00 21.43 H new ATOM 0 HA GLU A 75 28.631 -4.121 -7.603 1.00 50.14 H new ATOM 0 HB2 GLU A 75 28.515 -2.251 -9.985 1.00 61.43 H new ATOM 0 HB3 GLU A 75 27.134 -2.446 -8.924 1.00 61.43 H new ATOM 0 HG2 GLU A 75 28.914 -1.952 -7.020 1.00 13.40 H new ATOM 0 HG3 GLU A 75 29.822 -1.236 -8.337 1.00 13.40 H new ATOM 1178 N CYS A 76 27.169 -5.872 -8.550 1.00 32.03 N ATOM 1179 CA CYS A 76 26.225 -6.863 -9.051 1.00 72.33 C ATOM 1180 C CYS A 76 24.844 -6.660 -8.435 1.00 31.23 C ATOM 1181 O CYS A 76 24.697 -6.628 -7.213 1.00 33.40 O ATOM 1182 CB CYS A 76 26.728 -8.276 -8.749 1.00 32.13 C ATOM 1183 SG CYS A 76 27.132 -9.255 -10.231 1.00 41.10 S ATOM 0 H CYS A 76 27.403 -5.975 -7.563 1.00 32.03 H new ATOM 0 HA CYS A 76 26.144 -6.737 -10.131 1.00 72.33 H new ATOM 0 HB2 CYS A 76 27.615 -8.207 -8.119 1.00 32.13 H new ATOM 0 HB3 CYS A 76 25.969 -8.805 -8.173 1.00 32.13 H new ATOM 1188 N SER A 77 23.835 -6.523 -9.289 1.00 33.51 N ATOM 1189 CA SER A 77 22.466 -6.320 -8.829 1.00 0.11 C ATOM 1190 C SER A 77 21.604 -7.542 -9.130 1.00 61.24 C ATOM 1191 O SER A 77 21.716 -8.146 -10.198 1.00 1.12 O ATOM 1192 CB SER A 77 21.862 -5.080 -9.491 1.00 1.00 C ATOM 1193 OG SER A 77 21.659 -4.044 -8.545 1.00 64.41 O ATOM 0 H SER A 77 23.940 -6.549 -10.303 1.00 33.51 H new ATOM 0 HA SER A 77 22.490 -6.172 -7.749 1.00 0.11 H new ATOM 0 HB2 SER A 77 22.523 -4.729 -10.283 1.00 1.00 H new ATOM 0 HB3 SER A 77 20.913 -5.340 -9.959 1.00 1.00 H new ATOM 0 HG SER A 77 21.274 -3.262 -8.993 1.00 64.41 H new ATOM 1199 N ILE A 78 20.745 -7.901 -8.183 1.00 13.54 N ATOM 1200 CA ILE A 78 19.863 -9.050 -8.346 1.00 51.54 C ATOM 1201 C ILE A 78 18.402 -8.651 -8.168 1.00 52.12 C ATOM 1202 O ILE A 78 18.060 -7.891 -7.261 1.00 45.14 O ATOM 1203 CB ILE A 78 20.204 -10.168 -7.344 1.00 70.35 C ATOM 1204 CG1 ILE A 78 21.658 -10.612 -7.518 1.00 31.32 C ATOM 1205 CG2 ILE A 78 19.259 -11.347 -7.525 1.00 63.21 C ATOM 1206 CD1 ILE A 78 22.579 -10.102 -6.432 1.00 30.33 C ATOM 0 H ILE A 78 20.641 -7.412 -7.294 1.00 13.54 H new ATOM 0 HA ILE A 78 20.014 -9.423 -9.359 1.00 51.54 H new ATOM 0 HB ILE A 78 20.081 -9.780 -6.333 1.00 70.35 H new ATOM 0 HG12 ILE A 78 21.697 -11.701 -7.535 1.00 31.32 H new ATOM 0 HG13 ILE A 78 22.022 -10.265 -8.485 1.00 31.32 H new ATOM 0 HG21 ILE A 78 19.512 -12.130 -6.810 1.00 63.21 H new ATOM 0 HG22 ILE A 78 18.233 -11.020 -7.357 1.00 63.21 H new ATOM 0 HG23 ILE A 78 19.354 -11.737 -8.538 1.00 63.21 H new ATOM 0 HD11 ILE A 78 23.593 -10.455 -6.619 1.00 30.33 H new ATOM 0 HD12 ILE A 78 22.569 -9.012 -6.429 1.00 30.33 H new ATOM 0 HD13 ILE A 78 22.239 -10.471 -5.464 1.00 30.33 H new ATOM 1218 N HIS A 79 17.542 -9.170 -9.039 1.00 30.43 N ATOM 1219 CA HIS A 79 16.116 -8.871 -8.976 1.00 52.34 C ATOM 1220 C HIS A 79 15.312 -10.123 -8.642 1.00 35.22 C ATOM 1221 O HIS A 79 15.616 -11.216 -9.122 1.00 53.13 O ATOM 1222 CB HIS A 79 15.638 -8.283 -10.305 1.00 21.43 C ATOM 1223 CG HIS A 79 16.538 -7.215 -10.846 1.00 30.25 C ATOM 1224 ND1 HIS A 79 16.970 -7.187 -12.155 1.00 11.43 N ATOM 1225 CD2 HIS A 79 17.086 -6.132 -10.246 1.00 63.52 C ATOM 1226 CE1 HIS A 79 17.746 -6.134 -12.337 1.00 5.41 C ATOM 1227 NE2 HIS A 79 17.833 -5.477 -11.194 1.00 50.11 N ATOM 0 H HIS A 79 17.808 -9.799 -9.796 1.00 30.43 H new ATOM 0 HA HIS A 79 15.958 -8.138 -8.185 1.00 52.34 H new ATOM 0 HB2 HIS A 79 15.557 -9.085 -11.039 1.00 21.43 H new ATOM 0 HB3 HIS A 79 14.638 -7.871 -10.172 1.00 21.43 H new ATOM 0 HD2 HIS A 79 16.959 -5.838 -9.214 1.00 63.52 H new ATOM 0 HE1 HIS A 79 18.228 -5.857 -13.263 1.00 5.41 H new ATOM 0 HE2 HIS A 79 18.368 -4.622 -11.041 1.00 50.11 H new ATOM 1235 N LEU A 80 14.285 -9.958 -7.815 1.00 50.21 N ATOM 1236 CA LEU A 80 13.437 -11.075 -7.415 1.00 73.34 C ATOM 1237 C LEU A 80 11.988 -10.627 -7.248 1.00 4.11 C ATOM 1238 O LEU A 80 11.718 -9.453 -6.998 1.00 54.11 O ATOM 1239 CB LEU A 80 13.947 -11.687 -6.110 1.00 23.33 C ATOM 1240 CG LEU A 80 13.106 -12.823 -5.527 1.00 21.41 C ATOM 1241 CD1 LEU A 80 13.988 -13.812 -4.781 1.00 24.31 C ATOM 1242 CD2 LEU A 80 12.026 -12.270 -4.608 1.00 65.51 C ATOM 0 H LEU A 80 14.020 -9.061 -7.408 1.00 50.21 H new ATOM 0 HA LEU A 80 13.477 -11.828 -8.202 1.00 73.34 H new ATOM 0 HB2 LEU A 80 14.958 -12.059 -6.277 1.00 23.33 H new ATOM 0 HB3 LEU A 80 14.018 -10.895 -5.364 1.00 23.33 H new ATOM 0 HG LEU A 80 12.621 -13.349 -6.349 1.00 21.41 H new ATOM 0 HD11 LEU A 80 13.372 -14.613 -4.373 1.00 24.31 H new ATOM 0 HD12 LEU A 80 14.723 -14.233 -5.467 1.00 24.31 H new ATOM 0 HD13 LEU A 80 14.502 -13.300 -3.968 1.00 24.31 H new ATOM 0 HD21 LEU A 80 11.437 -13.093 -4.202 1.00 65.51 H new ATOM 0 HD22 LEU A 80 12.491 -11.719 -3.791 1.00 65.51 H new ATOM 0 HD23 LEU A 80 11.375 -11.602 -5.172 1.00 65.51 H new ATOM 1254 N GLU A 81 11.062 -11.571 -7.385 1.00 44.23 N ATOM 1255 CA GLU A 81 9.642 -11.272 -7.247 1.00 52.05 C ATOM 1256 C GLU A 81 8.964 -12.271 -6.315 1.00 34.33 C ATOM 1257 O GLU A 81 8.860 -13.458 -6.627 1.00 2.31 O ATOM 1258 CB GLU A 81 8.959 -11.291 -8.617 1.00 12.15 C ATOM 1259 CG GLU A 81 9.154 -10.011 -9.412 1.00 15.24 C ATOM 1260 CD GLU A 81 8.905 -10.202 -10.895 1.00 60.12 C ATOM 1261 OE1 GLU A 81 7.729 -10.152 -11.312 1.00 10.43 O ATOM 1262 OE2 GLU A 81 9.888 -10.402 -11.640 1.00 33.03 O ATOM 0 H GLU A 81 11.270 -12.548 -7.591 1.00 44.23 H new ATOM 0 HA GLU A 81 9.547 -10.276 -6.815 1.00 52.05 H new ATOM 0 HB2 GLU A 81 9.346 -12.130 -9.195 1.00 12.15 H new ATOM 0 HB3 GLU A 81 7.892 -11.464 -8.479 1.00 12.15 H new ATOM 0 HG2 GLU A 81 8.480 -9.244 -9.030 1.00 15.24 H new ATOM 0 HG3 GLU A 81 10.170 -9.646 -9.262 1.00 15.24 H new ATOM 1269 N VAL A 82 8.503 -11.783 -5.167 1.00 44.23 N ATOM 1270 CA VAL A 82 7.835 -12.632 -4.188 1.00 54.44 C ATOM 1271 C VAL A 82 6.328 -12.657 -4.421 1.00 42.11 C ATOM 1272 O VAL A 82 5.631 -11.681 -4.144 1.00 52.51 O ATOM 1273 CB VAL A 82 8.113 -12.156 -2.750 1.00 70.21 C ATOM 1274 CG1 VAL A 82 7.728 -13.234 -1.748 1.00 3.44 C ATOM 1275 CG2 VAL A 82 9.575 -11.767 -2.592 1.00 11.53 C ATOM 0 H VAL A 82 8.580 -10.804 -4.893 1.00 44.23 H new ATOM 0 HA VAL A 82 8.237 -13.638 -4.314 1.00 54.44 H new ATOM 0 HB VAL A 82 7.503 -11.275 -2.552 1.00 70.21 H new ATOM 0 HG11 VAL A 82 7.931 -12.880 -0.737 1.00 3.44 H new ATOM 0 HG12 VAL A 82 6.666 -13.460 -1.847 1.00 3.44 H new ATOM 0 HG13 VAL A 82 8.310 -14.135 -1.941 1.00 3.44 H new ATOM 0 HG21 VAL A 82 9.754 -11.433 -1.570 1.00 11.53 H new ATOM 0 HG22 VAL A 82 10.206 -12.629 -2.808 1.00 11.53 H new ATOM 0 HG23 VAL A 82 9.814 -10.960 -3.285 1.00 11.53 H new ATOM 1285 N ILE A 83 5.833 -13.779 -4.931 1.00 34.41 N ATOM 1286 CA ILE A 83 4.408 -13.932 -5.199 1.00 61.31 C ATOM 1287 C ILE A 83 3.660 -14.388 -3.951 1.00 55.22 C ATOM 1288 O ILE A 83 4.098 -15.298 -3.248 1.00 65.34 O ATOM 1289 CB ILE A 83 4.154 -14.942 -6.334 1.00 22.33 C ATOM 1290 CG1 ILE A 83 2.653 -15.192 -6.498 1.00 5.34 C ATOM 1291 CG2 ILE A 83 4.886 -16.247 -6.055 1.00 41.33 C ATOM 1292 CD1 ILE A 83 2.156 -16.403 -5.740 1.00 11.53 C ATOM 0 H ILE A 83 6.397 -14.595 -5.167 1.00 34.41 H new ATOM 0 HA ILE A 83 4.037 -12.954 -5.505 1.00 61.31 H new ATOM 0 HB ILE A 83 4.537 -14.524 -7.265 1.00 22.33 H new ATOM 0 HG12 ILE A 83 2.107 -14.312 -6.159 1.00 5.34 H new ATOM 0 HG13 ILE A 83 2.427 -15.318 -7.557 1.00 5.34 H new ATOM 0 HG21 ILE A 83 4.697 -16.951 -6.866 1.00 41.33 H new ATOM 0 HG22 ILE A 83 5.957 -16.055 -5.983 1.00 41.33 H new ATOM 0 HG23 ILE A 83 4.529 -16.671 -5.116 1.00 41.33 H new ATOM 0 HD11 ILE A 83 1.084 -16.519 -5.902 1.00 11.53 H new ATOM 0 HD12 ILE A 83 2.675 -17.293 -6.095 1.00 11.53 H new ATOM 0 HD13 ILE A 83 2.350 -16.271 -4.676 1.00 11.53 H new ATOM 1304 N VAL A 84 2.525 -13.749 -3.682 1.00 61.31 N ATOM 1305 CA VAL A 84 1.713 -14.090 -2.520 1.00 73.54 C ATOM 1306 C VAL A 84 0.258 -14.318 -2.915 1.00 32.10 C ATOM 1307 O VAL A 84 -0.305 -13.567 -3.712 1.00 63.10 O ATOM 1308 CB VAL A 84 1.776 -12.987 -1.448 1.00 13.12 C ATOM 1309 CG1 VAL A 84 3.169 -12.909 -0.843 1.00 21.14 C ATOM 1310 CG2 VAL A 84 1.367 -11.646 -2.039 1.00 34.22 C ATOM 0 H VAL A 84 2.148 -12.993 -4.253 1.00 61.31 H new ATOM 0 HA VAL A 84 2.123 -15.011 -2.106 1.00 73.54 H new ATOM 0 HB VAL A 84 1.074 -13.237 -0.653 1.00 13.12 H new ATOM 0 HG11 VAL A 84 3.194 -12.124 -0.087 1.00 21.14 H new ATOM 0 HG12 VAL A 84 3.419 -13.864 -0.382 1.00 21.14 H new ATOM 0 HG13 VAL A 84 3.893 -12.683 -1.625 1.00 21.14 H new ATOM 0 HG21 VAL A 84 1.417 -10.878 -1.267 1.00 34.22 H new ATOM 0 HG22 VAL A 84 2.043 -11.386 -2.854 1.00 34.22 H new ATOM 0 HG23 VAL A 84 0.348 -11.712 -2.420 1.00 34.22 H new ATOM 1320 N ASP A 85 -0.346 -15.358 -2.351 1.00 72.45 N ATOM 1321 CA ASP A 85 -1.737 -15.685 -2.643 1.00 14.32 C ATOM 1322 C ASP A 85 -2.652 -15.221 -1.513 1.00 72.53 C ATOM 1323 O ASP A 85 -2.559 -15.709 -0.387 1.00 11.35 O ATOM 1324 CB ASP A 85 -1.896 -17.190 -2.859 1.00 62.50 C ATOM 1325 CG ASP A 85 -2.583 -17.518 -4.170 1.00 44.03 C ATOM 1326 OD1 ASP A 85 -3.400 -16.695 -4.633 1.00 62.22 O ATOM 1327 OD2 ASP A 85 -2.304 -18.597 -4.733 1.00 64.53 O ATOM 0 H ASP A 85 0.106 -15.989 -1.689 1.00 72.45 H new ATOM 0 HA ASP A 85 -2.023 -15.164 -3.556 1.00 14.32 H new ATOM 0 HB2 ASP A 85 -0.914 -17.663 -2.839 1.00 62.50 H new ATOM 0 HB3 ASP A 85 -2.471 -17.613 -2.035 1.00 62.50 H new ATOM 1332 N ARG A 86 -3.535 -14.277 -1.823 1.00 24.21 N ATOM 1333 CA ARG A 86 -4.464 -13.746 -0.833 1.00 75.44 C ATOM 1334 C ARG A 86 -3.725 -12.937 0.228 1.00 13.20 C ATOM 1335 O ARG A 86 -3.358 -13.445 1.288 1.00 51.04 O ATOM 1336 CB ARG A 86 -5.243 -14.885 -0.171 1.00 43.04 C ATOM 1337 CG ARG A 86 -6.730 -14.870 -0.486 1.00 3.42 C ATOM 1338 CD ARG A 86 -7.525 -15.653 0.547 1.00 55.24 C ATOM 1339 NE ARG A 86 -8.158 -14.777 1.529 1.00 34.22 N ATOM 1340 CZ ARG A 86 -8.964 -15.213 2.491 1.00 74.21 C ATOM 1341 NH1 ARG A 86 -9.234 -16.507 2.599 1.00 42.11 N ATOM 1342 NH2 ARG A 86 -9.502 -14.354 3.348 1.00 74.54 N ATOM 0 H ARG A 86 -3.626 -13.865 -2.751 1.00 24.21 H new ATOM 0 HA ARG A 86 -5.164 -13.086 -1.346 1.00 75.44 H new ATOM 0 HB2 ARG A 86 -4.822 -15.837 -0.493 1.00 43.04 H new ATOM 0 HB3 ARG A 86 -5.108 -14.826 0.909 1.00 43.04 H new ATOM 0 HG2 ARG A 86 -7.086 -13.840 -0.517 1.00 3.42 H new ATOM 0 HG3 ARG A 86 -6.898 -15.296 -1.475 1.00 3.42 H new ATOM 0 HD2 ARG A 86 -8.289 -16.245 0.044 1.00 55.24 H new ATOM 0 HD3 ARG A 86 -6.864 -16.353 1.058 1.00 55.24 H new ATOM 0 HE ARG A 86 -7.971 -13.776 1.473 1.00 34.22 H new ATOM 0 HH11 ARG A 86 -8.822 -17.170 1.943 1.00 42.11 H new ATOM 0 HH12 ARG A 86 -9.853 -16.839 3.339 1.00 42.11 H new ATOM 0 HH21 ARG A 86 -9.297 -13.358 3.268 1.00 74.54 H new ATOM 0 HH22 ARG A 86 -10.121 -14.690 4.086 1.00 74.54 H new ATOM 1356 N PRO A 87 -3.501 -11.647 -0.062 1.00 4.44 N ATOM 1357 CA PRO A 87 -3.932 -11.031 -1.320 1.00 15.21 C ATOM 1358 C PRO A 87 -3.137 -11.540 -2.517 1.00 41.51 C ATOM 1359 O PRO A 87 -2.034 -12.067 -2.364 1.00 51.42 O ATOM 1360 CB PRO A 87 -3.666 -9.540 -1.095 1.00 71.31 C ATOM 1361 CG PRO A 87 -2.582 -9.499 -0.074 1.00 15.13 C ATOM 1362 CD PRO A 87 -2.807 -10.690 0.817 1.00 52.51 C ATOM 0 HA PRO A 87 -4.972 -11.262 -1.551 1.00 15.21 H new ATOM 0 HB2 PRO A 87 -3.359 -9.049 -2.018 1.00 71.31 H new ATOM 0 HB3 PRO A 87 -4.561 -9.027 -0.743 1.00 71.31 H new ATOM 0 HG2 PRO A 87 -1.600 -9.544 -0.545 1.00 15.13 H new ATOM 0 HG3 PRO A 87 -2.619 -8.572 0.497 1.00 15.13 H new ATOM 0 HD2 PRO A 87 -1.867 -11.096 1.190 1.00 52.51 H new ATOM 0 HD3 PRO A 87 -3.411 -10.433 1.687 1.00 52.51 H new ATOM 1370 N LEU A 88 -3.702 -11.378 -3.709 1.00 20.45 N ATOM 1371 CA LEU A 88 -3.045 -11.821 -4.933 1.00 64.13 C ATOM 1372 C LEU A 88 -2.167 -10.715 -5.511 1.00 32.12 C ATOM 1373 O LEU A 88 -2.670 -9.725 -6.040 1.00 51.54 O ATOM 1374 CB LEU A 88 -4.086 -12.254 -5.967 1.00 11.52 C ATOM 1375 CG LEU A 88 -4.059 -13.728 -6.371 1.00 45.11 C ATOM 1376 CD1 LEU A 88 -5.473 -14.263 -6.537 1.00 4.42 C ATOM 1377 CD2 LEU A 88 -3.262 -13.914 -7.654 1.00 72.24 C ATOM 0 H LEU A 88 -4.613 -10.943 -3.853 1.00 20.45 H new ATOM 0 HA LEU A 88 -2.410 -12.672 -4.687 1.00 64.13 H new ATOM 0 HB2 LEU A 88 -5.076 -12.024 -5.574 1.00 11.52 H new ATOM 0 HB3 LEU A 88 -3.951 -11.650 -6.864 1.00 11.52 H new ATOM 0 HG LEU A 88 -3.570 -14.293 -5.578 1.00 45.11 H new ATOM 0 HD11 LEU A 88 -5.433 -15.314 -6.825 1.00 4.42 H new ATOM 0 HD12 LEU A 88 -6.012 -14.165 -5.595 1.00 4.42 H new ATOM 0 HD13 LEU A 88 -5.989 -13.694 -7.311 1.00 4.42 H new ATOM 0 HD21 LEU A 88 -3.253 -14.969 -7.927 1.00 72.24 H new ATOM 0 HD22 LEU A 88 -3.722 -13.336 -8.455 1.00 72.24 H new ATOM 0 HD23 LEU A 88 -2.239 -13.570 -7.500 1.00 72.24 H new ATOM 1389 N GLN A 89 -0.854 -10.893 -5.406 1.00 73.03 N ATOM 1390 CA GLN A 89 0.093 -9.910 -5.920 1.00 34.31 C ATOM 1391 C GLN A 89 1.529 -10.368 -5.692 1.00 65.13 C ATOM 1392 O GLN A 89 1.770 -11.428 -5.115 1.00 21.33 O ATOM 1393 CB GLN A 89 -0.135 -8.554 -5.251 1.00 1.40 C ATOM 1394 CG GLN A 89 -0.678 -7.493 -6.195 1.00 64.13 C ATOM 1395 CD GLN A 89 0.410 -6.594 -6.750 1.00 33.10 C ATOM 1396 OE1 GLN A 89 1.071 -5.869 -6.006 1.00 64.23 O ATOM 1397 NE2 GLN A 89 0.601 -6.637 -8.063 1.00 54.44 N ATOM 0 H GLN A 89 -0.422 -11.708 -4.970 1.00 73.03 H new ATOM 0 HA GLN A 89 -0.071 -9.810 -6.993 1.00 34.31 H new ATOM 0 HB2 GLN A 89 -0.830 -8.680 -4.421 1.00 1.40 H new ATOM 0 HB3 GLN A 89 0.807 -8.204 -4.828 1.00 1.40 H new ATOM 0 HG2 GLN A 89 -1.199 -7.979 -7.020 1.00 64.13 H new ATOM 0 HG3 GLN A 89 -1.413 -6.885 -5.668 1.00 64.13 H new ATOM 0 HE21 GLN A 89 0.030 -7.253 -8.642 1.00 54.44 H new ATOM 0 HE22 GLN A 89 1.319 -6.054 -8.493 1.00 54.44 H new ATOM 1406 N VAL A 90 2.482 -9.562 -6.151 1.00 11.03 N ATOM 1407 CA VAL A 90 3.896 -9.884 -5.996 1.00 55.24 C ATOM 1408 C VAL A 90 4.663 -8.712 -5.395 1.00 24.11 C ATOM 1409 O VAL A 90 4.234 -7.562 -5.487 1.00 45.22 O ATOM 1410 CB VAL A 90 4.535 -10.264 -7.345 1.00 70.20 C ATOM 1411 CG1 VAL A 90 4.130 -11.674 -7.749 1.00 43.43 C ATOM 1412 CG2 VAL A 90 4.147 -9.260 -8.420 1.00 62.21 C ATOM 0 H VAL A 90 2.300 -8.682 -6.633 1.00 11.03 H new ATOM 0 HA VAL A 90 3.955 -10.738 -5.321 1.00 55.24 H new ATOM 0 HB VAL A 90 5.619 -10.241 -7.233 1.00 70.20 H new ATOM 0 HG11 VAL A 90 4.591 -11.925 -8.704 1.00 43.43 H new ATOM 0 HG12 VAL A 90 4.463 -12.380 -6.989 1.00 43.43 H new ATOM 0 HG13 VAL A 90 3.045 -11.728 -7.844 1.00 43.43 H new ATOM 0 HG21 VAL A 90 4.607 -9.544 -9.366 1.00 62.21 H new ATOM 0 HG22 VAL A 90 3.063 -9.248 -8.533 1.00 62.21 H new ATOM 0 HG23 VAL A 90 4.492 -8.267 -8.132 1.00 62.21 H new ATOM 1422 N PHE A 91 5.802 -9.012 -4.779 1.00 11.04 N ATOM 1423 CA PHE A 91 6.631 -7.983 -4.161 1.00 32.42 C ATOM 1424 C PHE A 91 7.951 -7.826 -4.910 1.00 53.11 C ATOM 1425 O PHE A 91 8.513 -8.800 -5.411 1.00 24.01 O ATOM 1426 CB PHE A 91 6.901 -8.329 -2.695 1.00 45.10 C ATOM 1427 CG PHE A 91 5.654 -8.452 -1.868 1.00 32.01 C ATOM 1428 CD1 PHE A 91 4.739 -7.413 -1.812 1.00 34.20 C ATOM 1429 CD2 PHE A 91 5.396 -9.607 -1.147 1.00 10.43 C ATOM 1430 CE1 PHE A 91 3.590 -7.524 -1.051 1.00 2.30 C ATOM 1431 CE2 PHE A 91 4.249 -9.723 -0.384 1.00 70.02 C ATOM 1432 CZ PHE A 91 3.344 -8.680 -0.337 1.00 65.52 C ATOM 0 H PHE A 91 6.172 -9.959 -4.694 1.00 11.04 H new ATOM 0 HA PHE A 91 6.091 -7.037 -4.211 1.00 32.42 H new ATOM 0 HB2 PHE A 91 7.453 -9.268 -2.647 1.00 45.10 H new ATOM 0 HB3 PHE A 91 7.541 -7.561 -2.261 1.00 45.10 H new ATOM 0 HD1 PHE A 91 4.925 -6.507 -2.369 1.00 34.20 H new ATOM 0 HD2 PHE A 91 6.099 -10.426 -1.182 1.00 10.43 H new ATOM 0 HE1 PHE A 91 2.885 -6.707 -1.015 1.00 2.30 H new ATOM 0 HE2 PHE A 91 4.061 -10.628 0.175 1.00 70.02 H new ATOM 0 HZ PHE A 91 2.446 -8.769 0.257 1.00 65.52 H new ATOM 1442 N HIS A 92 8.439 -6.592 -4.983 1.00 41.32 N ATOM 1443 CA HIS A 92 9.693 -6.305 -5.671 1.00 71.33 C ATOM 1444 C HIS A 92 10.873 -6.391 -4.708 1.00 61.32 C ATOM 1445 O HIS A 92 10.969 -5.616 -3.757 1.00 0.02 O ATOM 1446 CB HIS A 92 9.642 -4.918 -6.312 1.00 3.24 C ATOM 1447 CG HIS A 92 10.369 -4.834 -7.618 1.00 65.33 C ATOM 1448 ND1 HIS A 92 10.240 -3.770 -8.485 1.00 55.22 N ATOM 1449 CD2 HIS A 92 11.240 -5.690 -8.203 1.00 73.15 C ATOM 1450 CE1 HIS A 92 10.997 -3.975 -9.548 1.00 31.41 C ATOM 1451 NE2 HIS A 92 11.615 -5.134 -9.401 1.00 52.45 N ATOM 0 H HIS A 92 7.986 -5.775 -4.574 1.00 41.32 H new ATOM 0 HA HIS A 92 9.830 -7.053 -6.452 1.00 71.33 H new ATOM 0 HB2 HIS A 92 8.600 -4.637 -6.467 1.00 3.24 H new ATOM 0 HB3 HIS A 92 10.069 -4.192 -5.621 1.00 3.24 H new ATOM 0 HD2 HIS A 92 11.577 -6.634 -7.802 1.00 73.15 H new ATOM 0 HE1 HIS A 92 11.094 -3.309 -10.393 1.00 31.41 H new ATOM 0 HE2 HIS A 92 12.265 -5.548 -10.069 1.00 52.45 H new ATOM 1459 N VAL A 93 11.769 -7.340 -4.961 1.00 43.12 N ATOM 1460 CA VAL A 93 12.943 -7.527 -4.117 1.00 63.22 C ATOM 1461 C VAL A 93 14.229 -7.334 -4.913 1.00 60.13 C ATOM 1462 O VAL A 93 14.380 -7.877 -6.007 1.00 42.12 O ATOM 1463 CB VAL A 93 12.955 -8.927 -3.475 1.00 64.21 C ATOM 1464 CG1 VAL A 93 14.245 -9.148 -2.700 1.00 23.11 C ATOM 1465 CG2 VAL A 93 11.744 -9.110 -2.574 1.00 11.15 C ATOM 0 H VAL A 93 11.704 -7.991 -5.744 1.00 43.12 H new ATOM 0 HA VAL A 93 12.890 -6.775 -3.330 1.00 63.22 H new ATOM 0 HB VAL A 93 12.904 -9.672 -4.269 1.00 64.21 H new ATOM 0 HG11 VAL A 93 14.235 -10.142 -2.253 1.00 23.11 H new ATOM 0 HG12 VAL A 93 15.095 -9.062 -3.377 1.00 23.11 H new ATOM 0 HG13 VAL A 93 14.330 -8.398 -1.914 1.00 23.11 H new ATOM 0 HG21 VAL A 93 11.769 -10.105 -2.129 1.00 11.15 H new ATOM 0 HG22 VAL A 93 11.761 -8.359 -1.785 1.00 11.15 H new ATOM 0 HG23 VAL A 93 10.833 -8.998 -3.162 1.00 11.15 H new ATOM 1475 N GLU A 94 15.153 -6.557 -4.356 1.00 32.40 N ATOM 1476 CA GLU A 94 16.426 -6.293 -5.015 1.00 43.31 C ATOM 1477 C GLU A 94 17.585 -6.418 -4.030 1.00 41.51 C ATOM 1478 O GLU A 94 17.738 -5.595 -3.127 1.00 63.00 O ATOM 1479 CB GLU A 94 16.422 -4.896 -5.640 1.00 31.00 C ATOM 1480 CG GLU A 94 15.163 -4.588 -6.433 1.00 13.25 C ATOM 1481 CD GLU A 94 15.202 -3.218 -7.081 1.00 45.15 C ATOM 1482 OE1 GLU A 94 16.228 -2.889 -7.713 1.00 24.41 O ATOM 1483 OE2 GLU A 94 14.207 -2.474 -6.958 1.00 34.34 O ATOM 0 H GLU A 94 15.043 -6.100 -3.451 1.00 32.40 H new ATOM 0 HA GLU A 94 16.559 -7.035 -5.802 1.00 43.31 H new ATOM 0 HB2 GLU A 94 16.535 -4.153 -4.850 1.00 31.00 H new ATOM 0 HB3 GLU A 94 17.287 -4.798 -6.295 1.00 31.00 H new ATOM 0 HG2 GLU A 94 15.029 -5.347 -7.204 1.00 13.25 H new ATOM 0 HG3 GLU A 94 14.298 -4.649 -5.772 1.00 13.25 H new ATOM 1490 N VAL A 95 18.399 -7.453 -4.211 1.00 33.13 N ATOM 1491 CA VAL A 95 19.544 -7.687 -3.339 1.00 41.53 C ATOM 1492 C VAL A 95 20.855 -7.426 -4.073 1.00 11.21 C ATOM 1493 O VAL A 95 21.104 -7.989 -5.138 1.00 75.21 O ATOM 1494 CB VAL A 95 19.551 -9.127 -2.795 1.00 71.52 C ATOM 1495 CG1 VAL A 95 18.360 -9.357 -1.877 1.00 22.30 C ATOM 1496 CG2 VAL A 95 19.553 -10.129 -3.940 1.00 52.13 C ATOM 0 H VAL A 95 18.287 -8.143 -4.954 1.00 33.13 H new ATOM 0 HA VAL A 95 19.453 -6.992 -2.504 1.00 41.53 H new ATOM 0 HB VAL A 95 20.461 -9.273 -2.213 1.00 71.52 H new ATOM 0 HG11 VAL A 95 18.382 -10.380 -1.502 1.00 22.30 H new ATOM 0 HG12 VAL A 95 18.407 -8.662 -1.038 1.00 22.30 H new ATOM 0 HG13 VAL A 95 17.436 -9.193 -2.432 1.00 22.30 H new ATOM 0 HG21 VAL A 95 19.558 -11.142 -3.537 1.00 52.13 H new ATOM 0 HG22 VAL A 95 18.661 -9.986 -4.550 1.00 52.13 H new ATOM 0 HG23 VAL A 95 20.441 -9.978 -4.554 1.00 52.13 H new ATOM 1506 N GLU A 96 21.690 -6.568 -3.495 1.00 31.25 N ATOM 1507 CA GLU A 96 22.976 -6.233 -4.094 1.00 51.35 C ATOM 1508 C GLU A 96 24.121 -6.894 -3.332 1.00 52.25 C ATOM 1509 O GLU A 96 23.999 -7.196 -2.145 1.00 53.32 O ATOM 1510 CB GLU A 96 23.173 -4.715 -4.117 1.00 71.42 C ATOM 1511 CG GLU A 96 23.895 -4.214 -5.356 1.00 44.02 C ATOM 1512 CD GLU A 96 24.200 -2.730 -5.293 1.00 43.12 C ATOM 1513 OE1 GLU A 96 23.941 -2.116 -4.237 1.00 54.10 O ATOM 1514 OE2 GLU A 96 24.698 -2.183 -6.299 1.00 51.41 O ATOM 0 H GLU A 96 21.499 -6.093 -2.613 1.00 31.25 H new ATOM 0 HA GLU A 96 22.980 -6.609 -5.117 1.00 51.35 H new ATOM 0 HB2 GLU A 96 22.199 -4.230 -4.053 1.00 71.42 H new ATOM 0 HB3 GLU A 96 23.736 -4.417 -3.233 1.00 71.42 H new ATOM 0 HG2 GLU A 96 24.826 -4.768 -5.478 1.00 44.02 H new ATOM 0 HG3 GLU A 96 23.285 -4.419 -6.235 1.00 44.02 H new ATOM 1521 N VAL A 97 25.234 -7.117 -4.024 1.00 52.55 N ATOM 1522 CA VAL A 97 26.401 -7.741 -3.414 1.00 64.13 C ATOM 1523 C VAL A 97 27.249 -6.714 -2.672 1.00 31.22 C ATOM 1524 O VAL A 97 27.455 -5.600 -3.153 1.00 0.11 O ATOM 1525 CB VAL A 97 27.276 -8.447 -4.468 1.00 55.40 C ATOM 1526 CG1 VAL A 97 26.618 -9.739 -4.929 1.00 4.32 C ATOM 1527 CG2 VAL A 97 27.538 -7.522 -5.647 1.00 71.23 C ATOM 0 H VAL A 97 25.351 -6.874 -5.008 1.00 52.55 H new ATOM 0 HA VAL A 97 26.029 -8.481 -2.706 1.00 64.13 H new ATOM 0 HB VAL A 97 28.234 -8.698 -4.012 1.00 55.40 H new ATOM 0 HG11 VAL A 97 27.250 -10.224 -5.673 1.00 4.32 H new ATOM 0 HG12 VAL A 97 26.486 -10.405 -4.076 1.00 4.32 H new ATOM 0 HG13 VAL A 97 25.646 -9.516 -5.369 1.00 4.32 H new ATOM 0 HG21 VAL A 97 28.157 -8.036 -6.382 1.00 71.23 H new ATOM 0 HG22 VAL A 97 26.590 -7.239 -6.105 1.00 71.23 H new ATOM 0 HG23 VAL A 97 28.054 -6.627 -5.300 1.00 71.23 H new ATOM 1537 N ARG A 98 27.738 -7.097 -1.497 1.00 64.21 N ATOM 1538 CA ARG A 98 28.564 -6.209 -0.687 1.00 74.30 C ATOM 1539 C ARG A 98 29.958 -6.796 -0.486 1.00 51.32 C ATOM 1540 O ARG A 98 30.138 -7.749 0.272 1.00 1.41 O ATOM 1541 CB ARG A 98 27.903 -5.961 0.670 1.00 13.01 C ATOM 1542 CG ARG A 98 27.635 -4.493 0.958 1.00 52.34 C ATOM 1543 CD ARG A 98 28.263 -4.059 2.273 1.00 44.25 C ATOM 1544 NE ARG A 98 29.602 -3.505 2.083 1.00 35.32 N ATOM 1545 CZ ARG A 98 30.351 -3.039 3.076 1.00 50.43 C ATOM 1546 NH1 ARG A 98 29.896 -3.059 4.321 1.00 53.02 N ATOM 1547 NH2 ARG A 98 31.559 -2.551 2.824 1.00 51.43 N ATOM 0 H ARG A 98 27.577 -8.016 -1.085 1.00 64.21 H new ATOM 0 HA ARG A 98 28.661 -5.261 -1.216 1.00 74.30 H new ATOM 0 HB2 ARG A 98 26.961 -6.508 0.711 1.00 13.01 H new ATOM 0 HB3 ARG A 98 28.542 -6.366 1.455 1.00 13.01 H new ATOM 0 HG2 ARG A 98 28.031 -3.884 0.146 1.00 52.34 H new ATOM 0 HG3 ARG A 98 26.560 -4.318 0.992 1.00 52.34 H new ATOM 0 HD2 ARG A 98 27.627 -3.314 2.750 1.00 44.25 H new ATOM 0 HD3 ARG A 98 28.316 -4.913 2.949 1.00 44.25 H new ATOM 0 HE ARG A 98 29.982 -3.475 1.137 1.00 35.32 H new ATOM 0 HH11 ARG A 98 28.968 -3.433 4.519 1.00 53.02 H new ATOM 0 HH12 ARG A 98 30.474 -2.700 5.081 1.00 53.02 H new ATOM 0 HH21 ARG A 98 31.913 -2.534 1.867 1.00 51.43 H new ATOM 0 HH22 ARG A 98 32.134 -2.193 3.587 1.00 51.43 H new ATOM 1561 N ASP A 99 30.940 -6.220 -1.171 1.00 22.22 N ATOM 1562 CA ASP A 99 32.319 -6.685 -1.067 1.00 55.05 C ATOM 1563 C ASP A 99 33.239 -5.860 -1.961 1.00 52.43 C ATOM 1564 O ASP A 99 32.836 -4.827 -2.498 1.00 61.11 O ATOM 1565 CB ASP A 99 32.410 -8.164 -1.447 1.00 4.20 C ATOM 1566 CG ASP A 99 33.049 -9.003 -0.357 1.00 52.44 C ATOM 1567 OD1 ASP A 99 32.564 -8.950 0.792 1.00 73.41 O ATOM 1568 OD2 ASP A 99 34.034 -9.711 -0.654 1.00 2.43 O ATOM 0 H ASP A 99 30.807 -5.431 -1.804 1.00 22.22 H new ATOM 0 HA ASP A 99 32.641 -6.563 -0.033 1.00 55.05 H new ATOM 0 HB2 ASP A 99 31.410 -8.545 -1.656 1.00 4.20 H new ATOM 0 HB3 ASP A 99 32.988 -8.265 -2.366 1.00 4.20 H new ATOM 1573 N ILE A 100 34.475 -6.321 -2.115 1.00 43.04 N ATOM 1574 CA ILE A 100 35.452 -5.625 -2.944 1.00 20.21 C ATOM 1575 C ILE A 100 36.027 -6.551 -4.011 1.00 13.21 C ATOM 1576 O ILE A 100 36.013 -7.772 -3.860 1.00 41.44 O ATOM 1577 CB ILE A 100 36.606 -5.058 -2.097 1.00 3.41 C ATOM 1578 CG1 ILE A 100 37.152 -6.132 -1.154 1.00 12.23 C ATOM 1579 CG2 ILE A 100 36.138 -3.842 -1.310 1.00 63.43 C ATOM 1580 CD1 ILE A 100 38.355 -5.681 -0.356 1.00 1.23 C ATOM 0 H ILE A 100 34.824 -7.173 -1.677 1.00 43.04 H new ATOM 0 HA ILE A 100 34.927 -4.801 -3.426 1.00 20.21 H new ATOM 0 HB ILE A 100 37.409 -4.747 -2.766 1.00 3.41 H new ATOM 0 HG12 ILE A 100 36.363 -6.435 -0.466 1.00 12.23 H new ATOM 0 HG13 ILE A 100 37.422 -7.012 -1.737 1.00 12.23 H new ATOM 0 HG21 ILE A 100 36.965 -3.453 -0.716 1.00 63.43 H new ATOM 0 HG22 ILE A 100 35.793 -3.072 -2.001 1.00 63.43 H new ATOM 0 HG23 ILE A 100 35.320 -4.129 -0.649 1.00 63.43 H new ATOM 0 HD11 ILE A 100 38.688 -6.493 0.290 1.00 1.23 H new ATOM 0 HD12 ILE A 100 39.161 -5.405 -1.037 1.00 1.23 H new ATOM 0 HD13 ILE A 100 38.085 -4.819 0.254 1.00 1.23 H new