USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 846 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 2 SER OG : rot -18:sc= 0.34 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -61:sc= -0.44 USER MOD Single : A 11 LYS NZ :NH3+ -116:sc= -0.47 (180deg=-1.69!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= -0.0162 K(o=-0.016,f=-0.54) USER MOD Single : A 28 HIS : no HD1:sc= -5.02! C(o=-5!,f=-4.3!) USER MOD Single : A 30 TYR OH : rot -80:sc= -2.38! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 150:sc= -1.01 USER MOD Single : A 36 GLN : amide:sc= -0.141 K(o=-0.14,f=-1.1) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0.084 X(o=0.084,f=-0.28) USER MOD Single : A 46 MET CE :methyl -142:sc= 0 (180deg=-0.701) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= -0.249 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -145:sc= -1.06 (180deg=-2.55) USER MOD Single : A 71 MET CE :methyl 178:sc= -2.02 (180deg=-2.06) USER MOD Single : A 76 THR OG1 : rot -45:sc= 0.822 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 165:sc= 0 (180deg=-0.096) USER MOD Single : A 87 GLN : amide:sc= -0.0706 X(o=-0.071,f=-0.45) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl 143:sc= -2.29 (180deg=-8.52!) USER MOD Single : A 95 GLN : amide:sc=-0.00569 X(o=-0.0057,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 1.149 -1.820 -2.653 1.00 0.00 N ATOM 19 CA SER A 2 0.586 -3.039 -3.220 1.00 0.00 C ATOM 20 C SER A 2 -0.841 -3.259 -2.726 1.00 0.00 C ATOM 21 O SER A 2 -1.151 -3.018 -1.558 1.00 0.00 O ATOM 22 CB SER A 2 1.454 -4.245 -2.856 1.00 0.00 C ATOM 23 OG SER A 2 1.884 -4.176 -1.507 1.00 0.00 O ATOM 0 HA SER A 2 0.565 -2.929 -4.304 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.890 -5.164 -3.014 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.321 -4.285 -3.516 1.00 0.00 H new ATOM 0 HG SER A 2 1.784 -3.258 -1.178 1.00 0.00 H new ATOM 29 N LEU A 3 -1.707 -3.718 -3.623 1.00 0.00 N ATOM 30 CA LEU A 3 -3.102 -3.971 -3.281 1.00 0.00 C ATOM 31 C LEU A 3 -3.430 -5.456 -3.394 1.00 0.00 C ATOM 32 O LEU A 3 -2.834 -6.175 -4.196 1.00 0.00 O ATOM 33 CB LEU A 3 -4.026 -3.162 -4.192 1.00 0.00 C ATOM 34 CG LEU A 3 -4.192 -1.684 -3.839 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.501 -0.868 -5.084 1.00 0.00 C ATOM 36 CD2 LEU A 3 -5.286 -1.504 -2.796 1.00 0.00 C ATOM 0 H LEU A 3 -1.467 -3.923 -4.593 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.259 -3.661 -2.248 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.648 -3.231 -5.212 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.011 -3.629 -4.184 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.253 -1.324 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.616 0.181 -4.812 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.684 -0.971 -5.798 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.425 -1.229 -5.535 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.390 -0.446 -2.557 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.230 -1.882 -3.190 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.023 -2.056 -1.894 1.00 0.00 H new ATOM 48 N LYS A 4 -4.383 -5.910 -2.587 1.00 0.00 N ATOM 49 CA LYS A 4 -4.794 -7.309 -2.598 1.00 0.00 C ATOM 50 C LYS A 4 -5.407 -7.685 -3.943 1.00 0.00 C ATOM 51 O LYS A 4 -5.233 -8.804 -4.424 1.00 0.00 O ATOM 52 CB LYS A 4 -5.798 -7.575 -1.475 1.00 0.00 C ATOM 53 CG LYS A 4 -5.191 -8.266 -0.266 1.00 0.00 C ATOM 54 CD LYS A 4 -6.128 -8.225 0.929 1.00 0.00 C ATOM 55 CE LYS A 4 -5.389 -7.845 2.203 1.00 0.00 C ATOM 56 NZ LYS A 4 -4.750 -9.026 2.847 1.00 0.00 N ATOM 0 H LYS A 4 -4.886 -5.329 -1.916 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.908 -7.924 -2.438 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.236 -6.628 -1.160 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.611 -8.189 -1.864 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -4.963 -9.302 -0.515 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -4.248 -7.785 -0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.927 -7.507 0.742 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -6.599 -9.200 1.057 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -4.627 -7.101 1.972 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -6.085 -7.382 2.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -4.257 -8.725 3.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -5.480 -9.726 3.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -4.067 -9.453 2.189 1.00 0.00 H new ATOM 70 N SER A 5 -6.125 -6.742 -4.546 1.00 0.00 N ATOM 71 CA SER A 5 -6.766 -6.976 -5.834 1.00 0.00 C ATOM 72 C SER A 5 -5.731 -7.320 -6.901 1.00 0.00 C ATOM 73 O SER A 5 -6.058 -7.910 -7.931 1.00 0.00 O ATOM 74 CB SER A 5 -7.565 -5.743 -6.261 1.00 0.00 C ATOM 75 OG SER A 5 -7.425 -4.693 -5.320 1.00 0.00 O ATOM 0 H SER A 5 -6.277 -5.809 -4.163 1.00 0.00 H new ATOM 0 HA SER A 5 -7.446 -7.821 -5.726 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.224 -5.406 -7.240 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.618 -6.006 -6.363 1.00 0.00 H new ATOM 0 HG SER A 5 -7.774 -4.983 -4.451 1.00 0.00 H new ATOM 81 N ASP A 6 -4.482 -6.945 -6.647 1.00 0.00 N ATOM 82 CA ASP A 6 -3.398 -7.214 -7.585 1.00 0.00 C ATOM 83 C ASP A 6 -3.327 -8.700 -7.922 1.00 0.00 C ATOM 84 O ASP A 6 -3.096 -9.074 -9.071 1.00 0.00 O ATOM 85 CB ASP A 6 -2.063 -6.747 -7.001 1.00 0.00 C ATOM 86 CG ASP A 6 -1.073 -6.340 -8.075 1.00 0.00 C ATOM 87 OD1 ASP A 6 -1.270 -6.733 -9.244 1.00 0.00 O ATOM 88 OD2 ASP A 6 -0.101 -5.628 -7.746 1.00 0.00 O ATOM 0 H ASP A 6 -4.195 -6.454 -5.800 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.599 -6.661 -8.503 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.237 -5.904 -6.333 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.633 -7.547 -6.399 1.00 0.00 H new ATOM 93 N GLU A 7 -3.527 -9.541 -6.913 1.00 0.00 N ATOM 94 CA GLU A 7 -3.484 -10.986 -7.103 1.00 0.00 C ATOM 95 C GLU A 7 -4.542 -11.435 -8.107 1.00 0.00 C ATOM 96 O GLU A 7 -4.298 -12.315 -8.932 1.00 0.00 O ATOM 97 CB GLU A 7 -3.694 -11.706 -5.769 1.00 0.00 C ATOM 98 CG GLU A 7 -2.489 -12.515 -5.318 1.00 0.00 C ATOM 99 CD GLU A 7 -2.846 -13.949 -4.975 1.00 0.00 C ATOM 100 OE1 GLU A 7 -3.604 -14.155 -4.004 1.00 0.00 O ATOM 101 OE2 GLU A 7 -2.366 -14.864 -5.676 1.00 0.00 O ATOM 0 H GLU A 7 -3.720 -9.247 -5.956 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.501 -11.245 -7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -3.934 -10.970 -5.002 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.555 -12.369 -5.855 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.737 -12.510 -6.107 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -2.041 -12.038 -4.447 1.00 0.00 H new ATOM 108 N VAL A 8 -5.720 -10.823 -8.029 1.00 0.00 N ATOM 109 CA VAL A 8 -6.816 -11.157 -8.930 1.00 0.00 C ATOM 110 C VAL A 8 -6.608 -10.533 -10.305 1.00 0.00 C ATOM 111 O VAL A 8 -6.834 -11.175 -11.331 1.00 0.00 O ATOM 112 CB VAL A 8 -8.170 -10.688 -8.365 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.308 -11.122 -9.276 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.372 -11.221 -6.955 1.00 0.00 C ATOM 0 H VAL A 8 -5.939 -10.093 -7.351 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.827 -12.243 -9.025 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.168 -9.599 -8.320 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.257 -10.782 -8.861 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.168 -10.687 -10.265 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.316 -12.209 -9.356 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.334 -10.880 -6.571 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.354 -12.311 -6.972 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.573 -10.855 -6.310 1.00 0.00 H new ATOM 124 N PHE A 9 -6.174 -9.277 -10.319 1.00 0.00 N ATOM 125 CA PHE A 9 -5.935 -8.564 -11.568 1.00 0.00 C ATOM 126 C PHE A 9 -4.789 -9.202 -12.347 1.00 0.00 C ATOM 127 O PHE A 9 -4.823 -9.275 -13.575 1.00 0.00 O ATOM 128 CB PHE A 9 -5.621 -7.093 -11.289 1.00 0.00 C ATOM 129 CG PHE A 9 -6.845 -6.241 -11.114 1.00 0.00 C ATOM 130 CD1 PHE A 9 -7.975 -6.748 -10.491 1.00 0.00 C ATOM 131 CD2 PHE A 9 -6.867 -4.933 -11.571 1.00 0.00 C ATOM 132 CE1 PHE A 9 -9.103 -5.966 -10.330 1.00 0.00 C ATOM 133 CE2 PHE A 9 -7.993 -4.147 -11.412 1.00 0.00 C ATOM 134 CZ PHE A 9 -9.112 -4.664 -10.789 1.00 0.00 C ATOM 0 H PHE A 9 -5.981 -8.732 -9.479 1.00 0.00 H new ATOM 0 HA PHE A 9 -6.840 -8.626 -12.172 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.009 -7.025 -10.390 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -5.026 -6.695 -12.111 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.974 -7.765 -10.128 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.994 -4.523 -12.057 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.978 -6.374 -9.845 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.998 -3.130 -11.775 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.992 -4.051 -10.661 1.00 0.00 H new ATOM 144 N ALA A 10 -3.773 -9.661 -11.624 1.00 0.00 N ATOM 145 CA ALA A 10 -2.616 -10.294 -12.245 1.00 0.00 C ATOM 146 C ALA A 10 -3.006 -11.603 -12.924 1.00 0.00 C ATOM 147 O ALA A 10 -2.667 -11.838 -14.084 1.00 0.00 O ATOM 148 CB ALA A 10 -1.528 -10.537 -11.210 1.00 0.00 C ATOM 0 H ALA A 10 -3.728 -9.606 -10.606 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.230 -9.619 -13.009 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.670 -11.010 -11.688 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.222 -9.586 -10.774 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.911 -11.189 -10.425 1.00 0.00 H new ATOM 154 N LYS A 11 -3.719 -12.453 -12.194 1.00 0.00 N ATOM 155 CA LYS A 11 -4.155 -13.739 -12.725 1.00 0.00 C ATOM 156 C LYS A 11 -5.137 -13.548 -13.877 1.00 0.00 C ATOM 157 O LYS A 11 -5.122 -14.303 -14.849 1.00 0.00 O ATOM 158 CB LYS A 11 -4.805 -14.576 -11.621 1.00 0.00 C ATOM 159 CG LYS A 11 -6.040 -13.931 -11.015 1.00 0.00 C ATOM 160 CD LYS A 11 -6.686 -14.830 -9.975 1.00 0.00 C ATOM 161 CE LYS A 11 -5.792 -15.004 -8.757 1.00 0.00 C ATOM 162 NZ LYS A 11 -6.348 -14.317 -7.558 1.00 0.00 N ATOM 0 H LYS A 11 -4.008 -12.275 -11.232 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.277 -14.264 -13.102 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.077 -15.550 -12.028 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -4.074 -14.753 -10.832 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.767 -12.981 -10.556 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -6.760 -13.710 -11.803 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -7.642 -14.405 -9.668 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.897 -15.805 -10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.672 -16.066 -8.544 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.800 -14.608 -8.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.703 -13.556 -7.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.278 -13.912 -7.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.452 -15.002 -6.783 1.00 0.00 H new ATOM 176 N ILE A 12 -5.986 -12.533 -13.761 1.00 0.00 N ATOM 177 CA ILE A 12 -6.972 -12.241 -14.794 1.00 0.00 C ATOM 178 C ILE A 12 -6.297 -11.834 -16.099 1.00 0.00 C ATOM 179 O ILE A 12 -6.676 -12.294 -17.176 1.00 0.00 O ATOM 180 CB ILE A 12 -7.933 -11.120 -14.355 1.00 0.00 C ATOM 181 CG1 ILE A 12 -8.895 -11.635 -13.283 1.00 0.00 C ATOM 182 CG2 ILE A 12 -8.703 -10.584 -15.553 1.00 0.00 C ATOM 183 CD1 ILE A 12 -9.513 -10.535 -12.447 1.00 0.00 C ATOM 0 H ILE A 12 -6.011 -11.899 -12.962 1.00 0.00 H new ATOM 0 HA ILE A 12 -7.543 -13.156 -14.953 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.348 -10.305 -13.930 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -9.690 -12.205 -13.763 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -8.361 -12.322 -12.627 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -9.378 -9.793 -15.227 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.003 -10.185 -16.287 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -9.281 -11.390 -16.005 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -10.184 -10.973 -11.708 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -8.726 -9.979 -11.938 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -10.075 -9.860 -13.092 1.00 0.00 H new ATOM 195 N ALA A 13 -5.293 -10.970 -15.995 1.00 0.00 N ATOM 196 CA ALA A 13 -4.561 -10.504 -17.167 1.00 0.00 C ATOM 197 C ALA A 13 -3.924 -11.670 -17.916 1.00 0.00 C ATOM 198 O ALA A 13 -4.041 -11.775 -19.137 1.00 0.00 O ATOM 199 CB ALA A 13 -3.500 -9.493 -16.759 1.00 0.00 C ATOM 0 H ALA A 13 -4.968 -10.578 -15.111 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.270 -10.019 -17.838 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.961 -9.154 -17.644 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.977 -8.640 -16.275 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.801 -9.959 -16.065 1.00 0.00 H new ATOM 205 N LYS A 14 -3.249 -12.543 -17.177 1.00 0.00 N ATOM 206 CA LYS A 14 -2.592 -13.702 -17.770 1.00 0.00 C ATOM 207 C LYS A 14 -3.601 -14.585 -18.497 1.00 0.00 C ATOM 208 O LYS A 14 -3.336 -15.069 -19.598 1.00 0.00 O ATOM 209 CB LYS A 14 -1.873 -14.514 -16.691 1.00 0.00 C ATOM 210 CG LYS A 14 -0.693 -13.788 -16.069 1.00 0.00 C ATOM 211 CD LYS A 14 0.624 -14.458 -16.423 1.00 0.00 C ATOM 212 CE LYS A 14 1.813 -13.632 -15.957 1.00 0.00 C ATOM 213 NZ LYS A 14 3.078 -14.418 -15.980 1.00 0.00 N ATOM 0 H LYS A 14 -3.142 -12.470 -16.165 1.00 0.00 H new ATOM 0 HA LYS A 14 -1.860 -13.343 -18.494 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.585 -14.771 -15.907 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -1.525 -15.451 -17.125 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.680 -12.753 -16.412 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.810 -13.763 -14.986 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.665 -15.447 -15.966 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.681 -14.603 -17.502 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.919 -12.755 -16.596 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.629 -13.269 -14.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.864 -13.820 -15.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.987 -15.241 -15.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.267 -14.743 -16.950 1.00 0.00 H new ATOM 227 N ARG A 15 -4.758 -14.790 -17.876 1.00 0.00 N ATOM 228 CA ARG A 15 -5.806 -15.615 -18.466 1.00 0.00 C ATOM 229 C ARG A 15 -6.330 -14.989 -19.755 1.00 0.00 C ATOM 230 O ARG A 15 -6.768 -15.693 -20.666 1.00 0.00 O ATOM 231 CB ARG A 15 -6.955 -15.802 -17.474 1.00 0.00 C ATOM 232 CG ARG A 15 -6.533 -16.460 -16.170 1.00 0.00 C ATOM 233 CD ARG A 15 -7.162 -17.835 -16.010 1.00 0.00 C ATOM 234 NE ARG A 15 -6.666 -18.529 -14.825 1.00 0.00 N ATOM 235 CZ ARG A 15 -7.237 -19.616 -14.318 1.00 0.00 C ATOM 236 NH1 ARG A 15 -8.318 -20.130 -14.889 1.00 0.00 N ATOM 237 NH2 ARG A 15 -6.727 -20.192 -13.236 1.00 0.00 N ATOM 0 H ARG A 15 -4.994 -14.396 -16.965 1.00 0.00 H new ATOM 0 HA ARG A 15 -5.377 -16.589 -18.704 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -7.396 -14.830 -17.254 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -7.732 -16.406 -17.941 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -5.447 -16.550 -16.142 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -6.822 -15.827 -15.331 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.245 -17.733 -15.943 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.952 -18.435 -16.896 1.00 0.00 H new ATOM 0 HE ARG A 15 -5.836 -18.159 -14.361 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.714 -19.691 -15.720 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -8.754 -20.965 -14.497 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -5.896 -19.800 -12.793 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -7.166 -21.027 -12.847 1.00 0.00 H new ATOM 251 N LEU A 16 -6.282 -13.663 -19.825 1.00 0.00 N ATOM 252 CA LEU A 16 -6.752 -12.942 -21.002 1.00 0.00 C ATOM 253 C LEU A 16 -5.761 -13.074 -22.154 1.00 0.00 C ATOM 254 O LEU A 16 -6.059 -12.700 -23.288 1.00 0.00 O ATOM 255 CB LEU A 16 -6.968 -11.465 -20.667 1.00 0.00 C ATOM 256 CG LEU A 16 -8.040 -11.164 -19.620 1.00 0.00 C ATOM 257 CD1 LEU A 16 -7.665 -9.932 -18.811 1.00 0.00 C ATOM 258 CD2 LEU A 16 -9.396 -10.975 -20.285 1.00 0.00 C ATOM 0 H LEU A 16 -5.922 -13.066 -19.080 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.701 -13.381 -21.311 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.022 -11.050 -20.319 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.228 -10.939 -21.586 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.106 -12.014 -18.940 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.440 -9.733 -18.071 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.715 -10.104 -18.305 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.571 -9.074 -19.477 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.147 -10.762 -19.525 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.344 -10.143 -20.987 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.669 -11.885 -20.820 1.00 0.00 H new ATOM 270 N GLU A 17 -4.582 -13.611 -21.854 1.00 0.00 N ATOM 271 CA GLU A 17 -3.547 -13.794 -22.866 1.00 0.00 C ATOM 272 C GLU A 17 -3.850 -15.008 -23.739 1.00 0.00 C ATOM 273 O GLU A 17 -3.269 -15.175 -24.812 1.00 0.00 O ATOM 274 CB GLU A 17 -2.178 -13.957 -22.203 1.00 0.00 C ATOM 275 CG GLU A 17 -1.789 -12.788 -21.314 1.00 0.00 C ATOM 276 CD GLU A 17 -0.333 -12.834 -20.894 1.00 0.00 C ATOM 277 OE1 GLU A 17 0.518 -13.179 -21.741 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.044 -12.525 -19.719 1.00 0.00 O ATOM 0 H GLU A 17 -4.320 -13.926 -20.920 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.532 -12.907 -23.499 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.178 -14.870 -21.608 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.421 -14.081 -22.977 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.981 -11.854 -21.843 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.420 -12.787 -20.425 1.00 0.00 H new ATOM 285 N SER A 18 -4.762 -15.855 -23.271 1.00 0.00 N ATOM 286 CA SER A 18 -5.138 -17.056 -24.007 1.00 0.00 C ATOM 287 C SER A 18 -6.417 -16.825 -24.806 1.00 0.00 C ATOM 288 O SER A 18 -6.899 -17.722 -25.499 1.00 0.00 O ATOM 289 CB SER A 18 -5.329 -18.230 -23.044 1.00 0.00 C ATOM 290 OG SER A 18 -4.232 -19.125 -23.107 1.00 0.00 O ATOM 0 H SER A 18 -5.254 -15.731 -22.386 1.00 0.00 H new ATOM 0 HA SER A 18 -4.334 -17.293 -24.703 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.439 -17.855 -22.026 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.249 -18.760 -23.290 1.00 0.00 H new ATOM 0 HG SER A 18 -4.377 -19.865 -22.481 1.00 0.00 H new ATOM 296 N ILE A 19 -6.962 -15.618 -24.702 1.00 0.00 N ATOM 297 CA ILE A 19 -8.185 -15.268 -25.415 1.00 0.00 C ATOM 298 C ILE A 19 -8.015 -15.451 -26.920 1.00 0.00 C ATOM 299 O ILE A 19 -6.961 -15.144 -27.478 1.00 0.00 O ATOM 300 CB ILE A 19 -8.606 -13.815 -25.130 1.00 0.00 C ATOM 301 CG1 ILE A 19 -8.725 -13.581 -23.623 1.00 0.00 C ATOM 302 CG2 ILE A 19 -9.922 -13.499 -25.826 1.00 0.00 C ATOM 303 CD1 ILE A 19 -9.966 -14.195 -23.013 1.00 0.00 C ATOM 0 H ILE A 19 -6.576 -14.866 -24.131 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.964 -15.940 -25.055 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.840 -13.147 -25.523 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -7.845 -13.993 -23.129 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.727 -12.508 -23.429 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -10.207 -12.468 -25.615 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.805 -13.630 -26.902 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -10.698 -14.172 -25.460 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -9.985 -13.990 -21.943 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -10.852 -13.765 -23.481 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -9.956 -15.273 -23.176 1.00 0.00 H new ATOM 315 N ASP A 20 -9.059 -15.952 -27.571 1.00 0.00 N ATOM 316 CA ASP A 20 -9.027 -16.173 -29.012 1.00 0.00 C ATOM 317 C ASP A 20 -9.937 -15.184 -29.733 1.00 0.00 C ATOM 318 O ASP A 20 -10.864 -14.619 -29.153 1.00 0.00 O ATOM 319 CB ASP A 20 -9.450 -17.606 -29.339 1.00 0.00 C ATOM 320 CG ASP A 20 -8.322 -18.418 -29.946 1.00 0.00 C ATOM 321 OD1 ASP A 20 -7.235 -18.473 -29.335 1.00 0.00 O ATOM 322 OD2 ASP A 20 -8.527 -18.997 -31.034 1.00 0.00 O ATOM 0 H ASP A 20 -9.938 -16.213 -27.124 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.005 -16.017 -29.356 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.798 -18.096 -28.429 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.292 -17.584 -30.031 1.00 0.00 H new ATOM 327 N PRO A 21 -9.667 -14.968 -31.029 1.00 0.00 N ATOM 328 CA PRO A 21 -10.450 -14.047 -31.858 1.00 0.00 C ATOM 329 C PRO A 21 -11.855 -14.569 -32.137 1.00 0.00 C ATOM 330 O PRO A 21 -12.802 -13.793 -32.263 1.00 0.00 O ATOM 331 CB PRO A 21 -9.642 -13.964 -33.156 1.00 0.00 C ATOM 332 CG PRO A 21 -8.884 -15.245 -33.212 1.00 0.00 C ATOM 333 CD PRO A 21 -8.577 -15.608 -31.785 1.00 0.00 C ATOM 0 HA PRO A 21 -10.597 -13.084 -31.369 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.294 -13.852 -34.022 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.970 -13.106 -33.150 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.472 -16.025 -33.695 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.968 -15.131 -33.791 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.566 -16.688 -31.638 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -7.601 -15.235 -31.476 1.00 0.00 H new ATOM 341 N ALA A 22 -11.983 -15.888 -32.233 1.00 0.00 N ATOM 342 CA ALA A 22 -13.273 -16.514 -32.494 1.00 0.00 C ATOM 343 C ALA A 22 -14.180 -16.435 -31.271 1.00 0.00 C ATOM 344 O ALA A 22 -15.308 -15.951 -31.353 1.00 0.00 O ATOM 345 CB ALA A 22 -13.081 -17.963 -32.918 1.00 0.00 C ATOM 0 H ALA A 22 -11.208 -16.544 -32.134 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.754 -15.970 -33.306 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.053 -18.418 -33.110 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.478 -18.000 -33.825 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -12.574 -18.511 -32.123 1.00 0.00 H new ATOM 351 N ASN A 23 -13.679 -16.913 -30.137 1.00 0.00 N ATOM 352 CA ASN A 23 -14.445 -16.897 -28.896 1.00 0.00 C ATOM 353 C ASN A 23 -14.179 -15.618 -28.109 1.00 0.00 C ATOM 354 O ASN A 23 -13.044 -15.340 -27.721 1.00 0.00 O ATOM 355 CB ASN A 23 -14.096 -18.117 -28.041 1.00 0.00 C ATOM 356 CG ASN A 23 -15.209 -19.146 -28.020 1.00 0.00 C ATOM 357 OD1 ASN A 23 -16.222 -18.968 -27.342 1.00 0.00 O ATOM 358 ND2 ASN A 23 -15.027 -20.231 -28.764 1.00 0.00 N ATOM 0 H ASN A 23 -12.746 -17.316 -30.052 1.00 0.00 H new ATOM 0 HA ASN A 23 -15.504 -16.932 -29.152 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -13.186 -18.578 -28.425 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -13.884 -17.794 -27.022 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -15.742 -20.958 -28.789 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -14.172 -20.337 -29.310 1.00 0.00 H new ATOM 365 N ARG A 24 -15.233 -14.843 -27.876 1.00 0.00 N ATOM 366 CA ARG A 24 -15.114 -13.592 -27.136 1.00 0.00 C ATOM 367 C ARG A 24 -16.490 -13.042 -26.772 1.00 0.00 C ATOM 368 O ARG A 24 -16.683 -12.500 -25.685 1.00 0.00 O ATOM 369 CB ARG A 24 -14.342 -12.559 -27.959 1.00 0.00 C ATOM 370 CG ARG A 24 -12.944 -12.282 -27.431 1.00 0.00 C ATOM 371 CD ARG A 24 -12.009 -11.828 -28.541 1.00 0.00 C ATOM 372 NE ARG A 24 -11.784 -10.385 -28.512 1.00 0.00 N ATOM 373 CZ ARG A 24 -11.246 -9.705 -29.518 1.00 0.00 C ATOM 374 NH1 ARG A 24 -10.879 -10.333 -30.626 1.00 0.00 N ATOM 375 NH2 ARG A 24 -11.073 -8.393 -29.416 1.00 0.00 N ATOM 0 H ARG A 24 -16.179 -15.059 -28.189 1.00 0.00 H new ATOM 0 HA ARG A 24 -14.568 -13.795 -26.215 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -14.270 -12.908 -28.989 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.906 -11.626 -27.977 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -12.991 -11.516 -26.657 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -12.545 -13.182 -26.964 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.055 -12.346 -28.445 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.429 -12.110 -29.507 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.055 -9.872 -27.673 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -11.010 -11.341 -30.708 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.466 -9.808 -31.397 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -11.353 -7.906 -28.565 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.660 -7.871 -30.189 1.00 0.00 H new ATOM 389 N GLN A 25 -17.441 -13.187 -27.690 1.00 0.00 N ATOM 390 CA GLN A 25 -18.798 -12.703 -27.465 1.00 0.00 C ATOM 391 C GLN A 25 -18.847 -11.179 -27.506 1.00 0.00 C ATOM 392 O GLN A 25 -19.407 -10.591 -28.431 1.00 0.00 O ATOM 393 CB GLN A 25 -19.325 -13.206 -26.120 1.00 0.00 C ATOM 394 CG GLN A 25 -18.956 -14.650 -25.823 1.00 0.00 C ATOM 395 CD GLN A 25 -20.037 -15.383 -25.054 1.00 0.00 C ATOM 396 OE1 GLN A 25 -20.814 -14.772 -24.319 1.00 0.00 O ATOM 397 NE2 GLN A 25 -20.094 -16.699 -25.219 1.00 0.00 N ATOM 0 H GLN A 25 -17.297 -13.635 -28.595 1.00 0.00 H new ATOM 0 HA GLN A 25 -19.431 -13.090 -28.263 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -18.935 -12.570 -25.326 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -20.410 -13.107 -26.104 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -18.765 -15.172 -26.761 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -18.029 -14.674 -25.250 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -19.430 -17.165 -25.838 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -20.802 -17.245 -24.727 1.00 0.00 H new ATOM 406 N VAL A 26 -18.257 -10.545 -26.498 1.00 0.00 N ATOM 407 CA VAL A 26 -18.232 -9.090 -26.420 1.00 0.00 C ATOM 408 C VAL A 26 -17.110 -8.607 -25.508 1.00 0.00 C ATOM 409 O VAL A 26 -16.908 -9.143 -24.419 1.00 0.00 O ATOM 410 CB VAL A 26 -19.573 -8.533 -25.904 1.00 0.00 C ATOM 411 CG1 VAL A 26 -19.784 -8.914 -24.447 1.00 0.00 C ATOM 412 CG2 VAL A 26 -19.625 -7.023 -26.082 1.00 0.00 C ATOM 0 H VAL A 26 -17.790 -11.017 -25.724 1.00 0.00 H new ATOM 0 HA VAL A 26 -18.058 -8.722 -27.431 1.00 0.00 H new ATOM 0 HB VAL A 26 -20.380 -8.973 -26.490 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -20.736 -8.512 -24.100 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -19.793 -10.000 -24.352 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -18.975 -8.504 -23.843 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -20.579 -6.646 -25.713 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -18.811 -6.562 -25.522 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -19.523 -6.778 -27.139 1.00 0.00 H new ATOM 422 N GLU A 27 -16.381 -7.592 -25.962 1.00 0.00 N ATOM 423 CA GLU A 27 -15.278 -7.037 -25.186 1.00 0.00 C ATOM 424 C GLU A 27 -15.342 -5.513 -25.162 1.00 0.00 C ATOM 425 O GLU A 27 -15.297 -4.862 -26.207 1.00 0.00 O ATOM 426 CB GLU A 27 -13.938 -7.494 -25.766 1.00 0.00 C ATOM 427 CG GLU A 27 -13.554 -8.910 -25.370 1.00 0.00 C ATOM 428 CD GLU A 27 -13.092 -9.007 -23.929 1.00 0.00 C ATOM 429 OE1 GLU A 27 -13.950 -8.928 -23.025 1.00 0.00 O ATOM 430 OE2 GLU A 27 -11.873 -9.163 -23.705 1.00 0.00 O ATOM 0 H GLU A 27 -16.534 -7.138 -26.862 1.00 0.00 H new ATOM 0 HA GLU A 27 -15.367 -7.402 -24.163 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.981 -7.429 -26.853 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.157 -6.809 -25.437 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -14.409 -9.570 -25.519 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.760 -9.264 -26.027 1.00 0.00 H new ATOM 437 N HIS A 28 -15.447 -4.949 -23.963 1.00 0.00 N ATOM 438 CA HIS A 28 -15.517 -3.501 -23.802 1.00 0.00 C ATOM 439 C HIS A 28 -14.574 -3.031 -22.699 1.00 0.00 C ATOM 440 O HIS A 28 -14.390 -3.715 -21.693 1.00 0.00 O ATOM 441 CB HIS A 28 -16.949 -3.071 -23.483 1.00 0.00 C ATOM 442 CG HIS A 28 -17.706 -4.070 -22.663 1.00 0.00 C ATOM 443 ND1 HIS A 28 -17.867 -3.956 -21.298 1.00 0.00 N ATOM 444 CD2 HIS A 28 -18.349 -5.205 -23.023 1.00 0.00 C ATOM 445 CE1 HIS A 28 -18.575 -4.979 -20.854 1.00 0.00 C ATOM 446 NE2 HIS A 28 -18.880 -5.752 -21.880 1.00 0.00 N ATOM 0 H HIS A 28 -15.485 -5.473 -23.089 1.00 0.00 H new ATOM 0 HA HIS A 28 -15.208 -3.040 -24.740 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -16.924 -2.120 -22.950 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -17.485 -2.899 -24.417 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -18.430 -5.606 -24.023 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -18.857 -5.153 -19.826 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.422 -6.615 -21.832 1.00 0.00 H new ATOM 454 N VAL A 29 -13.979 -1.858 -22.896 1.00 0.00 N ATOM 455 CA VAL A 29 -13.056 -1.296 -21.918 1.00 0.00 C ATOM 456 C VAL A 29 -13.752 -1.044 -20.586 1.00 0.00 C ATOM 457 O VAL A 29 -14.819 -0.430 -20.537 1.00 0.00 O ATOM 458 CB VAL A 29 -12.440 0.023 -22.421 1.00 0.00 C ATOM 459 CG1 VAL A 29 -11.454 0.575 -21.402 1.00 0.00 C ATOM 460 CG2 VAL A 29 -11.767 -0.183 -23.769 1.00 0.00 C ATOM 0 H VAL A 29 -14.120 -1.279 -23.724 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.261 -2.028 -21.776 1.00 0.00 H new ATOM 0 HB VAL A 29 -13.240 0.752 -22.548 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.029 1.507 -21.775 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.970 0.763 -20.461 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.655 -0.149 -21.240 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -11.337 0.759 -24.109 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -10.977 -0.928 -23.671 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.504 -0.529 -24.494 1.00 0.00 H new ATOM 470 N TYR A 30 -13.143 -1.521 -19.506 1.00 0.00 N ATOM 471 CA TYR A 30 -13.705 -1.349 -18.172 1.00 0.00 C ATOM 472 C TYR A 30 -12.699 -0.685 -17.238 1.00 0.00 C ATOM 473 O TYR A 30 -11.490 -0.886 -17.362 1.00 0.00 O ATOM 474 CB TYR A 30 -14.135 -2.701 -17.599 1.00 0.00 C ATOM 475 CG TYR A 30 -15.532 -2.696 -17.019 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.636 -2.435 -17.820 1.00 0.00 C ATOM 477 CD2 TYR A 30 -15.747 -2.955 -15.671 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.914 -2.429 -17.295 1.00 0.00 C ATOM 479 CE2 TYR A 30 -17.021 -2.953 -15.138 1.00 0.00 C ATOM 480 CZ TYR A 30 -18.101 -2.689 -15.954 1.00 0.00 C ATOM 481 OH TYR A 30 -19.373 -2.685 -15.427 1.00 0.00 O ATOM 0 H TYR A 30 -12.259 -2.030 -19.529 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.578 -0.702 -18.254 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -14.080 -3.454 -18.385 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -13.430 -2.998 -16.823 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.493 -2.233 -18.871 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -14.903 -3.161 -15.029 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.762 -2.222 -17.931 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -17.171 -3.157 -14.088 1.00 0.00 H new ATOM 0 HH TYR A 30 -19.656 -1.761 -15.262 1.00 0.00 H new ATOM 491 N LYS A 31 -13.206 0.109 -16.301 1.00 0.00 N ATOM 492 CA LYS A 31 -12.354 0.803 -15.342 1.00 0.00 C ATOM 493 C LYS A 31 -12.563 0.258 -13.933 1.00 0.00 C ATOM 494 O LYS A 31 -13.697 0.087 -13.485 1.00 0.00 O ATOM 495 CB LYS A 31 -12.643 2.306 -15.367 1.00 0.00 C ATOM 496 CG LYS A 31 -12.158 3.039 -14.128 1.00 0.00 C ATOM 497 CD LYS A 31 -11.565 4.393 -14.477 1.00 0.00 C ATOM 498 CE LYS A 31 -12.650 5.437 -14.697 1.00 0.00 C ATOM 499 NZ LYS A 31 -12.079 6.759 -15.076 1.00 0.00 N ATOM 0 H LYS A 31 -14.203 0.288 -16.185 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.316 0.633 -15.627 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.170 2.744 -16.246 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -13.717 2.459 -15.473 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -12.989 3.172 -13.435 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.410 2.434 -13.616 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.902 4.719 -13.675 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -10.957 4.304 -15.377 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.328 5.097 -15.479 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -13.241 5.544 -13.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.850 7.443 -15.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.451 7.096 -14.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.536 6.663 -15.958 1.00 0.00 H new ATOM 513 N PHE A 32 -11.463 -0.013 -13.239 1.00 0.00 N ATOM 514 CA PHE A 32 -11.526 -0.539 -11.880 1.00 0.00 C ATOM 515 C PHE A 32 -10.955 0.464 -10.882 1.00 0.00 C ATOM 516 O PHE A 32 -9.826 0.930 -11.031 1.00 0.00 O ATOM 517 CB PHE A 32 -10.761 -1.861 -11.786 1.00 0.00 C ATOM 518 CG PHE A 32 -11.395 -2.977 -12.567 1.00 0.00 C ATOM 519 CD1 PHE A 32 -12.682 -3.400 -12.276 1.00 0.00 C ATOM 520 CD2 PHE A 32 -10.703 -3.603 -13.591 1.00 0.00 C ATOM 521 CE1 PHE A 32 -13.268 -4.427 -12.993 1.00 0.00 C ATOM 522 CE2 PHE A 32 -11.284 -4.630 -14.312 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.567 -5.043 -14.011 1.00 0.00 C ATOM 0 H PHE A 32 -10.517 0.123 -13.595 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.573 -0.715 -11.633 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.743 -1.709 -12.145 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.689 -2.156 -10.739 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.234 -2.922 -11.480 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.699 -3.285 -13.829 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -14.272 -4.747 -12.757 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -10.735 -5.109 -15.110 1.00 0.00 H new ATOM 0 HZ PHE A 32 -13.022 -5.847 -14.571 1.00 0.00 H new ATOM 533 N ARG A 33 -11.745 0.791 -9.864 1.00 0.00 N ATOM 534 CA ARG A 33 -11.320 1.740 -8.842 1.00 0.00 C ATOM 535 C ARG A 33 -11.170 1.050 -7.489 1.00 0.00 C ATOM 536 O ARG A 33 -12.128 0.485 -6.961 1.00 0.00 O ATOM 537 CB ARG A 33 -12.324 2.888 -8.733 1.00 0.00 C ATOM 538 CG ARG A 33 -11.828 4.191 -9.338 1.00 0.00 C ATOM 539 CD ARG A 33 -12.390 5.397 -8.602 1.00 0.00 C ATOM 540 NE ARG A 33 -13.251 6.209 -9.459 1.00 0.00 N ATOM 541 CZ ARG A 33 -12.796 6.974 -10.444 1.00 0.00 C ATOM 542 NH1 ARG A 33 -11.496 7.032 -10.697 1.00 0.00 N ATOM 543 NH2 ARG A 33 -13.642 7.683 -11.180 1.00 0.00 N ATOM 0 H ARG A 33 -12.682 0.413 -9.725 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.350 2.142 -9.135 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.251 2.597 -9.228 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.562 3.053 -7.682 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -10.739 4.218 -9.304 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.115 4.238 -10.388 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -12.957 5.060 -7.734 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.569 6.009 -8.229 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.257 6.187 -9.291 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -10.842 6.488 -10.134 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -11.150 7.621 -11.455 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -14.643 7.641 -10.989 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -13.291 8.270 -11.937 1.00 0.00 H new ATOM 557 N ILE A 34 -9.964 1.101 -6.935 1.00 0.00 N ATOM 558 CA ILE A 34 -9.689 0.483 -5.644 1.00 0.00 C ATOM 559 C ILE A 34 -9.404 1.536 -4.579 1.00 0.00 C ATOM 560 O ILE A 34 -8.431 2.285 -4.674 1.00 0.00 O ATOM 561 CB ILE A 34 -8.494 -0.485 -5.726 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.854 -1.703 -6.580 1.00 0.00 C ATOM 563 CG2 ILE A 34 -8.065 -0.916 -4.332 1.00 0.00 C ATOM 564 CD1 ILE A 34 -7.648 -2.440 -7.119 1.00 0.00 C ATOM 0 H ILE A 34 -9.161 1.564 -7.360 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.582 -0.078 -5.367 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.658 0.032 -6.198 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.453 -2.391 -5.983 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -9.476 -1.380 -7.415 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.220 -1.600 -4.407 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.773 -0.039 -3.754 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.895 -1.418 -3.835 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.978 -3.291 -7.715 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.059 -1.767 -7.743 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.037 -2.793 -6.289 1.00 0.00 H new ATOM 576 N THR A 35 -10.259 1.588 -3.562 1.00 0.00 N ATOM 577 CA THR A 35 -10.099 2.549 -2.478 1.00 0.00 C ATOM 578 C THR A 35 -9.353 1.931 -1.301 1.00 0.00 C ATOM 579 O THR A 35 -9.539 0.756 -0.986 1.00 0.00 O ATOM 580 CB THR A 35 -11.462 3.075 -1.988 1.00 0.00 C ATOM 581 OG1 THR A 35 -12.243 1.996 -1.463 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.219 3.752 -3.121 1.00 0.00 C ATOM 0 H THR A 35 -11.069 0.976 -3.467 1.00 0.00 H new ATOM 0 HA THR A 35 -9.518 3.381 -2.876 1.00 0.00 H new ATOM 0 HB THR A 35 -11.283 3.809 -1.202 1.00 0.00 H new ATOM 0 HG1 THR A 35 -12.835 2.333 -0.759 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.178 4.115 -2.752 1.00 0.00 H new ATOM 0 HG22 THR A 35 -11.634 4.591 -3.499 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.388 3.036 -3.925 1.00 0.00 H new ATOM 590 N GLN A 36 -8.510 2.730 -0.656 1.00 0.00 N ATOM 591 CA GLN A 36 -7.736 2.260 0.487 1.00 0.00 C ATOM 592 C GLN A 36 -8.453 2.572 1.796 1.00 0.00 C ATOM 593 O GLN A 36 -8.497 3.721 2.233 1.00 0.00 O ATOM 594 CB GLN A 36 -6.347 2.901 0.488 1.00 0.00 C ATOM 595 CG GLN A 36 -5.213 1.896 0.359 1.00 0.00 C ATOM 596 CD GLN A 36 -4.225 1.981 1.506 1.00 0.00 C ATOM 597 OE1 GLN A 36 -4.592 2.314 2.633 1.00 0.00 O ATOM 598 NE2 GLN A 36 -2.963 1.681 1.224 1.00 0.00 N ATOM 0 H GLN A 36 -8.345 3.705 -0.905 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.630 1.179 0.401 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.285 3.614 -0.334 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.217 3.466 1.411 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -5.628 0.889 0.316 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -4.688 2.065 -0.581 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -2.703 1.410 0.276 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -2.253 1.722 1.956 1.00 0.00 H new ATOM 607 N GLY A 37 -9.016 1.540 2.418 1.00 0.00 N ATOM 608 CA GLY A 37 -9.725 1.725 3.670 1.00 0.00 C ATOM 609 C GLY A 37 -11.125 2.270 3.469 1.00 0.00 C ATOM 610 O GLY A 37 -12.087 1.751 4.034 1.00 0.00 O ATOM 0 H GLY A 37 -8.993 0.579 2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.782 0.772 4.196 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.161 2.407 4.306 1.00 0.00 H new ATOM 614 N GLY A 38 -11.240 3.320 2.662 1.00 0.00 N ATOM 615 CA GLY A 38 -12.536 3.919 2.404 1.00 0.00 C ATOM 616 C GLY A 38 -12.454 5.084 1.438 1.00 0.00 C ATOM 617 O GLY A 38 -13.447 5.771 1.195 1.00 0.00 O ATOM 0 H GLY A 38 -10.458 3.767 2.182 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -13.209 3.162 2.000 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -12.969 4.260 3.344 1.00 0.00 H new ATOM 621 N LYS A 39 -11.267 5.310 0.885 1.00 0.00 N ATOM 622 CA LYS A 39 -11.058 6.401 -0.060 1.00 0.00 C ATOM 623 C LYS A 39 -10.245 5.930 -1.262 1.00 0.00 C ATOM 624 O LYS A 39 -9.292 5.165 -1.118 1.00 0.00 O ATOM 625 CB LYS A 39 -10.345 7.568 0.626 1.00 0.00 C ATOM 626 CG LYS A 39 -10.655 8.920 0.007 1.00 0.00 C ATOM 627 CD LYS A 39 -11.952 9.497 0.549 1.00 0.00 C ATOM 628 CE LYS A 39 -11.691 10.566 1.599 1.00 0.00 C ATOM 629 NZ LYS A 39 -12.852 10.739 2.514 1.00 0.00 N ATOM 0 H LYS A 39 -10.435 4.752 1.075 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.034 6.736 -0.412 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -10.627 7.587 1.679 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.269 7.398 0.587 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.836 9.610 0.209 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -10.726 8.818 -1.076 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -12.532 9.924 -0.270 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -12.553 8.698 0.983 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.808 10.297 2.179 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -11.473 11.513 1.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -12.635 11.476 3.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -13.689 11.020 1.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -13.045 9.842 3.003 1.00 0.00 H new ATOM 643 N VAL A 40 -10.628 6.395 -2.447 1.00 0.00 N ATOM 644 CA VAL A 40 -9.933 6.023 -3.674 1.00 0.00 C ATOM 645 C VAL A 40 -8.429 6.237 -3.541 1.00 0.00 C ATOM 646 O VAL A 40 -7.981 7.251 -3.005 1.00 0.00 O ATOM 647 CB VAL A 40 -10.450 6.832 -4.879 1.00 0.00 C ATOM 648 CG1 VAL A 40 -9.964 8.271 -4.805 1.00 0.00 C ATOM 649 CG2 VAL A 40 -10.016 6.180 -6.183 1.00 0.00 C ATOM 0 H VAL A 40 -11.415 7.029 -2.583 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.133 4.965 -3.842 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.540 6.841 -4.848 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.339 8.826 -5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.330 8.732 -3.887 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -8.874 8.288 -4.810 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.390 6.764 -7.024 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.928 6.139 -6.225 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -10.419 5.169 -6.236 1.00 0.00 H new ATOM 659 N VAL A 41 -7.654 5.275 -4.031 1.00 0.00 N ATOM 660 CA VAL A 41 -6.200 5.359 -3.968 1.00 0.00 C ATOM 661 C VAL A 41 -5.587 5.331 -5.364 1.00 0.00 C ATOM 662 O VAL A 41 -4.506 5.875 -5.591 1.00 0.00 O ATOM 663 CB VAL A 41 -5.607 4.206 -3.136 1.00 0.00 C ATOM 664 CG1 VAL A 41 -5.519 2.936 -3.970 1.00 0.00 C ATOM 665 CG2 VAL A 41 -4.241 4.591 -2.591 1.00 0.00 C ATOM 0 H VAL A 41 -8.009 4.428 -4.476 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.958 6.307 -3.487 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.268 4.012 -2.292 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.098 2.132 -3.366 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.516 2.652 -4.307 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.880 3.112 -4.835 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.837 3.765 -2.006 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.568 4.812 -3.419 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.338 5.472 -1.957 1.00 0.00 H new ATOM 675 N LYS A 42 -6.285 4.693 -6.298 1.00 0.00 N ATOM 676 CA LYS A 42 -5.812 4.595 -7.674 1.00 0.00 C ATOM 677 C LYS A 42 -6.878 3.978 -8.573 1.00 0.00 C ATOM 678 O LYS A 42 -7.763 3.264 -8.103 1.00 0.00 O ATOM 679 CB LYS A 42 -4.531 3.759 -7.736 1.00 0.00 C ATOM 680 CG LYS A 42 -3.573 4.196 -8.830 1.00 0.00 C ATOM 681 CD LYS A 42 -2.616 3.079 -9.212 1.00 0.00 C ATOM 682 CE LYS A 42 -1.537 2.885 -8.158 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.190 3.269 -8.666 1.00 0.00 N ATOM 0 H LYS A 42 -7.181 4.236 -6.127 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.599 5.602 -8.031 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.022 3.817 -6.774 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.796 2.714 -7.893 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.139 4.507 -9.708 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.005 5.063 -8.493 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.172 2.150 -9.340 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.152 3.308 -10.171 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.777 3.482 -7.278 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.522 1.842 -7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.518 3.122 -7.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.050 2.682 -9.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.197 4.271 -8.945 1.00 0.00 H new ATOM 697 N ASN A 43 -6.786 4.258 -9.869 1.00 0.00 N ATOM 698 CA ASN A 43 -7.743 3.729 -10.835 1.00 0.00 C ATOM 699 C ASN A 43 -7.028 2.983 -11.957 1.00 0.00 C ATOM 700 O ASN A 43 -6.031 3.462 -12.497 1.00 0.00 O ATOM 701 CB ASN A 43 -8.589 4.863 -11.419 1.00 0.00 C ATOM 702 CG ASN A 43 -7.741 5.960 -12.032 1.00 0.00 C ATOM 703 OD1 ASN A 43 -7.211 5.808 -13.133 1.00 0.00 O ATOM 704 ND2 ASN A 43 -7.608 7.073 -11.319 1.00 0.00 N ATOM 0 H ASN A 43 -6.059 4.848 -10.275 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.396 3.028 -10.316 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.259 4.459 -12.178 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.215 5.287 -10.634 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.048 7.846 -11.680 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -8.066 7.155 -10.411 1.00 0.00 H new ATOM 711 N TRP A 44 -7.545 1.809 -12.301 1.00 0.00 N ATOM 712 CA TRP A 44 -6.956 0.996 -13.360 1.00 0.00 C ATOM 713 C TRP A 44 -7.842 0.993 -14.601 1.00 0.00 C ATOM 714 O TRP A 44 -9.047 1.228 -14.515 1.00 0.00 O ATOM 715 CB TRP A 44 -6.738 -0.436 -12.870 1.00 0.00 C ATOM 716 CG TRP A 44 -5.531 -0.588 -11.994 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.462 -0.367 -10.648 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.220 -0.991 -12.405 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.187 -0.609 -10.197 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.406 -0.994 -11.255 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.655 -1.352 -13.631 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -2.059 -1.342 -11.298 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.317 -1.697 -13.671 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.532 -1.691 -12.511 1.00 0.00 C ATOM 0 H TRP A 44 -8.370 1.399 -11.863 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.993 1.432 -13.626 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.621 -0.762 -12.320 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.638 -1.096 -13.732 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.288 -0.049 -10.029 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -3.873 -0.517 -9.231 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.253 -1.361 -14.531 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.451 -1.337 -10.405 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.869 -1.976 -14.613 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.490 -1.967 -12.576 1.00 0.00 H new ATOM 735 N VAL A 45 -7.237 0.726 -15.754 1.00 0.00 N ATOM 736 CA VAL A 45 -7.972 0.691 -17.012 1.00 0.00 C ATOM 737 C VAL A 45 -7.662 -0.580 -17.795 1.00 0.00 C ATOM 738 O VAL A 45 -6.499 -0.935 -17.986 1.00 0.00 O ATOM 739 CB VAL A 45 -7.643 1.914 -17.889 1.00 0.00 C ATOM 740 CG1 VAL A 45 -8.248 1.756 -19.275 1.00 0.00 C ATOM 741 CG2 VAL A 45 -8.134 3.192 -17.226 1.00 0.00 C ATOM 0 H VAL A 45 -6.240 0.531 -15.843 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.032 0.709 -16.759 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.560 1.981 -17.997 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -8.005 2.630 -19.880 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -7.843 0.862 -19.749 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.331 1.663 -19.191 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.893 4.046 -17.859 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -9.214 3.137 -17.085 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.647 3.310 -16.258 1.00 0.00 H new ATOM 751 N MET A 46 -8.710 -1.261 -18.247 1.00 0.00 N ATOM 752 CA MET A 46 -8.549 -2.492 -19.011 1.00 0.00 C ATOM 753 C MET A 46 -8.659 -2.221 -20.508 1.00 0.00 C ATOM 754 O MET A 46 -9.637 -1.635 -20.972 1.00 0.00 O ATOM 755 CB MET A 46 -9.599 -3.521 -18.589 1.00 0.00 C ATOM 756 CG MET A 46 -9.721 -4.694 -19.548 1.00 0.00 C ATOM 757 SD MET A 46 -10.587 -6.099 -18.821 1.00 0.00 S ATOM 758 CE MET A 46 -12.282 -5.710 -19.249 1.00 0.00 C ATOM 0 H MET A 46 -9.679 -0.981 -18.097 1.00 0.00 H new ATOM 0 HA MET A 46 -7.556 -2.891 -18.804 1.00 0.00 H new ATOM 0 HB2 MET A 46 -9.348 -3.898 -17.597 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.567 -3.027 -18.507 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.249 -4.371 -20.445 1.00 0.00 H new ATOM 0 HG3 MET A 46 -8.725 -5.008 -19.860 1.00 0.00 H new ATOM 0 HE1 MET A 46 -12.938 -5.987 -18.424 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.373 -4.641 -19.441 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.568 -6.265 -20.143 1.00 0.00 H new ATOM 768 N ASP A 47 -7.650 -2.650 -21.258 1.00 0.00 N ATOM 769 CA ASP A 47 -7.634 -2.454 -22.703 1.00 0.00 C ATOM 770 C ASP A 47 -8.817 -3.159 -23.360 1.00 0.00 C ATOM 771 O ASP A 47 -9.783 -3.528 -22.692 1.00 0.00 O ATOM 772 CB ASP A 47 -6.323 -2.973 -23.295 1.00 0.00 C ATOM 773 CG ASP A 47 -5.802 -2.088 -24.411 1.00 0.00 C ATOM 774 OD1 ASP A 47 -6.290 -2.223 -25.552 1.00 0.00 O ATOM 775 OD2 ASP A 47 -4.905 -1.261 -24.143 1.00 0.00 O ATOM 0 H ASP A 47 -6.832 -3.136 -20.889 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.715 -1.385 -22.901 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.573 -3.039 -22.507 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.474 -3.983 -23.676 1.00 0.00 H new ATOM 780 N LEU A 48 -8.734 -3.343 -24.673 1.00 0.00 N ATOM 781 CA LEU A 48 -9.798 -4.003 -25.422 1.00 0.00 C ATOM 782 C LEU A 48 -9.260 -4.609 -26.714 1.00 0.00 C ATOM 783 O LEU A 48 -9.519 -5.772 -27.023 1.00 0.00 O ATOM 784 CB LEU A 48 -10.918 -3.010 -25.738 1.00 0.00 C ATOM 785 CG LEU A 48 -12.315 -3.607 -25.913 1.00 0.00 C ATOM 786 CD1 LEU A 48 -13.299 -2.539 -26.363 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.283 -4.758 -26.908 1.00 0.00 C ATOM 0 H LEU A 48 -7.941 -3.045 -25.241 1.00 0.00 H new ATOM 0 HA LEU A 48 -10.198 -4.807 -24.805 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.958 -2.271 -24.937 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.656 -2.476 -26.651 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.646 -3.995 -24.950 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.288 -2.982 -26.482 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.344 -1.747 -25.615 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.972 -2.121 -27.315 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.286 -5.170 -27.020 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.930 -4.395 -27.873 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -11.610 -5.534 -26.545 1.00 0.00 H new ATOM 799 N LYS A 49 -8.508 -3.812 -27.466 1.00 0.00 N ATOM 800 CA LYS A 49 -7.929 -4.269 -28.724 1.00 0.00 C ATOM 801 C LYS A 49 -6.767 -5.225 -28.473 1.00 0.00 C ATOM 802 O LYS A 49 -6.478 -6.094 -29.294 1.00 0.00 O ATOM 803 CB LYS A 49 -7.451 -3.075 -29.553 1.00 0.00 C ATOM 804 CG LYS A 49 -6.526 -3.458 -30.695 1.00 0.00 C ATOM 805 CD LYS A 49 -6.460 -2.367 -31.750 1.00 0.00 C ATOM 806 CE LYS A 49 -5.385 -2.657 -32.786 1.00 0.00 C ATOM 807 NZ LYS A 49 -4.671 -1.420 -33.206 1.00 0.00 N ATOM 0 H LYS A 49 -8.285 -2.846 -27.226 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.702 -4.802 -29.278 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.319 -2.554 -29.958 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -6.935 -2.373 -28.899 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -5.526 -3.650 -30.306 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.874 -4.385 -31.151 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.428 -2.278 -32.244 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -6.257 -1.409 -31.272 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -4.668 -3.369 -32.376 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -5.839 -3.128 -33.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.947 -1.660 -33.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.351 -0.751 -33.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.216 -0.984 -32.379 1.00 0.00 H new ATOM 821 N ASN A 50 -6.106 -5.058 -27.332 1.00 0.00 N ATOM 822 CA ASN A 50 -4.975 -5.907 -26.973 1.00 0.00 C ATOM 823 C ASN A 50 -5.381 -6.938 -25.925 1.00 0.00 C ATOM 824 O ASN A 50 -4.769 -8.000 -25.813 1.00 0.00 O ATOM 825 CB ASN A 50 -3.818 -5.055 -26.446 1.00 0.00 C ATOM 826 CG ASN A 50 -2.978 -4.468 -27.563 1.00 0.00 C ATOM 827 OD1 ASN A 50 -3.460 -3.664 -28.361 1.00 0.00 O ATOM 828 ND2 ASN A 50 -1.713 -4.868 -27.625 1.00 0.00 N ATOM 0 H ASN A 50 -6.334 -4.343 -26.641 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.649 -6.435 -27.869 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.216 -4.248 -25.831 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.185 -5.665 -25.801 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -1.099 -4.507 -28.355 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -1.355 -5.536 -26.942 1.00 0.00 H new ATOM 835 N VAL A 51 -6.419 -6.617 -25.158 1.00 0.00 N ATOM 836 CA VAL A 51 -6.909 -7.516 -24.120 1.00 0.00 C ATOM 837 C VAL A 51 -5.899 -7.646 -22.985 1.00 0.00 C ATOM 838 O VAL A 51 -5.535 -8.753 -22.587 1.00 0.00 O ATOM 839 CB VAL A 51 -7.212 -8.916 -24.686 1.00 0.00 C ATOM 840 CG1 VAL A 51 -8.045 -9.722 -23.701 1.00 0.00 C ATOM 841 CG2 VAL A 51 -7.917 -8.806 -26.029 1.00 0.00 C ATOM 0 H VAL A 51 -6.936 -5.741 -25.236 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.831 -7.082 -23.734 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.268 -9.439 -24.839 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.249 -10.708 -24.118 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.497 -9.830 -22.765 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.986 -9.206 -23.513 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.123 -9.804 -26.414 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.854 -8.264 -25.904 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -7.279 -8.271 -26.732 1.00 0.00 H new ATOM 851 N LYS A 52 -5.450 -6.508 -22.466 1.00 0.00 N ATOM 852 CA LYS A 52 -4.484 -6.493 -21.375 1.00 0.00 C ATOM 853 C LYS A 52 -4.824 -5.406 -20.361 1.00 0.00 C ATOM 854 O LYS A 52 -5.456 -4.404 -20.699 1.00 0.00 O ATOM 855 CB LYS A 52 -3.071 -6.272 -21.920 1.00 0.00 C ATOM 856 CG LYS A 52 -2.907 -4.961 -22.670 1.00 0.00 C ATOM 857 CD LYS A 52 -1.502 -4.403 -22.516 1.00 0.00 C ATOM 858 CE LYS A 52 -0.586 -4.882 -23.631 1.00 0.00 C ATOM 859 NZ LYS A 52 0.413 -3.846 -24.013 1.00 0.00 N ATOM 0 H LYS A 52 -5.740 -5.583 -22.784 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.527 -7.460 -20.873 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.363 -6.298 -21.092 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.814 -7.096 -22.585 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -3.124 -5.116 -23.727 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -3.631 -4.235 -22.299 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.540 -3.314 -22.518 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.093 -4.706 -21.552 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.067 -5.786 -23.312 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.184 -5.149 -24.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.018 -4.212 -24.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.081 -2.992 -24.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.001 -3.610 -23.188 1.00 0.00 H new ATOM 873 N LEU A 53 -4.401 -5.608 -19.118 1.00 0.00 N ATOM 874 CA LEU A 53 -4.660 -4.644 -18.055 1.00 0.00 C ATOM 875 C LEU A 53 -3.442 -3.758 -17.814 1.00 0.00 C ATOM 876 O LEU A 53 -2.314 -4.245 -17.732 1.00 0.00 O ATOM 877 CB LEU A 53 -5.041 -5.369 -16.763 1.00 0.00 C ATOM 878 CG LEU A 53 -6.496 -5.224 -16.316 1.00 0.00 C ATOM 879 CD1 LEU A 53 -7.439 -5.740 -17.391 1.00 0.00 C ATOM 880 CD2 LEU A 53 -6.726 -5.959 -15.004 1.00 0.00 C ATOM 0 H LEU A 53 -3.877 -6.431 -18.822 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.490 -4.011 -18.368 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.824 -6.430 -16.888 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.398 -5.004 -15.962 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.704 -4.166 -16.158 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.470 -5.629 -17.055 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.293 -5.169 -18.308 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.232 -6.793 -17.582 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.767 -5.845 -14.701 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.500 -7.017 -15.135 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.076 -5.542 -14.235 1.00 0.00 H new ATOM 892 N VAL A 54 -3.677 -2.455 -17.700 1.00 0.00 N ATOM 893 CA VAL A 54 -2.600 -1.501 -17.465 1.00 0.00 C ATOM 894 C VAL A 54 -3.078 -0.330 -16.615 1.00 0.00 C ATOM 895 O VAL A 54 -4.270 -0.024 -16.576 1.00 0.00 O ATOM 896 CB VAL A 54 -2.030 -0.961 -18.790 1.00 0.00 C ATOM 897 CG1 VAL A 54 -1.291 -2.058 -19.541 1.00 0.00 C ATOM 898 CG2 VAL A 54 -3.140 -0.372 -19.646 1.00 0.00 C ATOM 0 H VAL A 54 -4.604 -2.036 -17.767 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.814 -2.036 -16.931 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.318 -0.168 -18.562 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.896 -1.657 -20.474 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.469 -2.428 -18.928 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.978 -2.876 -19.759 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.719 0.005 -20.578 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.878 -1.143 -19.866 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.620 0.446 -19.108 1.00 0.00 H new ATOM 908 N GLU A 55 -2.141 0.323 -15.935 1.00 0.00 N ATOM 909 CA GLU A 55 -2.467 1.462 -15.085 1.00 0.00 C ATOM 910 C GLU A 55 -2.581 2.741 -15.909 1.00 0.00 C ATOM 911 O GLU A 55 -1.575 3.336 -16.294 1.00 0.00 O ATOM 912 CB GLU A 55 -1.406 1.636 -13.997 1.00 0.00 C ATOM 913 CG GLU A 55 0.018 1.617 -14.527 1.00 0.00 C ATOM 914 CD GLU A 55 0.859 2.754 -13.980 1.00 0.00 C ATOM 915 OE1 GLU A 55 0.535 3.924 -14.271 1.00 0.00 O ATOM 916 OE2 GLU A 55 1.841 2.473 -13.262 1.00 0.00 O ATOM 0 H GLU A 55 -1.150 0.083 -15.956 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.430 1.267 -14.614 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.580 2.580 -13.480 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.521 0.842 -13.259 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.485 0.667 -14.268 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.002 1.676 -15.615 1.00 0.00 H new ATOM 923 N SER A 56 -3.815 3.158 -16.177 1.00 0.00 N ATOM 924 CA SER A 56 -4.061 4.364 -16.959 1.00 0.00 C ATOM 925 C SER A 56 -5.322 5.076 -16.477 1.00 0.00 C ATOM 926 O SER A 56 -6.101 4.524 -15.699 1.00 0.00 O ATOM 927 CB SER A 56 -4.194 4.017 -18.443 1.00 0.00 C ATOM 928 OG SER A 56 -4.439 5.177 -19.218 1.00 0.00 O ATOM 0 H SER A 56 -4.659 2.679 -15.864 1.00 0.00 H new ATOM 0 HA SER A 56 -3.212 5.034 -16.824 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.282 3.531 -18.789 1.00 0.00 H new ATOM 0 HB3 SER A 56 -5.007 3.305 -18.582 1.00 0.00 H new ATOM 0 HG SER A 56 -4.518 4.929 -20.163 1.00 0.00 H new ATOM 934 N ASP A 57 -5.516 6.304 -16.945 1.00 0.00 N ATOM 935 CA ASP A 57 -6.682 7.092 -16.563 1.00 0.00 C ATOM 936 C ASP A 57 -7.625 7.276 -17.748 1.00 0.00 C ATOM 937 O ASP A 57 -8.541 8.097 -17.704 1.00 0.00 O ATOM 938 CB ASP A 57 -6.248 8.456 -16.025 1.00 0.00 C ATOM 939 CG ASP A 57 -7.036 8.872 -14.798 1.00 0.00 C ATOM 940 OD1 ASP A 57 -8.091 9.519 -14.962 1.00 0.00 O ATOM 941 OD2 ASP A 57 -6.597 8.550 -13.674 1.00 0.00 O ATOM 0 H ASP A 57 -4.881 6.775 -17.589 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.213 6.553 -15.779 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.187 8.425 -15.778 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.372 9.207 -16.805 1.00 0.00 H new ATOM 946 N ASP A 58 -7.394 6.507 -18.806 1.00 0.00 N ATOM 947 CA ASP A 58 -8.222 6.584 -20.004 1.00 0.00 C ATOM 948 C ASP A 58 -9.677 6.258 -19.680 1.00 0.00 C ATOM 949 O ASP A 58 -9.965 5.554 -18.713 1.00 0.00 O ATOM 950 CB ASP A 58 -7.698 5.627 -21.076 1.00 0.00 C ATOM 951 CG ASP A 58 -8.371 5.836 -22.418 1.00 0.00 C ATOM 952 OD1 ASP A 58 -9.421 5.204 -22.659 1.00 0.00 O ATOM 953 OD2 ASP A 58 -7.848 6.630 -23.227 1.00 0.00 O ATOM 0 H ASP A 58 -6.640 5.823 -18.859 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.173 7.604 -20.385 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.622 5.764 -21.187 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.856 4.599 -20.750 1.00 0.00 H new ATOM 958 N ALA A 59 -10.590 6.776 -20.495 1.00 0.00 N ATOM 959 CA ALA A 59 -12.014 6.540 -20.297 1.00 0.00 C ATOM 960 C ALA A 59 -12.376 5.089 -20.595 1.00 0.00 C ATOM 961 O ALA A 59 -11.542 4.314 -21.062 1.00 0.00 O ATOM 962 CB ALA A 59 -12.832 7.480 -21.168 1.00 0.00 C ATOM 0 H ALA A 59 -10.368 7.362 -21.299 1.00 0.00 H new ATOM 0 HA ALA A 59 -12.248 6.738 -19.251 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.894 7.292 -21.009 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -12.603 8.512 -20.904 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.586 7.311 -22.216 1.00 0.00 H new ATOM 968 N ALA A 60 -13.626 4.728 -20.323 1.00 0.00 N ATOM 969 CA ALA A 60 -14.099 3.370 -20.564 1.00 0.00 C ATOM 970 C ALA A 60 -15.617 3.333 -20.700 1.00 0.00 C ATOM 971 O ALA A 60 -16.310 4.254 -20.267 1.00 0.00 O ATOM 972 CB ALA A 60 -13.644 2.446 -19.444 1.00 0.00 C ATOM 0 H ALA A 60 -14.329 5.357 -19.936 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.668 3.023 -21.503 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -14.004 1.436 -19.637 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.555 2.440 -19.397 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.046 2.799 -18.495 1.00 0.00 H new ATOM 978 N GLU A 61 -16.127 2.265 -21.304 1.00 0.00 N ATOM 979 CA GLU A 61 -17.564 2.111 -21.497 1.00 0.00 C ATOM 980 C GLU A 61 -18.303 2.180 -20.164 1.00 0.00 C ATOM 981 O GLU A 61 -19.454 2.611 -20.102 1.00 0.00 O ATOM 982 CB GLU A 61 -17.868 0.782 -22.192 1.00 0.00 C ATOM 983 CG GLU A 61 -17.934 0.888 -23.707 1.00 0.00 C ATOM 984 CD GLU A 61 -19.358 0.914 -24.228 1.00 0.00 C ATOM 985 OE1 GLU A 61 -20.006 -0.154 -24.234 1.00 0.00 O ATOM 986 OE2 GLU A 61 -19.824 2.000 -24.631 1.00 0.00 O ATOM 0 H GLU A 61 -15.567 1.494 -21.668 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.909 2.930 -22.127 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.102 0.056 -21.920 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.818 0.397 -21.821 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.417 1.793 -24.027 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.404 0.045 -24.150 1.00 0.00 H new ATOM 993 N ALA A 62 -17.632 1.753 -19.099 1.00 0.00 N ATOM 994 CA ALA A 62 -18.223 1.768 -17.767 1.00 0.00 C ATOM 995 C ALA A 62 -17.146 1.791 -16.688 1.00 0.00 C ATOM 996 O ALA A 62 -15.989 1.454 -16.944 1.00 0.00 O ATOM 997 CB ALA A 62 -19.134 0.564 -17.581 1.00 0.00 C ATOM 0 H ALA A 62 -16.678 1.392 -19.133 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.816 2.677 -17.670 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.569 0.588 -16.582 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.931 0.592 -18.324 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.556 -0.352 -17.704 1.00 0.00 H new ATOM 1003 N THR A 63 -17.532 2.191 -15.481 1.00 0.00 N ATOM 1004 CA THR A 63 -16.598 2.259 -14.364 1.00 0.00 C ATOM 1005 C THR A 63 -17.117 1.474 -13.165 1.00 0.00 C ATOM 1006 O THR A 63 -18.255 1.661 -12.733 1.00 0.00 O ATOM 1007 CB THR A 63 -16.340 3.716 -13.936 1.00 0.00 C ATOM 1008 OG1 THR A 63 -15.765 4.451 -15.022 1.00 0.00 O ATOM 1009 CG2 THR A 63 -15.411 3.770 -12.732 1.00 0.00 C ATOM 0 H THR A 63 -18.485 2.473 -15.252 1.00 0.00 H new ATOM 0 HA THR A 63 -15.662 1.817 -14.707 1.00 0.00 H new ATOM 0 HB THR A 63 -17.294 4.165 -13.659 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.606 5.377 -14.742 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.243 4.809 -12.448 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.865 3.235 -11.898 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.458 3.305 -12.986 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.276 0.595 -12.630 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.650 -0.219 -11.479 1.00 0.00 C ATOM 1019 C LEU A 64 -15.792 0.127 -10.266 1.00 0.00 C ATOM 1020 O LEU A 64 -14.604 -0.193 -10.220 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.507 -1.705 -11.812 1.00 0.00 C ATOM 1022 CG LEU A 64 -17.688 -2.596 -11.427 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.360 -4.059 -11.687 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -18.062 -2.383 -9.967 1.00 0.00 C ATOM 0 H LEU A 64 -15.331 0.428 -12.975 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.691 -0.006 -11.237 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -16.339 -1.802 -12.885 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -15.614 -2.084 -11.314 1.00 0.00 H new ATOM 0 HG LEU A 64 -18.543 -2.321 -12.045 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -18.212 -4.678 -11.407 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -17.141 -4.200 -12.745 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.492 -4.348 -11.095 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -18.904 -3.025 -9.710 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -17.210 -2.631 -9.333 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -18.339 -1.341 -9.811 1.00 0.00 H new ATOM 1036 N THR A 65 -16.403 0.781 -9.283 1.00 0.00 N ATOM 1037 CA THR A 65 -15.696 1.169 -8.069 1.00 0.00 C ATOM 1038 C THR A 65 -15.930 0.160 -6.950 1.00 0.00 C ATOM 1039 O THR A 65 -17.071 -0.139 -6.599 1.00 0.00 O ATOM 1040 CB THR A 65 -16.135 2.564 -7.585 1.00 0.00 C ATOM 1041 OG1 THR A 65 -15.989 3.517 -8.644 1.00 0.00 O ATOM 1042 CG2 THR A 65 -15.312 3.003 -6.383 1.00 0.00 C ATOM 0 H THR A 65 -17.386 1.053 -9.304 1.00 0.00 H new ATOM 0 HA THR A 65 -14.635 1.195 -8.316 1.00 0.00 H new ATOM 0 HB THR A 65 -17.182 2.509 -7.287 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.272 4.401 -8.330 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.640 3.991 -6.059 1.00 0.00 H new ATOM 0 HG22 THR A 65 -15.448 2.290 -5.569 1.00 0.00 H new ATOM 0 HG23 THR A 65 -14.258 3.043 -6.659 1.00 0.00 H new ATOM 1050 N MET A 66 -14.841 -0.363 -6.394 1.00 0.00 N ATOM 1051 CA MET A 66 -14.929 -1.338 -5.313 1.00 0.00 C ATOM 1052 C MET A 66 -13.667 -1.314 -4.456 1.00 0.00 C ATOM 1053 O MET A 66 -12.562 -1.142 -4.969 1.00 0.00 O ATOM 1054 CB MET A 66 -15.147 -2.741 -5.880 1.00 0.00 C ATOM 1055 CG MET A 66 -16.552 -2.969 -6.416 1.00 0.00 C ATOM 1056 SD MET A 66 -16.786 -4.634 -7.066 1.00 0.00 S ATOM 1057 CE MET A 66 -15.461 -4.718 -8.268 1.00 0.00 C ATOM 0 H MET A 66 -13.889 -0.128 -6.674 1.00 0.00 H new ATOM 0 HA MET A 66 -15.779 -1.072 -4.685 1.00 0.00 H new ATOM 0 HB2 MET A 66 -14.429 -2.916 -6.681 1.00 0.00 H new ATOM 0 HB3 MET A 66 -14.941 -3.475 -5.101 1.00 0.00 H new ATOM 0 HG2 MET A 66 -17.274 -2.789 -5.619 1.00 0.00 H new ATOM 0 HG3 MET A 66 -16.759 -2.244 -7.203 1.00 0.00 H new ATOM 0 HE1 MET A 66 -15.785 -5.307 -9.126 1.00 0.00 H new ATOM 0 HE2 MET A 66 -15.202 -3.711 -8.595 1.00 0.00 H new ATOM 0 HE3 MET A 66 -14.588 -5.188 -7.815 1.00 0.00 H new ATOM 1067 N GLU A 67 -13.841 -1.486 -3.149 1.00 0.00 N ATOM 1068 CA GLU A 67 -12.715 -1.483 -2.223 1.00 0.00 C ATOM 1069 C GLU A 67 -11.773 -2.650 -2.506 1.00 0.00 C ATOM 1070 O GLU A 67 -12.183 -3.673 -3.055 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.215 -1.556 -0.778 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.836 -0.261 -0.283 1.00 0.00 C ATOM 1073 CD GLU A 67 -15.258 -0.447 0.209 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -15.520 -1.455 0.898 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -16.109 0.415 -0.095 1.00 0.00 O ATOM 0 H GLU A 67 -14.750 -1.629 -2.708 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.165 -0.553 -2.364 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -13.951 -2.356 -0.697 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.382 -1.822 -0.127 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -13.226 0.145 0.524 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -13.827 0.473 -1.089 1.00 0.00 H new ATOM 1082 N ASP A 68 -10.510 -2.487 -2.129 1.00 0.00 N ATOM 1083 CA ASP A 68 -9.509 -3.526 -2.342 1.00 0.00 C ATOM 1084 C ASP A 68 -10.029 -4.884 -1.882 1.00 0.00 C ATOM 1085 O ASP A 68 -9.953 -5.870 -2.615 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.218 -3.181 -1.598 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.079 -4.117 -1.949 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -7.297 -5.037 -2.766 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -5.969 -3.929 -1.409 1.00 0.00 O ATOM 0 H ASP A 68 -10.155 -1.646 -1.675 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.299 -3.580 -3.410 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.929 -2.157 -1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.399 -3.221 -0.524 1.00 0.00 H new ATOM 1094 N ASP A 69 -10.556 -4.928 -0.663 1.00 0.00 N ATOM 1095 CA ASP A 69 -11.089 -6.165 -0.104 1.00 0.00 C ATOM 1096 C ASP A 69 -12.323 -6.623 -0.876 1.00 0.00 C ATOM 1097 O ASP A 69 -12.592 -7.820 -0.981 1.00 0.00 O ATOM 1098 CB ASP A 69 -11.438 -5.974 1.373 1.00 0.00 C ATOM 1099 CG ASP A 69 -10.251 -6.220 2.284 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -9.887 -7.398 2.478 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -9.688 -5.234 2.804 1.00 0.00 O ATOM 0 H ASP A 69 -10.625 -4.121 -0.043 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.322 -6.934 -0.191 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.808 -4.960 1.528 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.247 -6.653 1.643 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.068 -5.663 -1.413 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.273 -5.968 -2.174 1.00 0.00 C ATOM 1108 C ILE A 70 -13.928 -6.589 -3.524 1.00 0.00 C ATOM 1109 O ILE A 70 -14.437 -7.652 -3.878 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.127 -4.708 -2.405 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.471 -4.046 -1.069 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.395 -5.060 -3.169 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -16.660 -4.670 -0.373 1.00 0.00 C ATOM 0 H ILE A 70 -12.858 -4.668 -1.335 1.00 0.00 H new ATOM 0 HA ILE A 70 -14.847 -6.682 -1.584 1.00 0.00 H new ATOM 0 HB ILE A 70 -14.550 -4.001 -3.002 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.604 -4.103 -0.411 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -15.673 -2.988 -1.238 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.988 -4.159 -3.324 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.130 -5.491 -4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -16.976 -5.783 -2.596 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.845 -4.150 0.567 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.539 -4.589 -1.012 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.453 -5.721 -0.172 1.00 0.00 H new ATOM 1125 N MET A 71 -13.058 -5.918 -4.272 1.00 0.00 N ATOM 1126 CA MET A 71 -12.642 -6.406 -5.582 1.00 0.00 C ATOM 1127 C MET A 71 -12.141 -7.844 -5.493 1.00 0.00 C ATOM 1128 O MET A 71 -12.297 -8.626 -6.431 1.00 0.00 O ATOM 1129 CB MET A 71 -11.548 -5.507 -6.161 1.00 0.00 C ATOM 1130 CG MET A 71 -11.177 -5.847 -7.595 1.00 0.00 C ATOM 1131 SD MET A 71 -12.084 -4.859 -8.800 1.00 0.00 S ATOM 1132 CE MET A 71 -11.392 -3.235 -8.495 1.00 0.00 C ATOM 0 H MET A 71 -12.628 -5.036 -3.994 1.00 0.00 H new ATOM 0 HA MET A 71 -13.509 -6.383 -6.243 1.00 0.00 H new ATOM 0 HB2 MET A 71 -11.880 -4.470 -6.117 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.658 -5.584 -5.536 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.107 -5.693 -7.736 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.373 -6.904 -7.776 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.828 -2.517 -9.190 1.00 0.00 H new ATOM 0 HE2 MET A 71 -11.614 -2.931 -7.472 1.00 0.00 H new ATOM 0 HE3 MET A 71 -10.312 -3.267 -8.637 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.538 -8.186 -4.359 1.00 0.00 N ATOM 1143 CA PHE A 72 -11.012 -9.530 -4.149 1.00 0.00 C ATOM 1144 C PHE A 72 -12.141 -10.556 -4.116 1.00 0.00 C ATOM 1145 O PHE A 72 -12.009 -11.656 -4.652 1.00 0.00 O ATOM 1146 CB PHE A 72 -10.215 -9.590 -2.844 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.062 -10.551 -2.889 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.955 -10.289 -3.680 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -9.085 -11.717 -2.141 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.893 -11.172 -3.724 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -8.026 -12.604 -2.180 1.00 0.00 C ATOM 1152 CZ PHE A 72 -6.928 -12.331 -2.973 1.00 0.00 C ATOM 0 H PHE A 72 -11.402 -7.552 -3.572 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.351 -9.769 -4.982 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.838 -8.594 -2.612 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.884 -9.875 -2.032 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.922 -9.384 -4.269 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.941 -11.935 -1.520 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.036 -10.956 -4.345 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.057 -13.509 -1.592 1.00 0.00 H new ATOM 0 HZ PHE A 72 -6.099 -13.022 -3.006 1.00 0.00 H new ATOM 1162 N ALA A 73 -13.250 -10.188 -3.483 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.402 -11.075 -3.382 1.00 0.00 C ATOM 1164 C ALA A 73 -14.994 -11.365 -4.756 1.00 0.00 C ATOM 1165 O ALA A 73 -15.175 -12.524 -5.132 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.456 -10.468 -2.468 1.00 0.00 C ATOM 0 H ALA A 73 -13.375 -9.281 -3.032 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.066 -12.020 -2.954 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -16.311 -11.141 -2.401 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.034 -10.319 -1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.780 -9.509 -2.872 1.00 0.00 H new ATOM 1172 N ILE A 74 -15.294 -10.307 -5.502 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.866 -10.450 -6.835 1.00 0.00 C ATOM 1174 C ILE A 74 -14.844 -11.020 -7.813 1.00 0.00 C ATOM 1175 O ILE A 74 -15.201 -11.519 -8.879 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.379 -9.102 -7.375 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -17.442 -8.524 -6.438 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -16.940 -9.272 -8.779 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -16.881 -7.580 -5.397 1.00 0.00 C ATOM 0 H ILE A 74 -15.150 -9.342 -5.206 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.705 -11.140 -6.746 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.543 -8.404 -7.421 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -18.189 -7.996 -7.031 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -17.955 -9.343 -5.935 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -17.298 -8.310 -9.146 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -16.158 -9.645 -9.441 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -17.766 -9.983 -8.757 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -17.690 -7.209 -4.768 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -16.155 -8.109 -4.779 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -16.392 -6.741 -5.892 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.570 -10.944 -7.441 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.515 -11.458 -8.295 1.00 0.00 C ATOM 1193 C GLY A 75 -12.254 -12.934 -8.070 1.00 0.00 C ATOM 1194 O GLY A 75 -11.915 -13.662 -9.003 1.00 0.00 O ATOM 0 H GLY A 75 -13.249 -10.535 -6.563 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.785 -11.295 -9.338 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.598 -10.898 -8.111 1.00 0.00 H new ATOM 1198 N THR A 76 -12.410 -13.378 -6.827 1.00 0.00 N ATOM 1199 CA THR A 76 -12.187 -14.776 -6.480 1.00 0.00 C ATOM 1200 C THR A 76 -13.499 -15.549 -6.441 1.00 0.00 C ATOM 1201 O THR A 76 -13.615 -16.560 -5.750 1.00 0.00 O ATOM 1202 CB THR A 76 -11.483 -14.911 -5.117 1.00 0.00 C ATOM 1203 OG1 THR A 76 -11.107 -16.274 -4.893 1.00 0.00 O ATOM 1204 CG2 THR A 76 -12.390 -14.438 -3.991 1.00 0.00 C ATOM 0 H THR A 76 -12.690 -12.789 -6.043 1.00 0.00 H new ATOM 0 HA THR A 76 -11.545 -15.195 -7.255 1.00 0.00 H new ATOM 0 HB THR A 76 -10.590 -14.286 -5.130 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.854 -16.863 -5.130 1.00 0.00 H new ATOM 0 HG21 THR A 76 -11.872 -14.543 -3.038 1.00 0.00 H new ATOM 0 HG22 THR A 76 -12.651 -13.392 -4.149 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.298 -15.040 -3.978 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.488 -15.067 -7.189 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.780 -15.727 -7.225 1.00 0.00 C ATOM 1214 C GLY A 77 -16.370 -15.923 -5.843 1.00 0.00 C ATOM 1215 O GLY A 77 -17.208 -16.801 -5.637 1.00 0.00 O ATOM 0 H GLY A 77 -14.417 -14.232 -7.770 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.469 -15.138 -7.830 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.676 -16.696 -7.713 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.932 -15.103 -4.893 1.00 0.00 N ATOM 1220 CA ALA A 78 -16.423 -15.190 -3.523 1.00 0.00 C ATOM 1221 C ALA A 78 -17.845 -14.651 -3.414 1.00 0.00 C ATOM 1222 O ALA A 78 -18.805 -15.418 -3.319 1.00 0.00 O ATOM 1223 CB ALA A 78 -15.497 -14.434 -2.582 1.00 0.00 C ATOM 0 H ALA A 78 -15.238 -14.371 -5.047 1.00 0.00 H new ATOM 0 HA ALA A 78 -16.438 -16.241 -3.235 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.876 -14.507 -1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.498 -14.866 -2.630 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.454 -13.386 -2.878 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.974 -13.329 -3.428 1.00 0.00 N ATOM 1230 CA LEU A 79 -19.281 -12.687 -3.330 1.00 0.00 C ATOM 1231 C LEU A 79 -19.731 -12.158 -4.688 1.00 0.00 C ATOM 1232 O LEU A 79 -18.931 -11.670 -5.487 1.00 0.00 O ATOM 1233 CB LEU A 79 -19.234 -11.544 -2.314 1.00 0.00 C ATOM 1234 CG LEU A 79 -19.567 -11.917 -0.869 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -19.193 -10.783 0.073 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -21.042 -12.262 -0.733 1.00 0.00 C ATOM 0 H LEU A 79 -17.190 -12.681 -3.506 1.00 0.00 H new ATOM 0 HA LEU A 79 -20.001 -13.433 -2.995 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -18.236 -11.107 -2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.928 -10.768 -2.637 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.983 -12.796 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -19.437 -11.065 1.097 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -18.124 -10.584 -0.004 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -19.750 -9.886 -0.198 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -21.260 -12.525 0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.645 -11.402 -1.024 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -21.279 -13.107 -1.380 1.00 0.00 H new ATOM 1248 N PRO A 80 -21.041 -12.255 -4.956 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.628 -11.789 -6.216 1.00 0.00 C ATOM 1250 C PRO A 80 -21.615 -10.268 -6.334 1.00 0.00 C ATOM 1251 O PRO A 80 -22.039 -9.562 -5.420 1.00 0.00 O ATOM 1252 CB PRO A 80 -23.066 -12.308 -6.152 1.00 0.00 C ATOM 1253 CG PRO A 80 -23.355 -12.444 -4.697 1.00 0.00 C ATOM 1254 CD PRO A 80 -22.052 -12.825 -4.050 1.00 0.00 C ATOM 0 HA PRO A 80 -21.070 -12.146 -7.082 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.759 -11.615 -6.630 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -23.165 -13.264 -6.666 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.736 -11.509 -4.286 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -24.116 -13.204 -4.520 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.968 -12.414 -3.044 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.948 -13.906 -3.962 1.00 0.00 H new ATOM 1262 N ALA A 81 -21.127 -9.771 -7.466 1.00 0.00 N ATOM 1263 CA ALA A 81 -21.062 -8.335 -7.704 1.00 0.00 C ATOM 1264 C ALA A 81 -22.452 -7.708 -7.661 1.00 0.00 C ATOM 1265 O ALA A 81 -22.600 -6.521 -7.369 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.394 -8.051 -9.041 1.00 0.00 C ATOM 0 H ALA A 81 -20.771 -10.342 -8.232 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.465 -7.887 -6.910 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.352 -6.974 -9.206 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.382 -8.457 -9.036 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.968 -8.518 -9.841 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.468 -8.512 -7.954 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.847 -8.037 -7.949 1.00 0.00 C ATOM 1274 C LYS A 82 -25.291 -7.672 -6.536 1.00 0.00 C ATOM 1275 O LYS A 82 -25.711 -6.544 -6.280 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.778 -9.104 -8.528 1.00 0.00 C ATOM 1277 CG LYS A 82 -27.229 -8.665 -8.613 1.00 0.00 C ATOM 1278 CD LYS A 82 -28.130 -9.799 -9.072 1.00 0.00 C ATOM 1279 CE LYS A 82 -29.524 -9.299 -9.418 1.00 0.00 C ATOM 1280 NZ LYS A 82 -30.562 -10.339 -9.180 1.00 0.00 N ATOM 0 H LYS A 82 -23.363 -9.497 -8.198 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.899 -7.143 -8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.430 -9.375 -9.525 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -25.714 -10.002 -7.913 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -27.560 -8.309 -7.637 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -27.316 -7.827 -9.305 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -27.690 -10.285 -9.943 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -28.197 -10.552 -8.287 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -29.751 -8.416 -8.821 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -29.550 -8.992 -10.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -31.498 -9.959 -9.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -30.360 -11.172 -9.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -30.555 -10.614 -8.177 1.00 0.00 H new ATOM 1294 N GLU A 83 -25.193 -8.633 -5.623 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.585 -8.411 -4.236 1.00 0.00 C ATOM 1296 C GLU A 83 -24.818 -7.236 -3.636 1.00 0.00 C ATOM 1297 O GLU A 83 -25.410 -6.327 -3.055 1.00 0.00 O ATOM 1298 CB GLU A 83 -25.340 -9.673 -3.405 1.00 0.00 C ATOM 1299 CG GLU A 83 -26.124 -10.881 -3.888 1.00 0.00 C ATOM 1300 CD GLU A 83 -27.608 -10.766 -3.600 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.988 -10.833 -2.412 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -28.390 -10.610 -4.561 1.00 0.00 O ATOM 0 H GLU A 83 -24.846 -9.572 -5.818 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.649 -8.175 -4.219 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -24.276 -9.910 -3.424 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -25.603 -9.471 -2.367 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.974 -11.001 -4.961 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -25.733 -11.779 -3.409 1.00 0.00 H new ATOM 1309 N ALA A 84 -23.497 -7.264 -3.780 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.649 -6.202 -3.254 1.00 0.00 C ATOM 1311 C ALA A 84 -23.159 -4.829 -3.682 1.00 0.00 C ATOM 1312 O ALA A 84 -23.128 -3.876 -2.905 1.00 0.00 O ATOM 1313 CB ALA A 84 -21.211 -6.399 -3.711 1.00 0.00 C ATOM 0 H ALA A 84 -22.991 -8.011 -4.257 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.682 -6.250 -2.166 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -20.589 -5.598 -3.311 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.843 -7.359 -3.350 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -21.170 -6.380 -4.800 1.00 0.00 H new ATOM 1319 N MET A 85 -23.626 -4.737 -4.922 1.00 0.00 N ATOM 1320 CA MET A 85 -24.143 -3.481 -5.453 1.00 0.00 C ATOM 1321 C MET A 85 -25.437 -3.085 -4.748 1.00 0.00 C ATOM 1322 O MET A 85 -25.707 -1.902 -4.546 1.00 0.00 O ATOM 1323 CB MET A 85 -24.384 -3.599 -6.959 1.00 0.00 C ATOM 1324 CG MET A 85 -23.673 -2.531 -7.773 1.00 0.00 C ATOM 1325 SD MET A 85 -24.555 -2.111 -9.289 1.00 0.00 S ATOM 1326 CE MET A 85 -25.899 -1.124 -8.636 1.00 0.00 C ATOM 0 H MET A 85 -23.657 -5.517 -5.578 1.00 0.00 H new ATOM 0 HA MET A 85 -23.399 -2.705 -5.272 1.00 0.00 H new ATOM 0 HB2 MET A 85 -24.053 -4.581 -7.296 1.00 0.00 H new ATOM 0 HB3 MET A 85 -25.455 -3.539 -7.153 1.00 0.00 H new ATOM 0 HG2 MET A 85 -23.556 -1.634 -7.165 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.671 -2.878 -8.025 1.00 0.00 H new ATOM 0 HE1 MET A 85 -26.375 -0.574 -9.448 1.00 0.00 H new ATOM 0 HE2 MET A 85 -26.632 -1.776 -8.161 1.00 0.00 H new ATOM 0 HE3 MET A 85 -25.510 -0.420 -7.901 1.00 0.00 H new ATOM 1336 N ALA A 86 -26.233 -4.083 -4.378 1.00 0.00 N ATOM 1337 CA ALA A 86 -27.498 -3.838 -3.695 1.00 0.00 C ATOM 1338 C ALA A 86 -27.268 -3.429 -2.244 1.00 0.00 C ATOM 1339 O ALA A 86 -28.116 -2.782 -1.631 1.00 0.00 O ATOM 1340 CB ALA A 86 -28.382 -5.074 -3.763 1.00 0.00 C ATOM 0 H ALA A 86 -26.025 -5.068 -4.540 1.00 0.00 H new ATOM 0 HA ALA A 86 -28.003 -3.015 -4.201 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -29.323 -4.877 -3.249 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -28.583 -5.321 -4.806 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.875 -5.911 -3.283 1.00 0.00 H new ATOM 1346 N GLN A 87 -26.115 -3.810 -1.702 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.776 -3.483 -0.322 1.00 0.00 C ATOM 1348 C GLN A 87 -25.078 -2.129 -0.240 1.00 0.00 C ATOM 1349 O GLN A 87 -24.543 -1.759 0.805 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.880 -4.569 0.276 1.00 0.00 C ATOM 1351 CG GLN A 87 -25.525 -5.946 0.297 1.00 0.00 C ATOM 1352 CD GLN A 87 -25.259 -6.695 1.588 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -25.323 -6.122 2.676 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.959 -7.983 1.473 1.00 0.00 N ATOM 0 H GLN A 87 -25.401 -4.345 -2.197 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.702 -3.430 0.251 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.953 -4.620 -0.296 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -24.611 -4.287 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -26.601 -5.841 0.157 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -25.150 -6.532 -0.542 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -24.917 -8.417 0.551 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -24.770 -8.539 2.307 1.00 0.00 H new ATOM 1363 N ASP A 88 -25.087 -1.396 -1.347 1.00 0.00 N ATOM 1364 CA ASP A 88 -24.456 -0.082 -1.400 1.00 0.00 C ATOM 1365 C ASP A 88 -22.961 -0.186 -1.113 1.00 0.00 C ATOM 1366 O ASP A 88 -22.307 0.809 -0.799 1.00 0.00 O ATOM 1367 CB ASP A 88 -25.116 0.865 -0.397 1.00 0.00 C ATOM 1368 CG ASP A 88 -26.619 0.684 -0.332 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -27.283 0.851 -1.376 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -27.132 0.373 0.764 1.00 0.00 O ATOM 0 H ASP A 88 -25.524 -1.689 -2.221 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.588 0.317 -2.406 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -24.690 0.696 0.592 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.889 1.895 -0.671 1.00 0.00 H new ATOM 1375 N LYS A 89 -22.426 -1.397 -1.222 1.00 0.00 N ATOM 1376 CA LYS A 89 -21.008 -1.633 -0.975 1.00 0.00 C ATOM 1377 C LYS A 89 -20.198 -1.474 -2.258 1.00 0.00 C ATOM 1378 O LYS A 89 -18.980 -1.647 -2.259 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.796 -3.033 -0.396 1.00 0.00 C ATOM 1380 CG LYS A 89 -21.508 -3.259 0.927 1.00 0.00 C ATOM 1381 CD LYS A 89 -20.542 -3.706 2.011 1.00 0.00 C ATOM 1382 CE LYS A 89 -21.036 -3.313 3.395 1.00 0.00 C ATOM 1383 NZ LYS A 89 -20.213 -3.928 4.473 1.00 0.00 N ATOM 0 H LYS A 89 -22.953 -2.231 -1.480 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.663 -0.892 -0.254 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -21.145 -3.772 -1.117 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.728 -3.202 -0.258 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -22.003 -2.339 1.237 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.286 -4.012 0.799 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -20.414 -4.787 1.963 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.563 -3.261 1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.012 -2.228 3.494 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -22.075 -3.621 3.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -20.582 -3.636 5.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -20.256 -4.964 4.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -19.226 -3.614 4.378 1.00 0.00 H new ATOM 1397 N MET A 90 -20.884 -1.143 -3.348 1.00 0.00 N ATOM 1398 CA MET A 90 -20.227 -0.959 -4.636 1.00 0.00 C ATOM 1399 C MET A 90 -21.163 -0.280 -5.632 1.00 0.00 C ATOM 1400 O MET A 90 -22.375 -0.488 -5.598 1.00 0.00 O ATOM 1401 CB MET A 90 -19.761 -2.306 -5.193 1.00 0.00 C ATOM 1402 CG MET A 90 -20.893 -3.162 -5.737 1.00 0.00 C ATOM 1403 SD MET A 90 -20.306 -4.697 -6.481 1.00 0.00 S ATOM 1404 CE MET A 90 -20.559 -4.348 -8.219 1.00 0.00 C ATOM 0 H MET A 90 -21.893 -0.997 -3.364 1.00 0.00 H new ATOM 0 HA MET A 90 -19.359 -0.317 -4.484 1.00 0.00 H new ATOM 0 HB2 MET A 90 -19.035 -2.130 -5.987 1.00 0.00 H new ATOM 0 HB3 MET A 90 -19.246 -2.857 -4.406 1.00 0.00 H new ATOM 0 HG2 MET A 90 -21.587 -3.396 -4.930 1.00 0.00 H new ATOM 0 HG3 MET A 90 -21.450 -2.592 -6.481 1.00 0.00 H new ATOM 0 HE1 MET A 90 -19.746 -4.783 -8.800 1.00 0.00 H new ATOM 0 HE2 MET A 90 -21.507 -4.779 -8.542 1.00 0.00 H new ATOM 0 HE3 MET A 90 -20.579 -3.269 -8.374 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.591 0.531 -6.516 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.376 1.241 -7.520 1.00 0.00 C ATOM 1416 C GLU A 91 -20.801 1.021 -8.916 1.00 0.00 C ATOM 1417 O GLU A 91 -19.683 0.528 -9.068 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.417 2.737 -7.203 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.468 3.113 -6.172 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.882 2.988 -6.707 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.092 3.289 -7.901 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -24.777 2.590 -5.934 1.00 0.00 O ATOM 0 H GLU A 91 -19.588 0.713 -6.558 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.391 0.844 -7.498 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -20.437 3.050 -6.841 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -21.609 3.289 -8.123 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.357 2.474 -5.296 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.298 4.138 -5.842 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.574 1.389 -9.933 1.00 0.00 N ATOM 1430 CA VAL A 92 -21.143 1.232 -11.317 1.00 0.00 C ATOM 1431 C VAL A 92 -21.678 2.362 -12.190 1.00 0.00 C ATOM 1432 O VAL A 92 -22.792 2.844 -11.985 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.605 -0.116 -11.900 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -20.887 -0.406 -13.209 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -21.376 -1.237 -10.897 1.00 0.00 C ATOM 0 H VAL A 92 -22.502 1.798 -9.824 1.00 0.00 H new ATOM 0 HA VAL A 92 -20.053 1.263 -11.315 1.00 0.00 H new ATOM 0 HB VAL A 92 -22.674 -0.056 -12.105 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -21.226 -1.363 -13.606 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -21.107 0.384 -13.927 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -19.812 -0.447 -13.033 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -21.708 -2.182 -11.326 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -20.314 -1.300 -10.658 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -21.941 -1.033 -9.988 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.877 2.779 -13.164 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.271 3.851 -14.071 1.00 0.00 C ATOM 1447 C ASP A 93 -21.085 3.428 -15.525 1.00 0.00 C ATOM 1448 O ASP A 93 -20.212 2.622 -15.841 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.456 5.114 -13.786 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.274 6.380 -13.953 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -22.028 6.725 -13.019 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.160 7.024 -15.016 1.00 0.00 O ATOM 0 H ASP A 93 -19.951 2.391 -13.346 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.327 4.064 -13.906 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.065 5.069 -12.770 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.598 5.148 -14.457 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.915 3.979 -16.407 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.826 3.646 -17.816 1.00 0.00 C ATOM 1459 C GLY A 94 -23.106 3.031 -18.348 1.00 0.00 C ATOM 1460 O GLY A 94 -24.172 3.641 -18.272 1.00 0.00 O ATOM 0 H GLY A 94 -22.646 4.649 -16.170 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.595 4.546 -18.385 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -21.001 2.951 -17.971 1.00 0.00 H new ATOM 1464 N GLN A 95 -23.000 1.822 -18.889 1.00 0.00 N ATOM 1465 CA GLN A 95 -24.158 1.127 -19.438 1.00 0.00 C ATOM 1466 C GLN A 95 -24.564 -0.042 -18.546 1.00 0.00 C ATOM 1467 O GLN A 95 -23.904 -1.080 -18.527 1.00 0.00 O ATOM 1468 CB GLN A 95 -23.855 0.624 -20.851 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.831 1.728 -21.897 1.00 0.00 C ATOM 1470 CD GLN A 95 -25.014 1.661 -22.843 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -24.848 1.652 -24.063 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -26.217 1.614 -22.284 1.00 0.00 N ATOM 0 H GLN A 95 -22.124 1.304 -18.959 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.987 1.833 -19.481 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -22.890 0.116 -20.848 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -24.604 -0.116 -21.133 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.825 2.697 -21.397 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -22.907 1.659 -22.471 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -26.308 1.624 -21.268 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -27.050 1.568 -22.870 1.00 0.00 H new ATOM 1481 N VAL A 96 -25.656 0.135 -17.809 1.00 0.00 N ATOM 1482 CA VAL A 96 -26.151 -0.905 -16.915 1.00 0.00 C ATOM 1483 C VAL A 96 -26.216 -2.254 -17.623 1.00 0.00 C ATOM 1484 O VAL A 96 -26.060 -3.302 -16.998 1.00 0.00 O ATOM 1485 CB VAL A 96 -27.549 -0.557 -16.369 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -28.055 -1.661 -15.453 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -27.518 0.778 -15.641 1.00 0.00 C ATOM 0 H VAL A 96 -26.214 0.989 -17.813 1.00 0.00 H new ATOM 0 HA VAL A 96 -25.449 -0.968 -16.084 1.00 0.00 H new ATOM 0 HB VAL A 96 -28.238 -0.472 -17.210 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -29.044 -1.397 -15.077 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -28.116 -2.596 -16.010 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -27.369 -1.782 -14.615 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -28.513 1.009 -15.262 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -26.816 0.722 -14.809 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -27.202 1.561 -16.330 1.00 0.00 H new ATOM 1497 N GLU A 97 -26.446 -2.218 -18.932 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.531 -3.438 -19.726 1.00 0.00 C ATOM 1499 C GLU A 97 -25.150 -4.057 -19.923 1.00 0.00 C ATOM 1500 O GLU A 97 -24.978 -5.270 -19.803 1.00 0.00 O ATOM 1501 CB GLU A 97 -27.170 -3.146 -21.085 1.00 0.00 C ATOM 1502 CG GLU A 97 -26.418 -2.108 -21.900 1.00 0.00 C ATOM 1503 CD GLU A 97 -27.198 -1.643 -23.115 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -28.054 -0.747 -22.963 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -26.951 -2.175 -24.217 1.00 0.00 O ATOM 0 H GLU A 97 -26.577 -1.358 -19.464 1.00 0.00 H new ATOM 0 HA GLU A 97 -27.155 -4.149 -19.185 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -27.228 -4.072 -21.657 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -28.193 -2.803 -20.930 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -26.192 -1.249 -21.268 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -25.465 -2.526 -22.223 1.00 0.00 H new ATOM 1512 N LEU A 98 -24.169 -3.214 -20.227 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.803 -3.676 -20.443 1.00 0.00 C ATOM 1514 C LEU A 98 -22.320 -4.515 -19.264 1.00 0.00 C ATOM 1515 O LEU A 98 -21.927 -5.670 -19.432 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.867 -2.484 -20.652 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.631 -2.062 -22.103 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -20.755 -3.079 -22.818 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -22.957 -1.892 -22.831 1.00 0.00 C ATOM 0 H LEU A 98 -24.295 -2.207 -20.329 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.793 -4.299 -21.338 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -22.271 -1.631 -20.108 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.903 -2.721 -20.202 1.00 0.00 H new ATOM 0 HG LEU A 98 -21.113 -1.103 -22.103 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -20.598 -2.763 -23.849 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -19.793 -3.152 -22.310 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -21.245 -4.052 -22.808 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -22.770 -1.592 -23.862 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -23.501 -2.836 -22.821 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -23.551 -1.126 -22.332 1.00 0.00 H new ATOM 1531 N ILE A 99 -22.353 -3.928 -18.073 1.00 0.00 N ATOM 1532 CA ILE A 99 -21.922 -4.623 -16.866 1.00 0.00 C ATOM 1533 C ILE A 99 -22.619 -5.972 -16.731 1.00 0.00 C ATOM 1534 O ILE A 99 -22.075 -6.907 -16.142 1.00 0.00 O ATOM 1535 CB ILE A 99 -22.201 -3.785 -15.604 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -21.804 -4.566 -14.350 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -23.668 -3.388 -15.545 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -21.271 -3.691 -13.237 1.00 0.00 C ATOM 0 H ILE A 99 -22.674 -2.972 -17.918 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.847 -4.779 -16.958 1.00 0.00 H new ATOM 0 HB ILE A 99 -21.601 -2.876 -15.649 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -22.671 -5.117 -13.985 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -21.047 -5.304 -14.616 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -23.849 -2.796 -14.648 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -23.921 -2.798 -16.426 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -24.287 -4.285 -15.519 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -21.010 -4.312 -12.380 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -20.385 -3.160 -13.584 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -22.034 -2.970 -12.944 1.00 0.00 H new ATOM 1550 N PHE A 100 -23.824 -6.068 -17.281 1.00 0.00 N ATOM 1551 CA PHE A 100 -24.596 -7.304 -17.223 1.00 0.00 C ATOM 1552 C PHE A 100 -23.910 -8.411 -18.019 1.00 0.00 C ATOM 1553 O PHE A 100 -23.897 -9.571 -17.607 1.00 0.00 O ATOM 1554 CB PHE A 100 -26.010 -7.074 -17.761 1.00 0.00 C ATOM 1555 CG PHE A 100 -27.088 -7.597 -16.856 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -27.376 -6.961 -15.660 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -27.813 -8.726 -17.202 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -28.368 -7.440 -14.825 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -28.807 -9.209 -16.372 1.00 0.00 C ATOM 1560 CZ PHE A 100 -29.084 -8.566 -15.181 1.00 0.00 C ATOM 0 H PHE A 100 -24.288 -5.304 -17.773 1.00 0.00 H new ATOM 0 HA PHE A 100 -24.659 -7.615 -16.180 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -26.162 -6.006 -17.915 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -26.101 -7.553 -18.736 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.819 -6.080 -15.376 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -27.599 -9.234 -18.131 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -28.583 -6.934 -13.895 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -29.367 -10.088 -16.654 1.00 0.00 H new ATOM 0 HZ PHE A 100 -29.859 -8.943 -14.530 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.342 -8.044 -19.162 1.00 0.00 N ATOM 1571 CA LEU A 101 -22.655 -9.005 -20.018 1.00 0.00 C ATOM 1572 C LEU A 101 -21.385 -9.520 -19.348 1.00 0.00 C ATOM 1573 O LEU A 101 -20.851 -10.563 -19.726 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.311 -8.364 -21.364 1.00 0.00 C ATOM 1575 CG LEU A 101 -23.389 -8.452 -22.445 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -23.490 -9.871 -22.983 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -24.732 -7.991 -21.897 1.00 0.00 C ATOM 0 H LEU A 101 -23.343 -7.088 -19.518 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.324 -9.849 -20.185 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.080 -7.312 -21.194 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.404 -8.832 -21.745 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.108 -7.793 -23.266 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.262 -9.915 -23.751 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -22.533 -10.166 -23.413 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -23.748 -10.551 -22.171 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -25.487 -8.060 -22.680 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -25.020 -8.625 -21.058 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -24.652 -6.957 -21.560 1.00 0.00 H new ATOM 1589 N LEU A 102 -20.908 -8.783 -18.351 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.702 -9.166 -17.626 1.00 0.00 C ATOM 1591 C LEU A 102 -20.009 -10.241 -16.588 1.00 0.00 C ATOM 1592 O LEU A 102 -19.260 -11.206 -16.441 1.00 0.00 O ATOM 1593 CB LEU A 102 -19.083 -7.945 -16.943 1.00 0.00 C ATOM 1594 CG LEU A 102 -18.148 -7.096 -17.806 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.806 -5.794 -17.099 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -16.882 -7.871 -18.141 1.00 0.00 C ATOM 0 H LEU A 102 -21.338 -7.917 -18.026 1.00 0.00 H new ATOM 0 HA LEU A 102 -18.990 -9.572 -18.345 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.890 -7.308 -16.581 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -18.529 -8.285 -16.068 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.661 -6.856 -18.737 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -17.140 -5.203 -17.727 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.720 -5.232 -16.910 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -17.312 -6.013 -16.152 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.228 -7.252 -18.755 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.366 -8.140 -17.220 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.144 -8.777 -18.688 1.00 0.00 H new ATOM 1608 N GLU A 103 -21.116 -10.068 -15.873 1.00 0.00 N ATOM 1609 CA GLU A 103 -21.522 -11.025 -14.851 1.00 0.00 C ATOM 1610 C GLU A 103 -21.181 -12.451 -15.274 1.00 0.00 C ATOM 1611 O GLU A 103 -20.439 -13.165 -14.599 1.00 0.00 O ATOM 1612 CB GLU A 103 -23.023 -10.907 -14.578 1.00 0.00 C ATOM 1613 CG GLU A 103 -23.351 -10.238 -13.253 1.00 0.00 C ATOM 1614 CD GLU A 103 -24.170 -11.127 -12.338 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -25.251 -11.584 -12.765 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -23.729 -11.366 -11.194 1.00 0.00 O ATOM 0 H GLU A 103 -21.747 -9.274 -15.983 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.975 -10.795 -13.937 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.487 -10.341 -15.386 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -23.465 -11.903 -14.592 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.424 -9.962 -12.751 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -23.899 -9.315 -13.442 1.00 0.00 H new ATOM 1623 N PRO A 104 -21.737 -12.877 -16.418 1.00 0.00 N ATOM 1624 CA PRO A 104 -21.507 -14.220 -16.958 1.00 0.00 C ATOM 1625 C PRO A 104 -20.081 -14.405 -17.466 1.00 0.00 C ATOM 1626 O PRO A 104 -19.531 -15.505 -17.418 1.00 0.00 O ATOM 1627 CB PRO A 104 -22.504 -14.313 -18.115 1.00 0.00 C ATOM 1628 CG PRO A 104 -22.737 -12.901 -18.529 1.00 0.00 C ATOM 1629 CD PRO A 104 -22.632 -12.079 -17.274 1.00 0.00 C ATOM 0 HA PRO A 104 -21.640 -14.992 -16.200 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -22.102 -14.905 -18.937 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.432 -14.792 -17.801 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -21.999 -12.584 -19.266 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -23.718 -12.786 -18.990 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.220 -11.090 -17.475 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.606 -11.930 -16.808 1.00 0.00 H new ATOM 1637 N PHE A 105 -19.487 -13.321 -17.954 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.125 -13.363 -18.473 1.00 0.00 C ATOM 1639 C PHE A 105 -17.149 -13.832 -17.399 1.00 0.00 C ATOM 1640 O PHE A 105 -16.129 -14.453 -17.700 1.00 0.00 O ATOM 1641 CB PHE A 105 -17.710 -11.984 -18.988 1.00 0.00 C ATOM 1642 CG PHE A 105 -16.320 -11.950 -19.558 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -16.020 -12.630 -20.727 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -15.315 -11.238 -18.924 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -14.742 -12.601 -21.252 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -14.035 -11.205 -19.445 1.00 0.00 C ATOM 1647 CZ PHE A 105 -13.748 -11.887 -20.611 1.00 0.00 C ATOM 0 H PHE A 105 -19.928 -12.402 -18.001 1.00 0.00 H new ATOM 0 HA PHE A 105 -18.099 -14.074 -19.299 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -18.416 -11.663 -19.754 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.777 -11.265 -18.172 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -16.793 -13.189 -21.233 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.534 -10.702 -18.012 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -14.520 -13.136 -22.163 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -13.260 -10.646 -18.941 1.00 0.00 H new ATOM 0 HZ PHE A 105 -12.749 -11.862 -21.021 1.00 0.00 H new ATOM 1657 N ILE A 106 -17.468 -13.531 -16.145 1.00 0.00 N ATOM 1658 CA ILE A 106 -16.620 -13.922 -15.025 1.00 0.00 C ATOM 1659 C ILE A 106 -16.377 -15.427 -15.020 1.00 0.00 C ATOM 1660 O ILE A 106 -15.356 -15.899 -14.520 1.00 0.00 O ATOM 1661 CB ILE A 106 -17.241 -13.509 -13.678 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -17.482 -11.998 -13.644 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -16.340 -13.933 -12.528 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -18.340 -11.549 -12.482 1.00 0.00 C ATOM 0 H ILE A 106 -18.308 -13.017 -15.879 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.670 -13.403 -15.152 1.00 0.00 H new ATOM 0 HB ILE A 106 -18.201 -14.013 -13.567 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -16.521 -11.486 -13.595 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -17.958 -11.693 -14.576 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -16.792 -13.634 -11.582 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -16.214 -15.016 -12.544 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.367 -13.453 -12.632 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -18.469 -10.467 -12.521 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -19.315 -12.033 -12.541 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -17.855 -11.823 -11.545 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.320 -16.176 -15.582 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.206 -17.628 -15.646 1.00 0.00 C ATOM 1678 C ALA A 107 -16.053 -18.049 -16.550 1.00 0.00 C ATOM 1679 O ALA A 107 -15.436 -19.093 -16.340 1.00 0.00 O ATOM 1680 CB ALA A 107 -18.512 -18.239 -16.133 1.00 0.00 C ATOM 0 H ALA A 107 -18.172 -15.801 -16.000 1.00 0.00 H new ATOM 0 HA ALA A 107 -16.998 -17.996 -14.641 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -18.413 -19.324 -16.176 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -19.316 -17.975 -15.446 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -18.744 -17.856 -17.127 1.00 0.00 H new ATOM 1686 N SER A 108 -15.768 -17.230 -17.558 1.00 0.00 N ATOM 1687 CA SER A 108 -14.691 -17.520 -18.497 1.00 0.00 C ATOM 1688 C SER A 108 -13.354 -17.635 -17.773 1.00 0.00 C ATOM 1689 O SER A 108 -12.685 -18.667 -17.837 1.00 0.00 O ATOM 1690 CB SER A 108 -14.613 -16.431 -19.568 1.00 0.00 C ATOM 1691 OG SER A 108 -13.895 -16.882 -20.704 1.00 0.00 O ATOM 0 H SER A 108 -16.268 -16.361 -17.745 1.00 0.00 H new ATOM 0 HA SER A 108 -14.907 -18.475 -18.976 1.00 0.00 H new ATOM 0 HB2 SER A 108 -15.619 -16.135 -19.864 1.00 0.00 H new ATOM 0 HB3 SER A 108 -14.129 -15.546 -19.156 1.00 0.00 H new ATOM 0 HG SER A 108 -13.861 -16.168 -21.374 1.00 0.00 H new