USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 821 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 88 SER OG : rot 82:sc= 0.831 USER MOD Set 2.1: A 47 MET CE :methyl -137:sc= -0.0726 (180deg=-0.705) USER MOD Set 2.2: A 50 CYS SG : rot 17:sc= -0.428 USER MOD Set 3.1: A 43 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.08) USER MOD Set 3.2: A 51 TYR OH : rot -51:sc= -0.423 USER MOD Set 4.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 3 TYR OH : rot -153:sc= 1.26 USER MOD Single : A 1 MET N :NH3+ 139:sc= 0.117 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -125:sc= 0.705 (180deg=-0.0292) USER MOD Single : A 17 LYS NZ :NH3+ 162:sc= -0.0364 (180deg=-0.326) USER MOD Single : A 20 SER OG : rot -84:sc= 1.21 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.0066 USER MOD Single : A 25 GLN : amide:sc= 0.587 K(o=0.59,f=-0.93) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 177:sc= -0.363 (180deg=-0.398) USER MOD Single : A 36 SER OG : rot 0:sc= 0.528 USER MOD Single : A 42 ASN : amide:sc= -0.225 X(o=-0.22,f=-0.46) USER MOD Single : A 52 LYS NZ :NH3+ -111:sc= 0.691 (180deg=-0.428) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -170:sc= -0.0128 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 30:sc= -0.0583 USER MOD Single : A 65 GLN : amide:sc= -0.599 K(o=-0.6,f=-0.061) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= -0.0609 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= -0.081 USER MOD Single : A 92 LYS NZ :NH3+ 169:sc= -0.0269 (180deg=-0.169) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.910 15.241 -1.768 1.00 0.00 N ATOM 2 CA MET A 1 11.088 14.090 -2.645 1.00 0.00 C ATOM 3 C MET A 1 9.759 13.424 -2.817 1.00 0.00 C ATOM 4 O MET A 1 8.953 13.431 -1.900 1.00 0.00 O ATOM 5 CB MET A 1 12.092 13.087 -2.044 1.00 0.00 C ATOM 6 CG MET A 1 12.398 11.891 -2.942 1.00 0.00 C ATOM 7 SD MET A 1 13.552 10.724 -2.197 1.00 0.00 S ATOM 8 CE MET A 1 13.686 9.513 -3.514 1.00 0.00 C ATOM 0 H1 MET A 1 11.709 15.299 -1.104 1.00 0.00 H new ATOM 0 H2 MET A 1 10.871 16.110 -2.339 1.00 0.00 H new ATOM 0 H3 MET A 1 10.023 15.137 -1.234 1.00 0.00 H new ATOM 0 HA MET A 1 11.481 14.425 -3.605 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.023 13.610 -1.825 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.700 12.723 -1.094 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.468 11.373 -3.177 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.811 12.249 -3.885 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.368 8.719 -3.210 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.703 9.089 -3.719 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.068 9.995 -4.414 1.00 0.00 H new ATOM 18 N ALA A 2 9.521 12.876 -3.972 1.00 0.00 N ATOM 19 CA ALA A 2 8.305 12.167 -4.233 1.00 0.00 C ATOM 20 C ALA A 2 8.642 10.842 -4.862 1.00 0.00 C ATOM 21 O ALA A 2 9.699 10.697 -5.480 1.00 0.00 O ATOM 22 CB ALA A 2 7.390 12.973 -5.139 1.00 0.00 C ATOM 0 H ALA A 2 10.167 12.909 -4.761 1.00 0.00 H new ATOM 0 HA ALA A 2 7.774 12.003 -3.295 1.00 0.00 H new ATOM 0 HB1 ALA A 2 6.473 12.412 -5.322 1.00 0.00 H new ATOM 0 HB2 ALA A 2 7.146 13.921 -4.659 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.893 13.165 -6.087 1.00 0.00 H new ATOM 28 N TYR A 3 7.787 9.886 -4.673 1.00 0.00 N ATOM 29 CA TYR A 3 7.963 8.569 -5.227 1.00 0.00 C ATOM 30 C TYR A 3 6.808 8.291 -6.165 1.00 0.00 C ATOM 31 O TYR A 3 5.838 9.040 -6.185 1.00 0.00 O ATOM 32 CB TYR A 3 8.008 7.498 -4.115 1.00 0.00 C ATOM 33 CG TYR A 3 9.223 7.542 -3.193 1.00 0.00 C ATOM 34 CD1 TYR A 3 9.426 8.591 -2.302 1.00 0.00 C ATOM 35 CD2 TYR A 3 10.146 6.505 -3.192 1.00 0.00 C ATOM 36 CE1 TYR A 3 10.508 8.603 -1.443 1.00 0.00 C ATOM 37 CE2 TYR A 3 11.233 6.515 -2.339 1.00 0.00 C ATOM 38 CZ TYR A 3 11.410 7.561 -1.468 1.00 0.00 C ATOM 39 OH TYR A 3 12.481 7.556 -0.593 1.00 0.00 O ATOM 0 H TYR A 3 6.935 9.994 -4.123 1.00 0.00 H new ATOM 0 HA TYR A 3 8.911 8.527 -5.764 1.00 0.00 H new ATOM 0 HB2 TYR A 3 7.110 7.598 -3.505 1.00 0.00 H new ATOM 0 HB3 TYR A 3 7.967 6.515 -4.583 1.00 0.00 H new ATOM 0 HD1 TYR A 3 8.724 9.412 -2.281 1.00 0.00 H new ATOM 0 HD2 TYR A 3 10.012 5.675 -3.870 1.00 0.00 H new ATOM 0 HE1 TYR A 3 10.646 9.424 -0.756 1.00 0.00 H new ATOM 0 HE2 TYR A 3 11.942 5.701 -2.358 1.00 0.00 H new ATOM 0 HH TYR A 3 13.220 7.045 -0.984 1.00 0.00 H new ATOM 49 N PHE A 4 6.913 7.248 -6.930 1.00 0.00 N ATOM 50 CA PHE A 4 5.870 6.874 -7.864 1.00 0.00 C ATOM 51 C PHE A 4 4.992 5.771 -7.294 1.00 0.00 C ATOM 52 O PHE A 4 5.366 5.115 -6.323 1.00 0.00 O ATOM 53 CB PHE A 4 6.495 6.446 -9.195 1.00 0.00 C ATOM 54 CG PHE A 4 7.178 7.577 -9.911 1.00 0.00 C ATOM 55 CD1 PHE A 4 6.459 8.425 -10.734 1.00 0.00 C ATOM 56 CD2 PHE A 4 8.536 7.798 -9.754 1.00 0.00 C ATOM 57 CE1 PHE A 4 7.080 9.473 -11.382 1.00 0.00 C ATOM 58 CE2 PHE A 4 9.162 8.841 -10.400 1.00 0.00 C ATOM 59 CZ PHE A 4 8.435 9.679 -11.215 1.00 0.00 C ATOM 0 H PHE A 4 7.721 6.625 -6.932 1.00 0.00 H new ATOM 0 HA PHE A 4 5.232 7.740 -8.038 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.217 5.650 -9.012 1.00 0.00 H new ATOM 0 HB3 PHE A 4 5.719 6.031 -9.838 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.400 8.265 -10.871 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.112 7.144 -9.116 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.507 10.131 -12.019 1.00 0.00 H new ATOM 0 HE2 PHE A 4 10.222 9.001 -10.267 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.924 10.497 -11.723 1.00 0.00 H new ATOM 69 N LEU A 5 3.824 5.584 -7.883 1.00 0.00 N ATOM 70 CA LEU A 5 2.893 4.542 -7.464 1.00 0.00 C ATOM 71 C LEU A 5 2.866 3.379 -8.419 1.00 0.00 C ATOM 72 O LEU A 5 2.740 3.558 -9.647 1.00 0.00 O ATOM 73 CB LEU A 5 1.447 5.068 -7.309 1.00 0.00 C ATOM 74 CG LEU A 5 1.007 5.558 -5.927 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.125 4.447 -4.905 1.00 0.00 C ATOM 76 CD2 LEU A 5 1.790 6.769 -5.501 1.00 0.00 C ATOM 0 H LEU A 5 3.491 6.148 -8.665 1.00 0.00 H new ATOM 0 HA LEU A 5 3.264 4.210 -6.495 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.313 5.889 -8.013 1.00 0.00 H new ATOM 0 HB3 LEU A 5 0.767 4.272 -7.614 1.00 0.00 H new ATOM 0 HG LEU A 5 -0.041 5.852 -5.993 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.808 4.815 -3.929 1.00 0.00 H new ATOM 0 HD12 LEU A 5 0.491 3.611 -5.201 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.161 4.114 -4.848 1.00 0.00 H new ATOM 0 HD21 LEU A 5 1.453 7.092 -4.516 1.00 0.00 H new ATOM 0 HD22 LEU A 5 2.850 6.520 -5.459 1.00 0.00 H new ATOM 0 HD23 LEU A 5 1.635 7.574 -6.219 1.00 0.00 H new ATOM 88 N ASP A 6 2.978 2.202 -7.873 1.00 0.00 N ATOM 89 CA ASP A 6 2.794 0.990 -8.626 1.00 0.00 C ATOM 90 C ASP A 6 1.987 0.042 -7.791 1.00 0.00 C ATOM 91 O ASP A 6 2.049 0.081 -6.564 1.00 0.00 O ATOM 92 CB ASP A 6 4.104 0.341 -9.056 1.00 0.00 C ATOM 93 CG ASP A 6 3.875 -0.808 -10.016 1.00 0.00 C ATOM 94 OD1 ASP A 6 3.289 -0.582 -11.097 1.00 0.00 O ATOM 95 OD2 ASP A 6 4.270 -1.938 -9.725 1.00 0.00 O ATOM 0 H ASP A 6 3.200 2.053 -6.889 1.00 0.00 H new ATOM 0 HA ASP A 6 2.274 1.240 -9.551 1.00 0.00 H new ATOM 0 HB2 ASP A 6 4.741 1.088 -9.529 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.636 -0.021 -8.176 1.00 0.00 H new ATOM 100 N PHE A 7 1.229 -0.779 -8.430 1.00 0.00 N ATOM 101 CA PHE A 7 0.332 -1.678 -7.756 1.00 0.00 C ATOM 102 C PHE A 7 0.505 -3.054 -8.330 1.00 0.00 C ATOM 103 O PHE A 7 0.598 -3.208 -9.559 1.00 0.00 O ATOM 104 CB PHE A 7 -1.140 -1.257 -7.973 1.00 0.00 C ATOM 105 CG PHE A 7 -1.530 0.118 -7.479 1.00 0.00 C ATOM 106 CD1 PHE A 7 -1.276 1.251 -8.245 1.00 0.00 C ATOM 107 CD2 PHE A 7 -2.169 0.273 -6.261 1.00 0.00 C ATOM 108 CE1 PHE A 7 -1.645 2.505 -7.800 1.00 0.00 C ATOM 109 CE2 PHE A 7 -2.543 1.527 -5.813 1.00 0.00 C ATOM 110 CZ PHE A 7 -2.281 2.642 -6.583 1.00 0.00 C ATOM 0 H PHE A 7 1.207 -0.853 -9.447 1.00 0.00 H new ATOM 0 HA PHE A 7 0.561 -1.657 -6.690 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -1.356 -1.310 -9.040 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -1.780 -1.990 -7.482 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.784 1.148 -9.201 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -2.378 -0.595 -5.654 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -1.436 3.376 -8.403 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -3.040 1.634 -4.860 1.00 0.00 H new ATOM 0 HZ PHE A 7 -2.574 3.621 -6.233 1.00 0.00 H new ATOM 120 N ASP A 8 0.583 -4.042 -7.484 1.00 0.00 N ATOM 121 CA ASP A 8 0.606 -5.414 -7.949 1.00 0.00 C ATOM 122 C ASP A 8 -0.784 -5.760 -8.448 1.00 0.00 C ATOM 123 O ASP A 8 -1.764 -5.158 -8.002 1.00 0.00 O ATOM 124 CB ASP A 8 0.999 -6.378 -6.827 1.00 0.00 C ATOM 125 CG ASP A 8 1.032 -7.816 -7.296 1.00 0.00 C ATOM 126 OD1 ASP A 8 2.064 -8.270 -7.814 1.00 0.00 O ATOM 127 OD2 ASP A 8 0.020 -8.509 -7.184 1.00 0.00 O ATOM 0 H ASP A 8 0.632 -3.932 -6.471 1.00 0.00 H new ATOM 0 HA ASP A 8 1.346 -5.512 -8.743 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.979 -6.101 -6.439 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.292 -6.282 -6.003 1.00 0.00 H new ATOM 132 N GLU A 9 -0.877 -6.694 -9.364 1.00 0.00 N ATOM 133 CA GLU A 9 -2.153 -7.116 -9.906 1.00 0.00 C ATOM 134 C GLU A 9 -3.118 -7.604 -8.809 1.00 0.00 C ATOM 135 O GLU A 9 -4.316 -7.425 -8.932 1.00 0.00 O ATOM 136 CB GLU A 9 -1.971 -8.198 -10.948 1.00 0.00 C ATOM 137 CG GLU A 9 -1.305 -9.442 -10.419 1.00 0.00 C ATOM 138 CD GLU A 9 -1.336 -10.542 -11.405 1.00 0.00 C ATOM 139 OE1 GLU A 9 -2.324 -11.303 -11.410 1.00 0.00 O ATOM 140 OE2 GLU A 9 -0.393 -10.657 -12.206 1.00 0.00 O ATOM 0 H GLU A 9 -0.073 -7.184 -9.756 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.596 -6.239 -10.377 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -2.946 -8.464 -11.357 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.378 -7.801 -11.772 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.271 -9.217 -10.157 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.804 -9.760 -9.504 1.00 0.00 H new ATOM 147 N ARG A 10 -2.590 -8.207 -7.742 1.00 0.00 N ATOM 148 CA ARG A 10 -3.422 -8.663 -6.640 1.00 0.00 C ATOM 149 C ARG A 10 -3.992 -7.481 -5.921 1.00 0.00 C ATOM 150 O ARG A 10 -5.178 -7.447 -5.596 1.00 0.00 O ATOM 151 CB ARG A 10 -2.642 -9.520 -5.657 1.00 0.00 C ATOM 152 CG ARG A 10 -2.187 -10.855 -6.207 1.00 0.00 C ATOM 153 CD ARG A 10 -1.457 -11.649 -5.141 1.00 0.00 C ATOM 154 NE ARG A 10 -2.277 -11.801 -3.929 1.00 0.00 N ATOM 155 CZ ARG A 10 -2.330 -12.888 -3.151 1.00 0.00 C ATOM 156 NH1 ARG A 10 -1.632 -13.987 -3.461 1.00 0.00 N ATOM 157 NH2 ARG A 10 -3.110 -12.873 -2.087 1.00 0.00 N ATOM 0 H ARG A 10 -1.593 -8.388 -7.623 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.221 -9.275 -7.059 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -1.767 -8.962 -5.324 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.262 -9.696 -4.778 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -3.048 -11.420 -6.564 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -1.532 -10.698 -7.064 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.197 -12.633 -5.532 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.522 -11.149 -4.889 1.00 0.00 H new ATOM 0 HE ARG A 10 -2.857 -11.007 -3.658 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.051 -14.002 -4.299 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -1.681 -14.809 -2.859 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -3.660 -12.042 -1.869 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -3.163 -13.693 -1.482 1.00 0.00 H new ATOM 171 N ALA A 11 -3.150 -6.487 -5.726 1.00 0.00 N ATOM 172 CA ALA A 11 -3.551 -5.263 -5.089 1.00 0.00 C ATOM 173 C ALA A 11 -4.573 -4.550 -5.949 1.00 0.00 C ATOM 174 O ALA A 11 -5.481 -3.944 -5.437 1.00 0.00 O ATOM 175 CB ALA A 11 -2.349 -4.370 -4.828 1.00 0.00 C ATOM 0 H ALA A 11 -2.170 -6.511 -6.007 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.004 -5.500 -4.126 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.678 -3.450 -4.345 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.644 -4.889 -4.178 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.862 -4.130 -5.773 1.00 0.00 H new ATOM 181 N LEU A 12 -4.445 -4.685 -7.265 1.00 0.00 N ATOM 182 CA LEU A 12 -5.372 -4.077 -8.193 1.00 0.00 C ATOM 183 C LEU A 12 -6.704 -4.754 -8.120 1.00 0.00 C ATOM 184 O LEU A 12 -7.734 -4.106 -8.169 1.00 0.00 O ATOM 185 CB LEU A 12 -4.838 -4.118 -9.613 1.00 0.00 C ATOM 186 CG LEU A 12 -3.717 -3.143 -9.941 1.00 0.00 C ATOM 187 CD1 LEU A 12 -3.194 -3.412 -11.335 1.00 0.00 C ATOM 188 CD2 LEU A 12 -4.229 -1.705 -9.842 1.00 0.00 C ATOM 0 H LEU A 12 -3.697 -5.218 -7.710 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.491 -3.032 -7.908 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.483 -5.128 -9.816 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.667 -3.929 -10.296 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.906 -3.279 -9.225 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.392 -2.711 -11.564 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.812 -4.431 -11.390 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -4.001 -3.288 -12.057 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.420 -1.014 -10.078 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.047 -1.561 -10.547 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.585 -1.514 -8.830 1.00 0.00 H new ATOM 200 N LYS A 13 -6.682 -6.056 -7.980 1.00 0.00 N ATOM 201 CA LYS A 13 -7.894 -6.826 -7.849 1.00 0.00 C ATOM 202 C LYS A 13 -8.641 -6.413 -6.591 1.00 0.00 C ATOM 203 O LYS A 13 -9.856 -6.199 -6.625 1.00 0.00 O ATOM 204 CB LYS A 13 -7.567 -8.314 -7.820 1.00 0.00 C ATOM 205 CG LYS A 13 -7.040 -8.849 -9.138 1.00 0.00 C ATOM 206 CD LYS A 13 -6.473 -10.240 -8.976 1.00 0.00 C ATOM 207 CE LYS A 13 -6.099 -10.866 -10.318 1.00 0.00 C ATOM 208 NZ LYS A 13 -4.974 -10.168 -10.992 1.00 0.00 N ATOM 0 H LYS A 13 -5.826 -6.611 -7.954 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.535 -6.632 -8.709 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.827 -8.499 -7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -8.464 -8.869 -7.546 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -7.843 -8.865 -9.874 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -6.269 -8.182 -9.522 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -5.591 -10.200 -8.337 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.204 -10.873 -8.472 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -5.830 -11.911 -10.163 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -6.970 -10.855 -10.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.265 -9.884 -11.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -4.712 -9.323 -10.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -4.156 -10.807 -11.054 1.00 0.00 H new ATOM 222 N GLU A 14 -7.916 -6.260 -5.499 1.00 0.00 N ATOM 223 CA GLU A 14 -8.511 -5.819 -4.255 1.00 0.00 C ATOM 224 C GLU A 14 -8.941 -4.337 -4.330 1.00 0.00 C ATOM 225 O GLU A 14 -9.977 -3.959 -3.823 1.00 0.00 O ATOM 226 CB GLU A 14 -7.601 -6.112 -3.059 1.00 0.00 C ATOM 227 CG GLU A 14 -7.230 -7.591 -2.942 1.00 0.00 C ATOM 228 CD GLU A 14 -6.585 -7.959 -1.625 1.00 0.00 C ATOM 229 OE1 GLU A 14 -5.345 -7.797 -1.460 1.00 0.00 O ATOM 230 OE2 GLU A 14 -7.310 -8.464 -0.719 1.00 0.00 O ATOM 0 H GLU A 14 -6.912 -6.435 -5.450 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.420 -6.399 -4.097 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.690 -5.520 -3.148 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -8.099 -5.794 -2.143 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.129 -8.193 -3.076 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.550 -7.850 -3.753 1.00 0.00 H new ATOM 237 N TRP A 15 -8.150 -3.532 -4.998 1.00 0.00 N ATOM 238 CA TRP A 15 -8.429 -2.099 -5.210 1.00 0.00 C ATOM 239 C TRP A 15 -9.731 -1.920 -6.024 1.00 0.00 C ATOM 240 O TRP A 15 -10.557 -1.040 -5.736 1.00 0.00 O ATOM 241 CB TRP A 15 -7.222 -1.489 -5.953 1.00 0.00 C ATOM 242 CG TRP A 15 -7.263 -0.022 -6.232 1.00 0.00 C ATOM 243 CD1 TRP A 15 -7.726 0.588 -7.359 1.00 0.00 C ATOM 244 CD2 TRP A 15 -6.769 1.017 -5.387 1.00 0.00 C ATOM 245 NE1 TRP A 15 -7.575 1.946 -7.254 1.00 0.00 N ATOM 246 CE2 TRP A 15 -6.985 2.235 -6.053 1.00 0.00 C ATOM 247 CE3 TRP A 15 -6.171 1.035 -4.125 1.00 0.00 C ATOM 248 CZ2 TRP A 15 -6.623 3.457 -5.502 1.00 0.00 C ATOM 249 CZ3 TRP A 15 -5.811 2.248 -3.581 1.00 0.00 C ATOM 250 CH2 TRP A 15 -6.037 3.442 -4.267 1.00 0.00 C ATOM 0 H TRP A 15 -7.276 -3.842 -5.423 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.571 -1.591 -4.256 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -6.325 -1.697 -5.369 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -7.111 -2.011 -6.904 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.150 0.076 -8.210 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -7.856 2.630 -7.956 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.994 0.116 -3.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.798 4.384 -6.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -5.346 2.276 -2.607 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -5.742 4.376 -3.812 1.00 0.00 H new ATOM 261 N ARG A 16 -9.901 -2.745 -7.041 1.00 0.00 N ATOM 262 CA ARG A 16 -11.107 -2.723 -7.863 1.00 0.00 C ATOM 263 C ARG A 16 -12.284 -3.359 -7.131 1.00 0.00 C ATOM 264 O ARG A 16 -13.440 -3.102 -7.457 1.00 0.00 O ATOM 265 CB ARG A 16 -10.868 -3.396 -9.203 1.00 0.00 C ATOM 266 CG ARG A 16 -9.778 -2.730 -10.015 1.00 0.00 C ATOM 267 CD ARG A 16 -9.500 -3.489 -11.282 1.00 0.00 C ATOM 268 NE ARG A 16 -8.312 -2.988 -11.972 1.00 0.00 N ATOM 269 CZ ARG A 16 -7.549 -3.726 -12.778 1.00 0.00 C ATOM 270 NH1 ARG A 16 -7.916 -4.973 -13.088 1.00 0.00 N ATOM 271 NH2 ARG A 16 -6.439 -3.213 -13.296 1.00 0.00 N ATOM 0 H ARG A 16 -9.215 -3.446 -7.323 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.359 -1.680 -8.054 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -10.603 -4.440 -9.036 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -11.795 -3.390 -9.776 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.074 -1.709 -10.257 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -8.867 -2.665 -9.420 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -9.366 -4.545 -11.050 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -10.362 -3.416 -11.945 1.00 0.00 H new ATOM 0 HE ARG A 16 -8.051 -2.013 -11.827 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.780 -5.360 -12.708 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -7.332 -5.538 -13.705 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -6.170 -2.254 -13.077 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.855 -3.778 -13.913 1.00 0.00 H new ATOM 285 N LYS A 17 -11.974 -4.211 -6.172 1.00 0.00 N ATOM 286 CA LYS A 17 -12.968 -4.835 -5.304 1.00 0.00 C ATOM 287 C LYS A 17 -13.568 -3.754 -4.421 1.00 0.00 C ATOM 288 O LYS A 17 -14.796 -3.665 -4.252 1.00 0.00 O ATOM 289 CB LYS A 17 -12.267 -5.869 -4.428 1.00 0.00 C ATOM 290 CG LYS A 17 -13.146 -6.629 -3.471 1.00 0.00 C ATOM 291 CD LYS A 17 -12.286 -7.419 -2.502 1.00 0.00 C ATOM 292 CE LYS A 17 -13.111 -8.345 -1.642 1.00 0.00 C ATOM 293 NZ LYS A 17 -13.741 -9.404 -2.448 1.00 0.00 N ATOM 0 H LYS A 17 -11.016 -4.496 -5.968 1.00 0.00 H new ATOM 0 HA LYS A 17 -13.749 -5.318 -5.891 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.766 -6.587 -5.078 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.491 -5.363 -3.854 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -13.786 -5.938 -2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -13.802 -7.303 -4.022 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -11.551 -8.000 -3.059 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -11.731 -6.730 -1.865 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.478 -8.795 -0.877 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -13.881 -7.774 -1.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -14.039 -10.183 -1.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -14.571 -9.018 -2.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.059 -9.761 -3.147 1.00 0.00 H new ATOM 307 N LEU A 18 -12.676 -2.936 -3.885 1.00 0.00 N ATOM 308 CA LEU A 18 -13.004 -1.808 -3.033 1.00 0.00 C ATOM 309 C LEU A 18 -13.905 -0.814 -3.711 1.00 0.00 C ATOM 310 O LEU A 18 -13.882 -0.648 -4.942 1.00 0.00 O ATOM 311 CB LEU A 18 -11.731 -1.091 -2.574 1.00 0.00 C ATOM 312 CG LEU A 18 -11.176 -1.460 -1.203 1.00 0.00 C ATOM 313 CD1 LEU A 18 -10.980 -2.952 -1.046 1.00 0.00 C ATOM 314 CD2 LEU A 18 -9.884 -0.721 -0.959 1.00 0.00 C ATOM 0 H LEU A 18 -11.673 -3.044 -4.037 1.00 0.00 H new ATOM 0 HA LEU A 18 -13.536 -2.217 -2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.953 -1.278 -3.314 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.927 -0.019 -2.581 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.910 -1.160 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.583 -3.164 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -11.936 -3.460 -1.171 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -10.279 -3.308 -1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.492 -0.988 0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.159 -0.993 -1.726 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.066 0.353 -0.996 1.00 0.00 H new ATOM 326 N GLY A 19 -14.680 -0.151 -2.906 1.00 0.00 N ATOM 327 CA GLY A 19 -15.568 0.866 -3.392 1.00 0.00 C ATOM 328 C GLY A 19 -14.785 2.102 -3.723 1.00 0.00 C ATOM 329 O GLY A 19 -13.733 2.342 -3.096 1.00 0.00 O ATOM 0 H GLY A 19 -14.716 -0.298 -1.897 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.096 0.510 -4.277 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.324 1.093 -2.640 1.00 0.00 H new ATOM 333 N SER A 20 -15.281 2.894 -4.667 1.00 0.00 N ATOM 334 CA SER A 20 -14.584 4.069 -5.163 1.00 0.00 C ATOM 335 C SER A 20 -14.162 4.983 -4.023 1.00 0.00 C ATOM 336 O SER A 20 -13.004 5.265 -3.872 1.00 0.00 O ATOM 337 CB SER A 20 -15.448 4.838 -6.181 1.00 0.00 C ATOM 338 OG SER A 20 -14.726 5.932 -6.755 1.00 0.00 O ATOM 0 H SER A 20 -16.185 2.735 -5.111 1.00 0.00 H new ATOM 0 HA SER A 20 -13.683 3.725 -5.671 1.00 0.00 H new ATOM 0 HB2 SER A 20 -15.773 4.160 -6.970 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.347 5.211 -5.690 1.00 0.00 H new ATOM 0 HG SER A 20 -14.788 6.711 -6.164 1.00 0.00 H new ATOM 344 N THR A 21 -15.100 5.345 -3.192 1.00 0.00 N ATOM 345 CA THR A 21 -14.884 6.271 -2.091 1.00 0.00 C ATOM 346 C THR A 21 -13.780 5.769 -1.135 1.00 0.00 C ATOM 347 O THR A 21 -12.938 6.552 -0.671 1.00 0.00 O ATOM 348 CB THR A 21 -16.202 6.460 -1.314 1.00 0.00 C ATOM 349 OG1 THR A 21 -17.258 6.746 -2.254 1.00 0.00 O ATOM 350 CG2 THR A 21 -16.097 7.607 -0.308 1.00 0.00 C ATOM 0 H THR A 21 -16.059 5.003 -3.254 1.00 0.00 H new ATOM 0 HA THR A 21 -14.556 7.224 -2.507 1.00 0.00 H new ATOM 0 HB THR A 21 -16.414 5.544 -0.762 1.00 0.00 H new ATOM 0 HG1 THR A 21 -18.102 6.867 -1.771 1.00 0.00 H new ATOM 0 HG21 THR A 21 -17.043 7.713 0.223 1.00 0.00 H new ATOM 0 HG22 THR A 21 -15.302 7.393 0.407 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.871 8.534 -0.835 1.00 0.00 H new ATOM 358 N VAL A 22 -13.747 4.463 -0.907 1.00 0.00 N ATOM 359 CA VAL A 22 -12.787 3.877 0.005 1.00 0.00 C ATOM 360 C VAL A 22 -11.396 3.907 -0.615 1.00 0.00 C ATOM 361 O VAL A 22 -10.437 4.376 -0.003 1.00 0.00 O ATOM 362 CB VAL A 22 -13.181 2.412 0.349 1.00 0.00 C ATOM 363 CG1 VAL A 22 -12.154 1.763 1.255 1.00 0.00 C ATOM 364 CG2 VAL A 22 -14.561 2.364 0.993 1.00 0.00 C ATOM 0 H VAL A 22 -14.378 3.792 -1.345 1.00 0.00 H new ATOM 0 HA VAL A 22 -12.784 4.461 0.925 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.210 1.849 -0.584 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.459 0.740 1.477 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -11.184 1.753 0.757 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.079 2.328 2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.818 1.331 1.226 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.555 2.952 1.911 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -15.299 2.775 0.304 1.00 0.00 H new ATOM 374 N ARG A 23 -11.309 3.479 -1.850 1.00 0.00 N ATOM 375 CA ARG A 23 -10.043 3.469 -2.544 1.00 0.00 C ATOM 376 C ARG A 23 -9.542 4.880 -2.835 1.00 0.00 C ATOM 377 O ARG A 23 -8.353 5.118 -2.831 1.00 0.00 O ATOM 378 CB ARG A 23 -10.055 2.602 -3.787 1.00 0.00 C ATOM 379 CG ARG A 23 -11.115 2.952 -4.794 1.00 0.00 C ATOM 380 CD ARG A 23 -10.809 2.293 -6.102 1.00 0.00 C ATOM 381 NE ARG A 23 -11.819 2.576 -7.112 1.00 0.00 N ATOM 382 CZ ARG A 23 -12.550 1.653 -7.733 1.00 0.00 C ATOM 383 NH1 ARG A 23 -12.443 0.369 -7.401 1.00 0.00 N ATOM 384 NH2 ARG A 23 -13.406 2.024 -8.675 1.00 0.00 N ATOM 0 H ARG A 23 -12.098 3.133 -2.396 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.328 3.007 -1.863 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.080 2.671 -4.269 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.190 1.563 -3.486 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -12.092 2.630 -4.434 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -11.164 4.033 -4.924 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.836 2.632 -6.459 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -10.737 1.215 -5.955 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.978 3.552 -7.362 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.797 0.085 -6.665 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -13.007 -0.331 -7.883 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.500 3.010 -8.919 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -13.970 1.323 -9.156 1.00 0.00 H new ATOM 398 N GLU A 24 -10.457 5.794 -3.107 1.00 0.00 N ATOM 399 CA GLU A 24 -10.128 7.194 -3.350 1.00 0.00 C ATOM 400 C GLU A 24 -9.380 7.800 -2.185 1.00 0.00 C ATOM 401 O GLU A 24 -8.350 8.447 -2.371 1.00 0.00 O ATOM 402 CB GLU A 24 -11.381 8.005 -3.647 1.00 0.00 C ATOM 403 CG GLU A 24 -11.902 7.825 -5.061 1.00 0.00 C ATOM 404 CD GLU A 24 -13.085 8.693 -5.351 1.00 0.00 C ATOM 405 OE1 GLU A 24 -12.897 9.912 -5.563 1.00 0.00 O ATOM 406 OE2 GLU A 24 -14.226 8.195 -5.381 1.00 0.00 O ATOM 0 H GLU A 24 -11.454 5.588 -3.167 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.476 7.225 -4.223 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.163 7.721 -2.942 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.168 9.061 -3.479 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.106 8.053 -5.770 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.175 6.781 -5.214 1.00 0.00 H new ATOM 413 N GLN A 25 -9.865 7.551 -0.987 1.00 0.00 N ATOM 414 CA GLN A 25 -9.224 8.058 0.215 1.00 0.00 C ATOM 415 C GLN A 25 -7.856 7.420 0.404 1.00 0.00 C ATOM 416 O GLN A 25 -6.910 8.076 0.843 1.00 0.00 O ATOM 417 CB GLN A 25 -10.123 7.841 1.414 1.00 0.00 C ATOM 418 CG GLN A 25 -11.365 8.712 1.379 1.00 0.00 C ATOM 419 CD GLN A 25 -12.397 8.292 2.383 1.00 0.00 C ATOM 420 OE1 GLN A 25 -12.412 8.742 3.526 1.00 0.00 O ATOM 421 NE2 GLN A 25 -13.268 7.432 1.958 1.00 0.00 N ATOM 0 H GLN A 25 -10.705 6.998 -0.816 1.00 0.00 H new ATOM 0 HA GLN A 25 -9.065 9.131 0.110 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -10.420 6.793 1.455 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -9.563 8.050 2.326 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.082 9.748 1.567 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.800 8.676 0.380 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -13.217 7.085 1.000 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -14.005 7.102 2.581 1.00 0.00 H new ATOM 430 N LEU A 26 -7.750 6.159 0.031 1.00 0.00 N ATOM 431 CA LEU A 26 -6.484 5.450 0.080 1.00 0.00 C ATOM 432 C LEU A 26 -5.504 6.027 -0.937 1.00 0.00 C ATOM 433 O LEU A 26 -4.334 6.230 -0.626 1.00 0.00 O ATOM 434 CB LEU A 26 -6.686 3.959 -0.167 1.00 0.00 C ATOM 435 CG LEU A 26 -7.510 3.201 0.880 1.00 0.00 C ATOM 436 CD1 LEU A 26 -7.671 1.755 0.474 1.00 0.00 C ATOM 437 CD2 LEU A 26 -6.861 3.289 2.256 1.00 0.00 C ATOM 0 H LEU A 26 -8.531 5.600 -0.312 1.00 0.00 H new ATOM 0 HA LEU A 26 -6.065 5.579 1.078 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.168 3.835 -1.137 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.705 3.488 -0.237 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.494 3.666 0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.258 1.229 1.227 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.182 1.702 -0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.689 1.289 0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.466 2.743 2.979 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.863 2.854 2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.789 4.334 2.558 1.00 0.00 H new ATOM 449 N LYS A 27 -5.991 6.300 -2.147 1.00 0.00 N ATOM 450 CA LYS A 27 -5.173 6.900 -3.197 1.00 0.00 C ATOM 451 C LYS A 27 -4.632 8.247 -2.746 1.00 0.00 C ATOM 452 O LYS A 27 -3.457 8.547 -2.927 1.00 0.00 O ATOM 453 CB LYS A 27 -5.985 7.117 -4.470 1.00 0.00 C ATOM 454 CG LYS A 27 -5.156 7.704 -5.607 1.00 0.00 C ATOM 455 CD LYS A 27 -6.006 8.184 -6.770 1.00 0.00 C ATOM 456 CE LYS A 27 -6.819 9.424 -6.396 1.00 0.00 C ATOM 457 NZ LYS A 27 -7.619 9.926 -7.537 1.00 0.00 N ATOM 0 H LYS A 27 -6.955 6.113 -2.424 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.352 6.212 -3.399 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.411 6.166 -4.790 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.820 7.783 -4.254 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.565 8.537 -5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -4.453 6.951 -5.964 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -5.364 8.411 -7.621 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -6.680 7.387 -7.083 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.482 9.186 -5.565 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.146 10.209 -6.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.155 10.767 -7.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.985 10.178 -8.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.280 9.186 -7.850 1.00 0.00 H new ATOM 471 N LYS A 28 -5.495 9.044 -2.138 1.00 0.00 N ATOM 472 CA LYS A 28 -5.108 10.355 -1.639 1.00 0.00 C ATOM 473 C LYS A 28 -4.052 10.224 -0.568 1.00 0.00 C ATOM 474 O LYS A 28 -3.144 11.061 -0.464 1.00 0.00 O ATOM 475 CB LYS A 28 -6.309 11.129 -1.114 1.00 0.00 C ATOM 476 CG LYS A 28 -7.353 11.400 -2.166 1.00 0.00 C ATOM 477 CD LYS A 28 -8.447 12.296 -1.644 1.00 0.00 C ATOM 478 CE LYS A 28 -9.477 12.556 -2.715 1.00 0.00 C ATOM 479 NZ LYS A 28 -10.411 13.625 -2.332 1.00 0.00 N ATOM 0 H LYS A 28 -6.473 8.805 -1.977 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.691 10.918 -2.474 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.764 10.569 -0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.968 12.077 -0.699 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -6.884 11.865 -3.033 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.784 10.457 -2.503 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.922 11.833 -0.780 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.021 13.240 -1.305 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.974 12.829 -3.643 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -10.035 11.640 -2.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.102 13.772 -3.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.910 13.354 -1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -9.883 14.506 -2.169 1.00 0.00 H new ATOM 493 N LYS A 29 -4.165 9.173 0.211 1.00 0.00 N ATOM 494 CA LYS A 29 -3.187 8.877 1.227 1.00 0.00 C ATOM 495 C LYS A 29 -1.845 8.536 0.632 1.00 0.00 C ATOM 496 O LYS A 29 -0.814 8.950 1.151 1.00 0.00 O ATOM 497 CB LYS A 29 -3.657 7.799 2.185 1.00 0.00 C ATOM 498 CG LYS A 29 -4.083 8.329 3.539 1.00 0.00 C ATOM 499 CD LYS A 29 -5.242 9.295 3.451 1.00 0.00 C ATOM 500 CE LYS A 29 -5.553 9.869 4.812 1.00 0.00 C ATOM 501 NZ LYS A 29 -4.427 10.680 5.349 1.00 0.00 N ATOM 0 H LYS A 29 -4.933 8.504 0.158 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.065 9.789 1.811 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -4.494 7.265 1.734 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.854 7.075 2.325 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.361 7.493 4.181 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.236 8.826 4.012 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.001 10.100 2.756 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.120 8.784 3.055 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.447 10.489 4.748 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.777 9.058 5.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.703 11.096 6.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.594 10.072 5.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.196 11.440 4.678 1.00 0.00 H new ATOM 515 N LEU A 30 -1.861 7.801 -0.452 1.00 0.00 N ATOM 516 CA LEU A 30 -0.662 7.475 -1.175 1.00 0.00 C ATOM 517 C LEU A 30 -0.011 8.751 -1.682 1.00 0.00 C ATOM 518 O LEU A 30 1.183 8.951 -1.525 1.00 0.00 O ATOM 519 CB LEU A 30 -0.998 6.549 -2.340 1.00 0.00 C ATOM 520 CG LEU A 30 -1.672 5.234 -1.954 1.00 0.00 C ATOM 521 CD1 LEU A 30 -2.031 4.420 -3.182 1.00 0.00 C ATOM 522 CD2 LEU A 30 -0.783 4.441 -1.013 1.00 0.00 C ATOM 0 H LEU A 30 -2.712 7.411 -0.858 1.00 0.00 H new ATOM 0 HA LEU A 30 0.036 6.963 -0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.650 7.083 -3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.078 6.322 -2.880 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.601 5.467 -1.434 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.509 3.490 -2.875 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.716 4.990 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.126 4.194 -3.746 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -1.277 3.507 -0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.165 4.223 -1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.598 5.023 -0.110 1.00 0.00 H new ATOM 534 N VAL A 31 -0.827 9.632 -2.228 1.00 0.00 N ATOM 535 CA VAL A 31 -0.358 10.891 -2.777 1.00 0.00 C ATOM 536 C VAL A 31 0.307 11.776 -1.699 1.00 0.00 C ATOM 537 O VAL A 31 1.398 12.316 -1.921 1.00 0.00 O ATOM 538 CB VAL A 31 -1.525 11.655 -3.473 1.00 0.00 C ATOM 539 CG1 VAL A 31 -1.076 13.008 -3.998 1.00 0.00 C ATOM 540 CG2 VAL A 31 -2.083 10.818 -4.606 1.00 0.00 C ATOM 0 H VAL A 31 -1.835 9.495 -2.304 1.00 0.00 H new ATOM 0 HA VAL A 31 0.402 10.659 -3.523 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.302 11.830 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -1.917 13.510 -4.476 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.713 13.617 -3.170 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.276 12.869 -4.725 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.898 11.357 -5.089 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.296 10.621 -5.334 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.456 9.873 -4.211 1.00 0.00 H new ATOM 550 N GLU A 32 -0.319 11.890 -0.536 1.00 0.00 N ATOM 551 CA GLU A 32 0.260 12.682 0.544 1.00 0.00 C ATOM 552 C GLU A 32 1.522 12.013 1.131 1.00 0.00 C ATOM 553 O GLU A 32 2.562 12.668 1.320 1.00 0.00 O ATOM 554 CB GLU A 32 -0.777 13.029 1.642 1.00 0.00 C ATOM 555 CG GLU A 32 -1.399 11.830 2.327 1.00 0.00 C ATOM 556 CD GLU A 32 -2.423 12.186 3.385 1.00 0.00 C ATOM 557 OE1 GLU A 32 -2.049 12.379 4.560 1.00 0.00 O ATOM 558 OE2 GLU A 32 -3.629 12.232 3.083 1.00 0.00 O ATOM 0 H GLU A 32 -1.214 11.452 -0.316 1.00 0.00 H new ATOM 0 HA GLU A 32 0.573 13.629 0.105 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -0.294 13.651 2.396 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -1.571 13.628 1.196 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -1.874 11.200 1.574 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -0.608 11.237 2.786 1.00 0.00 H new ATOM 565 N VAL A 33 1.457 10.705 1.320 1.00 0.00 N ATOM 566 CA VAL A 33 2.515 9.954 1.973 1.00 0.00 C ATOM 567 C VAL A 33 3.835 10.017 1.194 1.00 0.00 C ATOM 568 O VAL A 33 4.885 9.991 1.783 1.00 0.00 O ATOM 569 CB VAL A 33 2.116 8.484 2.308 1.00 0.00 C ATOM 570 CG1 VAL A 33 2.224 7.548 1.113 1.00 0.00 C ATOM 571 CG2 VAL A 33 2.891 7.971 3.511 1.00 0.00 C ATOM 0 H VAL A 33 0.666 10.133 1.024 1.00 0.00 H new ATOM 0 HA VAL A 33 2.675 10.450 2.931 1.00 0.00 H new ATOM 0 HB VAL A 33 1.058 8.497 2.572 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.933 6.541 1.412 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.564 7.895 0.318 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.252 7.536 0.752 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.594 6.944 3.724 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.959 8.003 3.296 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.676 8.598 4.377 1.00 0.00 H new ATOM 581 N LEU A 34 3.748 10.155 -0.130 1.00 0.00 N ATOM 582 CA LEU A 34 4.919 10.162 -1.034 1.00 0.00 C ATOM 583 C LEU A 34 5.998 11.171 -0.648 1.00 0.00 C ATOM 584 O LEU A 34 7.162 10.966 -0.991 1.00 0.00 O ATOM 585 CB LEU A 34 4.490 10.456 -2.466 1.00 0.00 C ATOM 586 CG LEU A 34 3.603 9.433 -3.138 1.00 0.00 C ATOM 587 CD1 LEU A 34 3.202 9.928 -4.513 1.00 0.00 C ATOM 588 CD2 LEU A 34 4.309 8.086 -3.227 1.00 0.00 C ATOM 0 H LEU A 34 2.859 10.267 -0.618 1.00 0.00 H new ATOM 0 HA LEU A 34 5.349 9.165 -0.945 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.970 11.414 -2.474 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.388 10.576 -3.071 1.00 0.00 H new ATOM 0 HG LEU A 34 2.702 9.296 -2.540 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.563 9.188 -4.994 1.00 0.00 H new ATOM 0 HD12 LEU A 34 2.660 10.869 -4.417 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.095 10.084 -5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.654 7.363 -3.714 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.226 8.193 -3.807 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.553 7.736 -2.224 1.00 0.00 H new ATOM 600 N GLU A 35 5.632 12.249 0.049 1.00 0.00 N ATOM 601 CA GLU A 35 6.636 13.243 0.448 1.00 0.00 C ATOM 602 C GLU A 35 7.630 12.646 1.462 1.00 0.00 C ATOM 603 O GLU A 35 8.793 13.056 1.544 1.00 0.00 O ATOM 604 CB GLU A 35 5.977 14.499 1.015 1.00 0.00 C ATOM 605 CG GLU A 35 5.129 14.252 2.244 1.00 0.00 C ATOM 606 CD GLU A 35 4.442 15.486 2.718 1.00 0.00 C ATOM 607 OE1 GLU A 35 3.310 15.766 2.262 1.00 0.00 O ATOM 608 OE2 GLU A 35 5.004 16.208 3.566 1.00 0.00 O ATOM 0 H GLU A 35 4.677 12.455 0.343 1.00 0.00 H new ATOM 0 HA GLU A 35 7.190 13.529 -0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.753 15.223 1.262 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.355 14.950 0.242 1.00 0.00 H new ATOM 0 HG2 GLU A 35 4.384 13.488 2.021 1.00 0.00 H new ATOM 0 HG3 GLU A 35 5.758 13.860 3.043 1.00 0.00 H new ATOM 615 N SER A 36 7.160 11.687 2.230 1.00 0.00 N ATOM 616 CA SER A 36 7.942 10.983 3.224 1.00 0.00 C ATOM 617 C SER A 36 7.273 9.644 3.518 1.00 0.00 C ATOM 618 O SER A 36 6.559 9.508 4.493 1.00 0.00 O ATOM 619 CB SER A 36 8.073 11.809 4.522 1.00 0.00 C ATOM 620 OG SER A 36 8.719 13.059 4.283 1.00 0.00 O ATOM 0 H SER A 36 6.193 11.366 2.178 1.00 0.00 H new ATOM 0 HA SER A 36 8.947 10.822 2.834 1.00 0.00 H new ATOM 0 HB2 SER A 36 7.084 11.984 4.944 1.00 0.00 H new ATOM 0 HB3 SER A 36 8.639 11.241 5.261 1.00 0.00 H new ATOM 0 HG SER A 36 8.947 13.133 3.333 1.00 0.00 H new ATOM 626 N PRO A 37 7.419 8.651 2.620 1.00 0.00 N ATOM 627 CA PRO A 37 6.783 7.354 2.810 1.00 0.00 C ATOM 628 C PRO A 37 7.508 6.528 3.856 1.00 0.00 C ATOM 629 O PRO A 37 6.919 5.674 4.512 1.00 0.00 O ATOM 630 CB PRO A 37 6.859 6.709 1.429 1.00 0.00 C ATOM 631 CG PRO A 37 8.054 7.325 0.791 1.00 0.00 C ATOM 632 CD PRO A 37 8.149 8.728 1.335 1.00 0.00 C ATOM 0 HA PRO A 37 5.760 7.436 3.177 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.963 5.626 1.502 1.00 0.00 H new ATOM 0 HB3 PRO A 37 5.956 6.904 0.850 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.955 6.757 1.023 1.00 0.00 H new ATOM 0 HG3 PRO A 37 7.954 7.335 -0.294 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.185 9.033 1.480 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.695 9.452 0.658 1.00 0.00 H new ATOM 640 N ARG A 38 8.781 6.829 4.042 1.00 0.00 N ATOM 641 CA ARG A 38 9.613 6.150 5.014 1.00 0.00 C ATOM 642 C ARG A 38 9.375 6.638 6.448 1.00 0.00 C ATOM 643 O ARG A 38 10.225 7.250 7.076 1.00 0.00 O ATOM 644 CB ARG A 38 11.111 6.130 4.599 1.00 0.00 C ATOM 645 CG ARG A 38 11.625 7.388 3.875 1.00 0.00 C ATOM 646 CD ARG A 38 11.515 8.654 4.706 1.00 0.00 C ATOM 647 NE ARG A 38 12.021 9.816 3.986 1.00 0.00 N ATOM 648 CZ ARG A 38 11.950 11.086 4.402 1.00 0.00 C ATOM 649 NH1 ARG A 38 11.377 11.382 5.567 1.00 0.00 N ATOM 650 NH2 ARG A 38 12.450 12.056 3.644 1.00 0.00 N ATOM 0 H ARG A 38 9.268 7.557 3.518 1.00 0.00 H new ATOM 0 HA ARG A 38 9.298 5.107 5.018 1.00 0.00 H new ATOM 0 HB2 ARG A 38 11.714 5.978 5.494 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.277 5.269 3.952 1.00 0.00 H new ATOM 0 HG2 ARG A 38 12.668 7.236 3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 38 11.063 7.520 2.950 1.00 0.00 H new ATOM 0 HD2 ARG A 38 10.473 8.821 4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 38 12.072 8.530 5.634 1.00 0.00 H new ATOM 0 HE ARG A 38 12.469 9.646 3.085 1.00 0.00 H new ATOM 0 HH11 ARG A 38 10.989 10.639 6.148 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.326 12.352 5.878 1.00 0.00 H new ATOM 0 HH21 ARG A 38 12.885 11.831 2.749 1.00 0.00 H new ATOM 0 HH22 ARG A 38 12.398 13.026 3.957 1.00 0.00 H new ATOM 664 N ILE A 39 8.176 6.431 6.898 1.00 0.00 N ATOM 665 CA ILE A 39 7.760 6.785 8.228 1.00 0.00 C ATOM 666 C ILE A 39 7.705 5.546 9.110 1.00 0.00 C ATOM 667 O ILE A 39 7.005 4.584 8.799 1.00 0.00 O ATOM 668 CB ILE A 39 6.374 7.497 8.203 1.00 0.00 C ATOM 669 CG1 ILE A 39 6.504 8.884 7.575 1.00 0.00 C ATOM 670 CG2 ILE A 39 5.759 7.586 9.589 1.00 0.00 C ATOM 671 CD1 ILE A 39 5.193 9.633 7.430 1.00 0.00 C ATOM 0 H ILE A 39 7.438 6.001 6.340 1.00 0.00 H new ATOM 0 HA ILE A 39 8.491 7.479 8.643 1.00 0.00 H new ATOM 0 HB ILE A 39 5.701 6.895 7.592 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.184 9.482 8.182 1.00 0.00 H new ATOM 0 HG13 ILE A 39 6.961 8.782 6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 39 4.794 8.089 9.527 1.00 0.00 H new ATOM 0 HG22 ILE A 39 5.620 6.582 9.991 1.00 0.00 H new ATOM 0 HG23 ILE A 39 6.421 8.151 10.245 1.00 0.00 H new ATOM 0 HD11 ILE A 39 5.378 10.606 6.976 1.00 0.00 H new ATOM 0 HD12 ILE A 39 4.515 9.061 6.797 1.00 0.00 H new ATOM 0 HD13 ILE A 39 4.742 9.771 8.413 1.00 0.00 H new ATOM 683 N GLU A 40 8.427 5.597 10.211 1.00 0.00 N ATOM 684 CA GLU A 40 8.501 4.518 11.195 1.00 0.00 C ATOM 685 C GLU A 40 7.118 4.119 11.725 1.00 0.00 C ATOM 686 O GLU A 40 6.837 2.943 11.941 1.00 0.00 O ATOM 687 CB GLU A 40 9.447 4.885 12.368 1.00 0.00 C ATOM 688 CG GLU A 40 9.054 6.113 13.216 1.00 0.00 C ATOM 689 CD GLU A 40 9.097 7.429 12.471 1.00 0.00 C ATOM 690 OE1 GLU A 40 10.207 7.949 12.209 1.00 0.00 O ATOM 691 OE2 GLU A 40 8.027 7.946 12.108 1.00 0.00 O ATOM 0 H GLU A 40 8.995 6.407 10.459 1.00 0.00 H new ATOM 0 HA GLU A 40 8.915 3.654 10.676 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.518 4.022 13.031 1.00 0.00 H new ATOM 0 HB3 GLU A 40 10.443 5.057 11.961 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.047 5.963 13.605 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.722 6.174 14.075 1.00 0.00 H new ATOM 698 N ALA A 41 6.249 5.101 11.873 1.00 0.00 N ATOM 699 CA ALA A 41 4.889 4.889 12.387 1.00 0.00 C ATOM 700 C ALA A 41 4.004 4.187 11.353 1.00 0.00 C ATOM 701 O ALA A 41 2.940 3.654 11.671 1.00 0.00 O ATOM 702 CB ALA A 41 4.272 6.217 12.794 1.00 0.00 C ATOM 0 H ALA A 41 6.456 6.073 11.643 1.00 0.00 H new ATOM 0 HA ALA A 41 4.956 4.242 13.262 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.264 6.049 13.174 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.881 6.678 13.572 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.228 6.878 11.929 1.00 0.00 H new ATOM 708 N ASN A 42 4.444 4.180 10.123 1.00 0.00 N ATOM 709 CA ASN A 42 3.687 3.541 9.071 1.00 0.00 C ATOM 710 C ASN A 42 4.330 2.232 8.705 1.00 0.00 C ATOM 711 O ASN A 42 3.770 1.461 7.970 1.00 0.00 O ATOM 712 CB ASN A 42 3.589 4.420 7.799 1.00 0.00 C ATOM 713 CG ASN A 42 2.811 5.714 7.977 1.00 0.00 C ATOM 714 OD1 ASN A 42 1.899 5.813 8.791 1.00 0.00 O ATOM 715 ND2 ASN A 42 3.160 6.716 7.213 1.00 0.00 N ATOM 0 H ASN A 42 5.320 4.607 9.822 1.00 0.00 H new ATOM 0 HA ASN A 42 2.678 3.383 9.453 1.00 0.00 H new ATOM 0 HB2 ASN A 42 4.597 4.662 7.463 1.00 0.00 H new ATOM 0 HB3 ASN A 42 3.120 3.837 7.006 1.00 0.00 H new ATOM 0 HD21 ASN A 42 2.670 7.608 7.286 1.00 0.00 H new ATOM 0 HD22 ASN A 42 3.922 6.606 6.544 1.00 0.00 H new ATOM 722 N LYS A 43 5.483 1.967 9.258 1.00 0.00 N ATOM 723 CA LYS A 43 6.261 0.841 8.887 1.00 0.00 C ATOM 724 C LYS A 43 5.882 -0.424 9.632 1.00 0.00 C ATOM 725 O LYS A 43 5.592 -0.397 10.834 1.00 0.00 O ATOM 726 CB LYS A 43 7.731 1.206 9.039 1.00 0.00 C ATOM 727 CG LYS A 43 8.676 0.056 9.113 1.00 0.00 C ATOM 728 CD LYS A 43 10.105 0.505 8.882 1.00 0.00 C ATOM 729 CE LYS A 43 10.373 0.737 7.403 1.00 0.00 C ATOM 730 NZ LYS A 43 11.722 1.265 7.135 1.00 0.00 N ATOM 0 H LYS A 43 5.904 2.542 9.988 1.00 0.00 H new ATOM 0 HA LYS A 43 6.057 0.597 7.844 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.019 1.836 8.198 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.846 1.806 9.941 1.00 0.00 H new ATOM 0 HG2 LYS A 43 8.596 -0.422 10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 43 8.402 -0.692 8.369 1.00 0.00 H new ATOM 0 HD2 LYS A 43 10.295 1.423 9.438 1.00 0.00 H new ATOM 0 HD3 LYS A 43 10.793 -0.248 9.266 1.00 0.00 H new ATOM 0 HE2 LYS A 43 10.244 -0.202 6.865 1.00 0.00 H new ATOM 0 HE3 LYS A 43 9.632 1.434 7.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 11.907 1.243 6.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 11.785 2.245 7.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 12.428 0.680 7.627 1.00 0.00 H new ATOM 744 N LEU A 44 5.853 -1.512 8.891 1.00 0.00 N ATOM 745 CA LEU A 44 5.579 -2.831 9.418 1.00 0.00 C ATOM 746 C LEU A 44 6.870 -3.440 9.911 1.00 0.00 C ATOM 747 O LEU A 44 7.868 -3.481 9.173 1.00 0.00 O ATOM 748 CB LEU A 44 5.008 -3.739 8.330 1.00 0.00 C ATOM 749 CG LEU A 44 3.697 -3.317 7.683 1.00 0.00 C ATOM 750 CD1 LEU A 44 3.308 -4.317 6.621 1.00 0.00 C ATOM 751 CD2 LEU A 44 2.606 -3.222 8.713 1.00 0.00 C ATOM 0 H LEU A 44 6.023 -1.503 7.885 1.00 0.00 H new ATOM 0 HA LEU A 44 4.855 -2.738 10.228 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.757 -3.834 7.543 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.868 -4.731 8.759 1.00 0.00 H new ATOM 0 HG LEU A 44 3.833 -2.336 7.228 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.369 -4.011 6.160 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.088 -4.362 5.861 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.186 -5.301 7.075 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.676 -2.919 8.231 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.469 -4.193 9.188 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.881 -2.485 9.467 1.00 0.00 H new ATOM 763 N ARG A 45 6.853 -3.920 11.115 1.00 0.00 N ATOM 764 CA ARG A 45 8.018 -4.514 11.711 1.00 0.00 C ATOM 765 C ARG A 45 8.256 -5.894 11.116 1.00 0.00 C ATOM 766 O ARG A 45 7.409 -6.787 11.244 1.00 0.00 O ATOM 767 CB ARG A 45 7.824 -4.660 13.211 1.00 0.00 C ATOM 768 CG ARG A 45 9.016 -5.259 13.927 1.00 0.00 C ATOM 769 CD ARG A 45 8.621 -5.802 15.280 1.00 0.00 C ATOM 770 NE ARG A 45 7.623 -6.877 15.141 1.00 0.00 N ATOM 771 CZ ARG A 45 7.651 -8.038 15.797 1.00 0.00 C ATOM 772 NH1 ARG A 45 8.541 -8.242 16.765 1.00 0.00 N ATOM 773 NH2 ARG A 45 6.773 -8.985 15.490 1.00 0.00 N ATOM 0 H ARG A 45 6.030 -3.913 11.718 1.00 0.00 H new ATOM 0 HA ARG A 45 8.874 -3.869 11.513 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.611 -3.680 13.637 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.950 -5.284 13.396 1.00 0.00 H new ATOM 0 HG2 ARG A 45 9.444 -6.058 13.322 1.00 0.00 H new ATOM 0 HG3 ARG A 45 9.790 -4.501 14.048 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.503 -6.183 15.796 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.214 -4.999 15.895 1.00 0.00 H new ATOM 0 HE ARG A 45 6.851 -6.721 14.493 1.00 0.00 H new ATOM 0 HH11 ARG A 45 9.207 -7.508 17.009 1.00 0.00 H new ATOM 0 HH12 ARG A 45 8.558 -9.132 17.263 1.00 0.00 H new ATOM 0 HH21 ARG A 45 6.083 -8.822 14.757 1.00 0.00 H new ATOM 0 HH22 ARG A 45 6.788 -9.875 15.987 1.00 0.00 H new ATOM 787 N GLY A 46 9.366 -6.050 10.448 1.00 0.00 N ATOM 788 CA GLY A 46 9.743 -7.337 9.925 1.00 0.00 C ATOM 789 C GLY A 46 9.543 -7.445 8.437 1.00 0.00 C ATOM 790 O GLY A 46 10.024 -8.388 7.804 1.00 0.00 O ATOM 0 H GLY A 46 10.028 -5.300 10.252 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.790 -7.527 10.161 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.159 -8.111 10.422 1.00 0.00 H new ATOM 794 N MET A 47 8.861 -6.492 7.866 1.00 0.00 N ATOM 795 CA MET A 47 8.588 -6.511 6.442 1.00 0.00 C ATOM 796 C MET A 47 9.530 -5.557 5.735 1.00 0.00 C ATOM 797 O MET A 47 9.763 -4.453 6.239 1.00 0.00 O ATOM 798 CB MET A 47 7.136 -6.120 6.170 1.00 0.00 C ATOM 799 CG MET A 47 6.102 -7.079 6.759 1.00 0.00 C ATOM 800 SD MET A 47 6.195 -8.750 6.059 1.00 0.00 S ATOM 801 CE MET A 47 5.758 -8.432 4.342 1.00 0.00 C ATOM 0 H MET A 47 8.479 -5.686 8.361 1.00 0.00 H new ATOM 0 HA MET A 47 8.746 -7.521 6.063 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.960 -5.123 6.573 1.00 0.00 H new ATOM 0 HB3 MET A 47 6.985 -6.059 5.092 1.00 0.00 H new ATOM 0 HG2 MET A 47 6.243 -7.136 7.838 1.00 0.00 H new ATOM 0 HG3 MET A 47 5.104 -6.676 6.588 1.00 0.00 H new ATOM 0 HE1 MET A 47 5.069 -9.201 3.994 1.00 0.00 H new ATOM 0 HE2 MET A 47 5.282 -7.455 4.263 1.00 0.00 H new ATOM 0 HE3 MET A 47 6.659 -8.447 3.728 1.00 0.00 H new ATOM 811 N PRO A 48 10.100 -5.956 4.575 1.00 0.00 N ATOM 812 CA PRO A 48 11.064 -5.130 3.822 1.00 0.00 C ATOM 813 C PRO A 48 10.460 -3.810 3.339 1.00 0.00 C ATOM 814 O PRO A 48 9.749 -3.772 2.317 1.00 0.00 O ATOM 815 CB PRO A 48 11.466 -6.013 2.635 1.00 0.00 C ATOM 816 CG PRO A 48 10.364 -7.010 2.507 1.00 0.00 C ATOM 817 CD PRO A 48 9.856 -7.248 3.899 1.00 0.00 C ATOM 0 HA PRO A 48 11.909 -4.837 4.445 1.00 0.00 H new ATOM 0 HB2 PRO A 48 11.574 -5.425 1.724 1.00 0.00 H new ATOM 0 HB3 PRO A 48 12.423 -6.503 2.814 1.00 0.00 H new ATOM 0 HG2 PRO A 48 9.571 -6.633 1.861 1.00 0.00 H new ATOM 0 HG3 PRO A 48 10.726 -7.936 2.060 1.00 0.00 H new ATOM 0 HD2 PRO A 48 8.798 -7.510 3.902 1.00 0.00 H new ATOM 0 HD3 PRO A 48 10.388 -8.064 4.387 1.00 0.00 H new ATOM 825 N ASP A 49 10.681 -2.763 4.148 1.00 0.00 N ATOM 826 CA ASP A 49 10.197 -1.395 3.909 1.00 0.00 C ATOM 827 C ASP A 49 8.759 -1.347 3.493 1.00 0.00 C ATOM 828 O ASP A 49 8.395 -0.655 2.544 1.00 0.00 O ATOM 829 CB ASP A 49 11.084 -0.594 2.947 1.00 0.00 C ATOM 830 CG ASP A 49 12.379 -0.175 3.585 1.00 0.00 C ATOM 831 OD1 ASP A 49 12.353 0.609 4.558 1.00 0.00 O ATOM 832 OD2 ASP A 49 13.458 -0.620 3.130 1.00 0.00 O ATOM 0 H ASP A 49 11.217 -2.847 5.012 1.00 0.00 H new ATOM 0 HA ASP A 49 10.266 -0.903 4.879 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.294 -1.196 2.063 1.00 0.00 H new ATOM 0 HB3 ASP A 49 10.544 0.291 2.609 1.00 0.00 H new ATOM 837 N CYS A 50 7.937 -2.081 4.199 1.00 0.00 N ATOM 838 CA CYS A 50 6.545 -2.082 3.915 1.00 0.00 C ATOM 839 C CYS A 50 5.856 -1.182 4.908 1.00 0.00 C ATOM 840 O CYS A 50 6.231 -1.138 6.095 1.00 0.00 O ATOM 841 CB CYS A 50 5.997 -3.499 3.970 1.00 0.00 C ATOM 842 SG CYS A 50 6.875 -4.651 2.885 1.00 0.00 S ATOM 0 H CYS A 50 8.219 -2.682 4.973 1.00 0.00 H new ATOM 0 HA CYS A 50 6.363 -1.706 2.908 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.053 -3.863 4.996 1.00 0.00 H new ATOM 0 HB3 CYS A 50 4.942 -3.484 3.695 1.00 0.00 H new ATOM 0 HG CYS A 50 8.021 -4.140 2.545 1.00 0.00 H new ATOM 848 N TYR A 51 4.886 -0.467 4.438 1.00 0.00 N ATOM 849 CA TYR A 51 4.193 0.501 5.222 1.00 0.00 C ATOM 850 C TYR A 51 2.709 0.307 5.060 1.00 0.00 C ATOM 851 O TYR A 51 2.246 -0.080 3.980 1.00 0.00 O ATOM 852 CB TYR A 51 4.590 1.929 4.787 1.00 0.00 C ATOM 853 CG TYR A 51 6.077 2.227 4.901 1.00 0.00 C ATOM 854 CD1 TYR A 51 6.943 1.904 3.875 1.00 0.00 C ATOM 855 CD2 TYR A 51 6.612 2.816 6.030 1.00 0.00 C ATOM 856 CE1 TYR A 51 8.292 2.155 3.973 1.00 0.00 C ATOM 857 CE2 TYR A 51 7.961 3.073 6.126 1.00 0.00 C ATOM 858 CZ TYR A 51 8.792 2.736 5.093 1.00 0.00 C ATOM 859 OH TYR A 51 10.142 2.975 5.193 1.00 0.00 O ATOM 0 H TYR A 51 4.547 -0.542 3.479 1.00 0.00 H new ATOM 0 HA TYR A 51 4.464 0.371 6.270 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.279 2.081 3.753 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.040 2.648 5.394 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.554 1.445 2.978 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.961 3.079 6.851 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.952 1.890 3.160 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.362 3.539 7.014 1.00 0.00 H new ATOM 0 HH TYR A 51 10.636 2.155 4.984 1.00 0.00 H new ATOM 869 N LYS A 52 1.975 0.561 6.114 1.00 0.00 N ATOM 870 CA LYS A 52 0.546 0.420 6.091 1.00 0.00 C ATOM 871 C LYS A 52 -0.110 1.762 6.302 1.00 0.00 C ATOM 872 O LYS A 52 0.380 2.600 7.075 1.00 0.00 O ATOM 873 CB LYS A 52 0.007 -0.596 7.156 1.00 0.00 C ATOM 874 CG LYS A 52 -0.026 -0.124 8.644 1.00 0.00 C ATOM 875 CD LYS A 52 1.357 0.110 9.234 1.00 0.00 C ATOM 876 CE LYS A 52 1.319 0.509 10.712 1.00 0.00 C ATOM 877 NZ LYS A 52 0.698 1.836 10.953 1.00 0.00 N ATOM 0 H LYS A 52 2.353 0.871 7.009 1.00 0.00 H new ATOM 0 HA LYS A 52 0.292 0.021 5.109 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.006 -0.879 6.870 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.618 -1.497 7.102 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -0.603 0.798 8.712 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -0.547 -0.871 9.243 1.00 0.00 H new ATOM 0 HD2 LYS A 52 1.951 -0.797 9.124 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.861 0.892 8.665 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.768 -0.248 11.270 1.00 0.00 H new ATOM 0 HE3 LYS A 52 2.336 0.516 11.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.427 2.508 11.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.265 2.182 10.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -0.033 1.749 11.688 1.00 0.00 H new ATOM 891 N ILE A 53 -1.165 1.983 5.600 1.00 0.00 N ATOM 892 CA ILE A 53 -1.987 3.139 5.802 1.00 0.00 C ATOM 893 C ILE A 53 -3.368 2.640 6.138 1.00 0.00 C ATOM 894 O ILE A 53 -3.826 1.656 5.553 1.00 0.00 O ATOM 895 CB ILE A 53 -2.049 4.067 4.551 1.00 0.00 C ATOM 896 CG1 ILE A 53 -0.635 4.541 4.171 1.00 0.00 C ATOM 897 CG2 ILE A 53 -2.969 5.269 4.822 1.00 0.00 C ATOM 898 CD1 ILE A 53 -0.582 5.443 2.955 1.00 0.00 C ATOM 0 H ILE A 53 -1.491 1.363 4.859 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.561 3.743 6.603 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.461 3.502 3.715 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.202 5.070 5.020 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.009 3.667 3.988 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.002 5.908 3.940 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.974 4.914 5.051 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.584 5.838 5.668 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.451 5.729 2.759 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.982 4.912 2.091 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.178 6.337 3.139 1.00 0.00 H new ATOM 910 N LYS A 54 -4.001 3.265 7.086 1.00 0.00 N ATOM 911 CA LYS A 54 -5.316 2.868 7.484 1.00 0.00 C ATOM 912 C LYS A 54 -6.290 3.996 7.275 1.00 0.00 C ATOM 913 O LYS A 54 -6.000 5.155 7.605 1.00 0.00 O ATOM 914 CB LYS A 54 -5.388 2.283 8.926 1.00 0.00 C ATOM 915 CG LYS A 54 -5.161 3.246 10.084 1.00 0.00 C ATOM 916 CD LYS A 54 -3.775 3.847 10.094 1.00 0.00 C ATOM 917 CE LYS A 54 -3.601 4.698 11.292 1.00 0.00 C ATOM 918 NZ LYS A 54 -2.268 5.336 11.334 1.00 0.00 N ATOM 0 H LYS A 54 -3.622 4.059 7.602 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.604 2.039 6.837 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.369 1.825 9.055 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.651 1.484 9.003 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -5.897 4.048 10.031 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.329 2.720 11.024 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.026 3.055 10.089 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.620 4.439 9.192 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -4.372 5.469 11.303 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -3.741 4.094 12.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -2.191 5.922 12.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -1.532 4.601 11.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.143 5.934 10.492 1.00 0.00 H new ATOM 932 N LEU A 55 -7.398 3.679 6.678 1.00 0.00 N ATOM 933 CA LEU A 55 -8.433 4.642 6.411 1.00 0.00 C ATOM 934 C LEU A 55 -9.265 4.732 7.683 1.00 0.00 C ATOM 935 O LEU A 55 -9.870 3.739 8.089 1.00 0.00 O ATOM 936 CB LEU A 55 -9.272 4.146 5.219 1.00 0.00 C ATOM 937 CG LEU A 55 -9.974 5.202 4.346 1.00 0.00 C ATOM 938 CD1 LEU A 55 -10.659 4.531 3.188 1.00 0.00 C ATOM 939 CD2 LEU A 55 -10.978 6.020 5.124 1.00 0.00 C ATOM 0 H LEU A 55 -7.616 2.735 6.357 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.041 5.625 6.151 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.621 3.557 4.573 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.035 3.470 5.605 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.205 5.886 3.985 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.154 5.282 2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.921 3.999 2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -11.399 3.824 3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.444 6.750 4.462 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -11.743 5.362 5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.472 6.540 5.937 1.00 0.00 H new ATOM 951 N ARG A 56 -9.286 5.912 8.282 1.00 0.00 N ATOM 952 CA ARG A 56 -9.861 6.149 9.612 1.00 0.00 C ATOM 953 C ARG A 56 -11.295 5.628 9.778 1.00 0.00 C ATOM 954 O ARG A 56 -11.558 4.823 10.671 1.00 0.00 O ATOM 955 CB ARG A 56 -9.779 7.642 9.970 1.00 0.00 C ATOM 956 CG ARG A 56 -10.227 7.999 11.388 1.00 0.00 C ATOM 957 CD ARG A 56 -9.327 7.365 12.443 1.00 0.00 C ATOM 958 NE ARG A 56 -7.921 7.772 12.283 1.00 0.00 N ATOM 959 CZ ARG A 56 -6.942 7.538 13.164 1.00 0.00 C ATOM 960 NH1 ARG A 56 -7.201 6.933 14.325 1.00 0.00 N ATOM 961 NH2 ARG A 56 -5.708 7.925 12.884 1.00 0.00 N ATOM 0 H ARG A 56 -8.898 6.753 7.855 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.257 5.569 10.309 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -8.750 7.975 9.837 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.389 8.203 9.262 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.221 9.082 11.509 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.254 7.667 11.539 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.676 7.649 13.436 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.400 6.279 12.378 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.673 8.274 11.430 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.153 6.644 14.548 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -6.447 6.760 14.989 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.509 8.398 12.002 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.955 7.751 13.550 1.00 0.00 H new ATOM 975 N SER A 57 -12.208 6.076 8.946 1.00 0.00 N ATOM 976 CA SER A 57 -13.592 5.667 9.096 1.00 0.00 C ATOM 977 C SER A 57 -13.830 4.242 8.597 1.00 0.00 C ATOM 978 O SER A 57 -14.354 3.400 9.335 1.00 0.00 O ATOM 979 CB SER A 57 -14.536 6.649 8.394 1.00 0.00 C ATOM 980 OG SER A 57 -15.893 6.311 8.631 1.00 0.00 O ATOM 0 H SER A 57 -12.026 6.713 8.170 1.00 0.00 H new ATOM 0 HA SER A 57 -13.811 5.679 10.164 1.00 0.00 H new ATOM 0 HB2 SER A 57 -14.343 7.661 8.749 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.339 6.645 7.322 1.00 0.00 H new ATOM 0 HG SER A 57 -16.475 6.953 8.174 1.00 0.00 H new ATOM 986 N SER A 58 -13.438 3.976 7.367 1.00 0.00 N ATOM 987 CA SER A 58 -13.698 2.707 6.717 1.00 0.00 C ATOM 988 C SER A 58 -12.999 1.513 7.407 1.00 0.00 C ATOM 989 O SER A 58 -13.545 0.409 7.439 1.00 0.00 O ATOM 990 CB SER A 58 -13.258 2.819 5.279 1.00 0.00 C ATOM 991 OG SER A 58 -13.728 4.030 4.726 1.00 0.00 O ATOM 0 H SER A 58 -12.926 4.640 6.786 1.00 0.00 H new ATOM 0 HA SER A 58 -14.766 2.502 6.785 1.00 0.00 H new ATOM 0 HB2 SER A 58 -12.170 2.779 5.218 1.00 0.00 H new ATOM 0 HB3 SER A 58 -13.640 1.975 4.706 1.00 0.00 H new ATOM 0 HG SER A 58 -13.578 4.027 3.758 1.00 0.00 H new ATOM 997 N GLY A 59 -11.806 1.734 7.945 1.00 0.00 N ATOM 998 CA GLY A 59 -11.096 0.661 8.603 1.00 0.00 C ATOM 999 C GLY A 59 -10.362 -0.230 7.622 1.00 0.00 C ATOM 1000 O GLY A 59 -10.137 -1.423 7.879 1.00 0.00 O ATOM 0 H GLY A 59 -11.322 2.632 7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -10.383 1.081 9.312 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -11.801 0.061 9.178 1.00 0.00 H new ATOM 1004 N TYR A 60 -10.007 0.325 6.500 1.00 0.00 N ATOM 1005 CA TYR A 60 -9.269 -0.406 5.495 1.00 0.00 C ATOM 1006 C TYR A 60 -7.799 -0.138 5.650 1.00 0.00 C ATOM 1007 O TYR A 60 -7.406 0.930 6.123 1.00 0.00 O ATOM 1008 CB TYR A 60 -9.725 -0.045 4.081 1.00 0.00 C ATOM 1009 CG TYR A 60 -11.049 -0.654 3.667 1.00 0.00 C ATOM 1010 CD1 TYR A 60 -12.240 -0.247 4.237 1.00 0.00 C ATOM 1011 CD2 TYR A 60 -11.099 -1.632 2.684 1.00 0.00 C ATOM 1012 CE1 TYR A 60 -13.442 -0.791 3.846 1.00 0.00 C ATOM 1013 CE2 TYR A 60 -12.302 -2.177 2.282 1.00 0.00 C ATOM 1014 CZ TYR A 60 -13.468 -1.751 2.865 1.00 0.00 C ATOM 1015 OH TYR A 60 -14.671 -2.280 2.459 1.00 0.00 O ATOM 0 H TYR A 60 -10.216 1.292 6.250 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.465 -1.468 5.641 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -9.800 1.040 4.004 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -8.958 -0.362 3.375 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.227 0.513 5.004 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.182 -1.972 2.226 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -14.361 -0.464 4.309 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -12.325 -2.935 1.513 1.00 0.00 H new ATOM 0 HH TYR A 60 -14.515 -2.946 1.757 1.00 0.00 H new ATOM 1025 N ARG A 61 -7.001 -1.096 5.282 1.00 0.00 N ATOM 1026 CA ARG A 61 -5.567 -0.999 5.372 1.00 0.00 C ATOM 1027 C ARG A 61 -4.955 -1.237 4.005 1.00 0.00 C ATOM 1028 O ARG A 61 -5.439 -2.070 3.237 1.00 0.00 O ATOM 1029 CB ARG A 61 -4.964 -2.009 6.381 1.00 0.00 C ATOM 1030 CG ARG A 61 -5.135 -1.699 7.882 1.00 0.00 C ATOM 1031 CD ARG A 61 -6.568 -1.832 8.403 1.00 0.00 C ATOM 1032 NE ARG A 61 -6.601 -1.672 9.866 1.00 0.00 N ATOM 1033 CZ ARG A 61 -7.648 -1.932 10.686 1.00 0.00 C ATOM 1034 NH1 ARG A 61 -8.851 -2.218 10.199 1.00 0.00 N ATOM 1035 NH2 ARG A 61 -7.489 -1.849 11.991 1.00 0.00 N ATOM 0 H ARG A 61 -7.330 -1.984 4.904 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.334 0.004 5.730 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.407 -2.986 6.186 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.897 -2.096 6.174 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.492 -2.368 8.453 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.787 -0.684 8.071 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -7.203 -1.080 7.935 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -6.972 -2.806 8.128 1.00 0.00 H new ATOM 0 HE ARG A 61 -5.748 -1.330 10.308 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -9.000 -2.245 9.190 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -9.626 -2.411 10.834 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -6.582 -1.590 12.379 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -8.273 -2.043 12.614 1.00 0.00 H new ATOM 1049 N LEU A 62 -3.934 -0.503 3.703 1.00 0.00 N ATOM 1050 CA LEU A 62 -3.213 -0.640 2.463 1.00 0.00 C ATOM 1051 C LEU A 62 -1.747 -0.833 2.809 1.00 0.00 C ATOM 1052 O LEU A 62 -1.218 -0.095 3.640 1.00 0.00 O ATOM 1053 CB LEU A 62 -3.448 0.625 1.593 1.00 0.00 C ATOM 1054 CG LEU A 62 -2.901 0.633 0.143 1.00 0.00 C ATOM 1055 CD1 LEU A 62 -3.569 1.736 -0.648 1.00 0.00 C ATOM 1056 CD2 LEU A 62 -1.397 0.851 0.110 1.00 0.00 C ATOM 0 H LEU A 62 -3.565 0.224 4.316 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.557 -1.497 1.884 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.523 0.799 1.544 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.011 1.475 2.118 1.00 0.00 H new ATOM 0 HG LEU A 62 -3.120 -0.340 -0.296 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.182 1.739 -1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.646 1.568 -0.669 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.361 2.698 -0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.052 0.850 -0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.158 1.809 0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.901 0.050 0.659 1.00 0.00 H new ATOM 1068 N VAL A 63 -1.108 -1.826 2.207 1.00 0.00 N ATOM 1069 CA VAL A 63 0.290 -2.116 2.481 1.00 0.00 C ATOM 1070 C VAL A 63 1.115 -2.048 1.191 1.00 0.00 C ATOM 1071 O VAL A 63 0.837 -2.762 0.200 1.00 0.00 O ATOM 1072 CB VAL A 63 0.474 -3.513 3.162 1.00 0.00 C ATOM 1073 CG1 VAL A 63 1.944 -3.797 3.457 1.00 0.00 C ATOM 1074 CG2 VAL A 63 -0.332 -3.599 4.450 1.00 0.00 C ATOM 0 H VAL A 63 -1.539 -2.447 1.522 1.00 0.00 H new ATOM 0 HA VAL A 63 0.648 -1.357 3.177 1.00 0.00 H new ATOM 0 HB VAL A 63 0.108 -4.265 2.463 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.038 -4.775 3.930 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.510 -3.788 2.526 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.335 -3.031 4.127 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -0.188 -4.579 4.905 1.00 0.00 H new ATOM 0 HG22 VAL A 63 0.003 -2.826 5.141 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -1.389 -3.454 4.228 1.00 0.00 H new ATOM 1084 N TYR A 64 2.112 -1.205 1.206 1.00 0.00 N ATOM 1085 CA TYR A 64 2.998 -1.014 0.080 1.00 0.00 C ATOM 1086 C TYR A 64 4.425 -1.062 0.563 1.00 0.00 C ATOM 1087 O TYR A 64 4.674 -0.856 1.743 1.00 0.00 O ATOM 1088 CB TYR A 64 2.723 0.343 -0.620 1.00 0.00 C ATOM 1089 CG TYR A 64 2.939 1.580 0.244 1.00 0.00 C ATOM 1090 CD1 TYR A 64 4.202 2.143 0.393 1.00 0.00 C ATOM 1091 CD2 TYR A 64 1.880 2.179 0.903 1.00 0.00 C ATOM 1092 CE1 TYR A 64 4.398 3.254 1.175 1.00 0.00 C ATOM 1093 CE2 TYR A 64 2.068 3.296 1.683 1.00 0.00 C ATOM 1094 CZ TYR A 64 3.331 3.827 1.816 1.00 0.00 C ATOM 1095 OH TYR A 64 3.529 4.922 2.609 1.00 0.00 O ATOM 0 H TYR A 64 2.338 -0.621 2.011 1.00 0.00 H new ATOM 0 HA TYR A 64 2.823 -1.809 -0.645 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.366 0.417 -1.497 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.693 0.346 -0.978 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.044 1.698 -0.116 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.889 1.762 0.803 1.00 0.00 H new ATOM 0 HE1 TYR A 64 5.387 3.674 1.284 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.230 3.754 2.188 1.00 0.00 H new ATOM 0 HH TYR A 64 4.289 5.439 2.269 1.00 0.00 H new ATOM 1105 N GLN A 65 5.341 -1.347 -0.311 1.00 0.00 N ATOM 1106 CA GLN A 65 6.732 -1.288 0.038 1.00 0.00 C ATOM 1107 C GLN A 65 7.394 -0.175 -0.723 1.00 0.00 C ATOM 1108 O GLN A 65 7.090 0.059 -1.895 1.00 0.00 O ATOM 1109 CB GLN A 65 7.478 -2.607 -0.185 1.00 0.00 C ATOM 1110 CG GLN A 65 7.449 -3.134 -1.609 1.00 0.00 C ATOM 1111 CD GLN A 65 8.432 -4.267 -1.837 1.00 0.00 C ATOM 1112 OE1 GLN A 65 8.920 -4.457 -2.946 1.00 0.00 O ATOM 1113 NE2 GLN A 65 8.779 -4.989 -0.791 1.00 0.00 N ATOM 0 H GLN A 65 5.152 -1.624 -1.274 1.00 0.00 H new ATOM 0 HA GLN A 65 6.781 -1.095 1.110 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.517 -2.473 0.115 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.051 -3.363 0.474 1.00 0.00 H new ATOM 0 HG2 GLN A 65 6.442 -3.480 -1.843 1.00 0.00 H new ATOM 0 HG3 GLN A 65 7.674 -2.320 -2.298 1.00 0.00 H new ATOM 0 HE21 GLN A 65 8.355 -4.806 0.118 1.00 0.00 H new ATOM 0 HE22 GLN A 65 9.472 -5.731 -0.891 1.00 0.00 H new ATOM 1122 N VAL A 66 8.252 0.522 -0.067 1.00 0.00 N ATOM 1123 CA VAL A 66 8.961 1.601 -0.683 1.00 0.00 C ATOM 1124 C VAL A 66 10.217 1.070 -1.315 1.00 0.00 C ATOM 1125 O VAL A 66 11.119 0.598 -0.619 1.00 0.00 O ATOM 1126 CB VAL A 66 9.316 2.718 0.338 1.00 0.00 C ATOM 1127 CG1 VAL A 66 10.189 3.794 -0.291 1.00 0.00 C ATOM 1128 CG2 VAL A 66 8.059 3.343 0.885 1.00 0.00 C ATOM 0 H VAL A 66 8.487 0.365 0.913 1.00 0.00 H new ATOM 0 HA VAL A 66 8.315 2.043 -1.441 1.00 0.00 H new ATOM 0 HB VAL A 66 9.877 2.255 1.150 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.417 4.558 0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.117 3.347 -0.648 1.00 0.00 H new ATOM 0 HG13 VAL A 66 9.659 4.249 -1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 66 8.322 4.124 1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 66 7.483 3.777 0.068 1.00 0.00 H new ATOM 0 HG23 VAL A 66 7.461 2.581 1.385 1.00 0.00 H new ATOM 1138 N ILE A 67 10.266 1.099 -2.618 1.00 0.00 N ATOM 1139 CA ILE A 67 11.450 0.708 -3.302 1.00 0.00 C ATOM 1140 C ILE A 67 12.175 1.985 -3.643 1.00 0.00 C ATOM 1141 O ILE A 67 11.871 2.649 -4.644 1.00 0.00 O ATOM 1142 CB ILE A 67 11.156 -0.068 -4.604 1.00 0.00 C ATOM 1143 CG1 ILE A 67 10.102 -1.156 -4.360 1.00 0.00 C ATOM 1144 CG2 ILE A 67 12.452 -0.701 -5.114 1.00 0.00 C ATOM 1145 CD1 ILE A 67 9.650 -1.857 -5.622 1.00 0.00 C ATOM 0 H ILE A 67 9.496 1.390 -3.220 1.00 0.00 H new ATOM 0 HA ILE A 67 12.034 0.041 -2.668 1.00 0.00 H new ATOM 0 HB ILE A 67 10.765 0.624 -5.350 1.00 0.00 H new ATOM 0 HG12 ILE A 67 10.508 -1.895 -3.670 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.236 -0.708 -3.873 1.00 0.00 H new ATOM 0 HG21 ILE A 67 12.251 -1.251 -6.034 1.00 0.00 H new ATOM 0 HG22 ILE A 67 13.186 0.081 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 67 12.844 -1.385 -4.361 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.905 -2.612 -5.372 1.00 0.00 H new ATOM 0 HD12 ILE A 67 9.213 -1.129 -6.306 1.00 0.00 H new ATOM 0 HD13 ILE A 67 10.506 -2.335 -6.099 1.00 0.00 H new ATOM 1157 N ASP A 68 13.100 2.349 -2.804 1.00 0.00 N ATOM 1158 CA ASP A 68 13.823 3.603 -2.949 1.00 0.00 C ATOM 1159 C ASP A 68 14.759 3.539 -4.132 1.00 0.00 C ATOM 1160 O ASP A 68 14.968 4.540 -4.823 1.00 0.00 O ATOM 1161 CB ASP A 68 14.576 3.945 -1.664 1.00 0.00 C ATOM 1162 CG ASP A 68 15.338 5.253 -1.746 1.00 0.00 C ATOM 1163 OD1 ASP A 68 16.496 5.250 -2.232 1.00 0.00 O ATOM 1164 OD2 ASP A 68 14.807 6.297 -1.289 1.00 0.00 O ATOM 0 H ASP A 68 13.383 1.794 -1.997 1.00 0.00 H new ATOM 0 HA ASP A 68 13.102 4.400 -3.133 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.867 3.997 -0.838 1.00 0.00 H new ATOM 0 HB3 ASP A 68 15.274 3.140 -1.435 1.00 0.00 H new ATOM 1169 N GLU A 69 15.267 2.342 -4.396 1.00 0.00 N ATOM 1170 CA GLU A 69 16.145 2.098 -5.532 1.00 0.00 C ATOM 1171 C GLU A 69 15.450 2.422 -6.847 1.00 0.00 C ATOM 1172 O GLU A 69 16.064 2.917 -7.776 1.00 0.00 O ATOM 1173 CB GLU A 69 16.594 0.645 -5.574 1.00 0.00 C ATOM 1174 CG GLU A 69 17.432 0.195 -4.401 1.00 0.00 C ATOM 1175 CD GLU A 69 17.949 -1.203 -4.604 1.00 0.00 C ATOM 1176 OE1 GLU A 69 19.022 -1.356 -5.217 1.00 0.00 O ATOM 1177 OE2 GLU A 69 17.283 -2.173 -4.181 1.00 0.00 O ATOM 0 H GLU A 69 15.082 1.514 -3.829 1.00 0.00 H new ATOM 0 HA GLU A 69 17.010 2.749 -5.406 1.00 0.00 H new ATOM 0 HB2 GLU A 69 15.710 0.010 -5.633 1.00 0.00 H new ATOM 0 HB3 GLU A 69 17.163 0.484 -6.489 1.00 0.00 H new ATOM 0 HG2 GLU A 69 18.270 0.879 -4.266 1.00 0.00 H new ATOM 0 HG3 GLU A 69 16.837 0.236 -3.489 1.00 0.00 H new ATOM 1184 N LYS A 70 14.166 2.150 -6.912 1.00 0.00 N ATOM 1185 CA LYS A 70 13.415 2.360 -8.134 1.00 0.00 C ATOM 1186 C LYS A 70 12.537 3.605 -8.030 1.00 0.00 C ATOM 1187 O LYS A 70 11.847 3.965 -8.975 1.00 0.00 O ATOM 1188 CB LYS A 70 12.597 1.107 -8.466 1.00 0.00 C ATOM 1189 CG LYS A 70 13.467 -0.131 -8.674 1.00 0.00 C ATOM 1190 CD LYS A 70 12.646 -1.388 -8.911 1.00 0.00 C ATOM 1191 CE LYS A 70 13.555 -2.605 -9.033 1.00 0.00 C ATOM 1192 NZ LYS A 70 12.802 -3.862 -9.163 1.00 0.00 N ATOM 0 H LYS A 70 13.618 1.783 -6.134 1.00 0.00 H new ATOM 0 HA LYS A 70 14.112 2.534 -8.954 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.889 0.917 -7.659 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.011 1.289 -9.367 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.128 0.033 -9.525 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.102 -0.275 -7.800 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.945 -1.532 -8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 70 12.054 -1.277 -9.819 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.205 -2.483 -9.900 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.200 -2.661 -8.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 13.466 -4.658 -9.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 12.201 -3.995 -8.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 12.205 -3.823 -10.014 1.00 0.00 H new ATOM 1206 N VAL A 71 12.587 4.254 -6.856 1.00 0.00 N ATOM 1207 CA VAL A 71 11.855 5.511 -6.561 1.00 0.00 C ATOM 1208 C VAL A 71 10.319 5.296 -6.736 1.00 0.00 C ATOM 1209 O VAL A 71 9.557 6.197 -7.078 1.00 0.00 O ATOM 1210 CB VAL A 71 12.389 6.702 -7.459 1.00 0.00 C ATOM 1211 CG1 VAL A 71 11.841 8.057 -7.005 1.00 0.00 C ATOM 1212 CG2 VAL A 71 13.916 6.742 -7.457 1.00 0.00 C ATOM 0 H VAL A 71 13.143 3.921 -6.069 1.00 0.00 H new ATOM 0 HA VAL A 71 12.037 5.787 -5.522 1.00 0.00 H new ATOM 0 HB VAL A 71 12.032 6.515 -8.472 1.00 0.00 H new ATOM 0 HG11 VAL A 71 12.234 8.843 -7.650 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.753 8.048 -7.066 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.145 8.246 -5.976 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.259 7.568 -8.080 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.275 6.883 -6.438 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.305 5.803 -7.852 1.00 0.00 H new ATOM 1222 N VAL A 72 9.871 4.113 -6.425 1.00 0.00 N ATOM 1223 CA VAL A 72 8.483 3.774 -6.594 1.00 0.00 C ATOM 1224 C VAL A 72 8.011 2.958 -5.403 1.00 0.00 C ATOM 1225 O VAL A 72 8.777 2.165 -4.842 1.00 0.00 O ATOM 1226 CB VAL A 72 8.244 2.997 -7.944 1.00 0.00 C ATOM 1227 CG1 VAL A 72 8.997 1.683 -7.997 1.00 0.00 C ATOM 1228 CG2 VAL A 72 6.768 2.775 -8.226 1.00 0.00 C ATOM 0 H VAL A 72 10.450 3.361 -6.050 1.00 0.00 H new ATOM 0 HA VAL A 72 7.901 4.694 -6.646 1.00 0.00 H new ATOM 0 HB VAL A 72 8.643 3.639 -8.729 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.798 1.188 -8.947 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.066 1.872 -7.903 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.669 1.042 -7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.654 2.236 -9.167 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.327 2.192 -7.418 1.00 0.00 H new ATOM 0 HG23 VAL A 72 6.262 3.738 -8.296 1.00 0.00 H new ATOM 1238 N VAL A 73 6.810 3.202 -4.959 1.00 0.00 N ATOM 1239 CA VAL A 73 6.256 2.433 -3.933 1.00 0.00 C ATOM 1240 C VAL A 73 5.356 1.384 -4.567 1.00 0.00 C ATOM 1241 O VAL A 73 4.517 1.685 -5.434 1.00 0.00 O ATOM 1242 CB VAL A 73 5.512 3.286 -2.867 1.00 0.00 C ATOM 1243 CG1 VAL A 73 6.418 4.358 -2.293 1.00 0.00 C ATOM 1244 CG2 VAL A 73 4.222 3.894 -3.376 1.00 0.00 C ATOM 0 H VAL A 73 6.205 3.944 -5.312 1.00 0.00 H new ATOM 0 HA VAL A 73 7.058 1.946 -3.378 1.00 0.00 H new ATOM 0 HB VAL A 73 5.235 2.594 -2.072 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.870 4.938 -1.551 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.282 3.890 -1.822 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.754 5.018 -3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.755 4.476 -2.581 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.436 4.545 -4.224 1.00 0.00 H new ATOM 0 HG23 VAL A 73 3.545 3.100 -3.690 1.00 0.00 H new ATOM 1254 N PHE A 74 5.575 0.178 -4.199 1.00 0.00 N ATOM 1255 CA PHE A 74 4.879 -0.931 -4.766 1.00 0.00 C ATOM 1256 C PHE A 74 3.818 -1.403 -3.802 1.00 0.00 C ATOM 1257 O PHE A 74 4.134 -1.921 -2.730 1.00 0.00 O ATOM 1258 CB PHE A 74 5.905 -2.039 -5.069 1.00 0.00 C ATOM 1259 CG PHE A 74 5.347 -3.327 -5.600 1.00 0.00 C ATOM 1260 CD1 PHE A 74 4.891 -3.419 -6.899 1.00 0.00 C ATOM 1261 CD2 PHE A 74 5.310 -4.455 -4.800 1.00 0.00 C ATOM 1262 CE1 PHE A 74 4.406 -4.610 -7.389 1.00 0.00 C ATOM 1263 CE2 PHE A 74 4.823 -5.648 -5.283 1.00 0.00 C ATOM 1264 CZ PHE A 74 4.372 -5.725 -6.579 1.00 0.00 C ATOM 0 H PHE A 74 6.254 -0.079 -3.483 1.00 0.00 H new ATOM 0 HA PHE A 74 4.381 -0.649 -5.694 1.00 0.00 H new ATOM 0 HB2 PHE A 74 6.624 -1.653 -5.791 1.00 0.00 H new ATOM 0 HB3 PHE A 74 6.457 -2.255 -4.154 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.915 -2.548 -7.537 1.00 0.00 H new ATOM 0 HD2 PHE A 74 5.668 -4.399 -3.783 1.00 0.00 H new ATOM 0 HE1 PHE A 74 4.052 -4.671 -8.408 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.795 -6.520 -4.646 1.00 0.00 H new ATOM 0 HZ PHE A 74 3.991 -6.660 -6.963 1.00 0.00 H new ATOM 1274 N VAL A 75 2.571 -1.181 -4.151 1.00 0.00 N ATOM 1275 CA VAL A 75 1.473 -1.637 -3.338 1.00 0.00 C ATOM 1276 C VAL A 75 1.344 -3.123 -3.548 1.00 0.00 C ATOM 1277 O VAL A 75 1.138 -3.585 -4.679 1.00 0.00 O ATOM 1278 CB VAL A 75 0.140 -0.923 -3.704 1.00 0.00 C ATOM 1279 CG1 VAL A 75 -1.005 -1.403 -2.812 1.00 0.00 C ATOM 1280 CG2 VAL A 75 0.295 0.593 -3.603 1.00 0.00 C ATOM 0 H VAL A 75 2.294 -0.684 -4.998 1.00 0.00 H new ATOM 0 HA VAL A 75 1.673 -1.402 -2.293 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.104 -1.179 -4.735 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.924 -0.887 -3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.139 -2.477 -2.939 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.769 -1.187 -1.770 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.648 1.073 -3.863 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.571 0.863 -2.584 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.073 0.926 -4.290 1.00 0.00 H new ATOM 1290 N ILE A 76 1.466 -3.865 -2.481 1.00 0.00 N ATOM 1291 CA ILE A 76 1.483 -5.301 -2.578 1.00 0.00 C ATOM 1292 C ILE A 76 0.089 -5.840 -2.344 1.00 0.00 C ATOM 1293 O ILE A 76 -0.369 -6.750 -3.033 1.00 0.00 O ATOM 1294 CB ILE A 76 2.439 -5.926 -1.525 1.00 0.00 C ATOM 1295 CG1 ILE A 76 3.802 -5.217 -1.536 1.00 0.00 C ATOM 1296 CG2 ILE A 76 2.628 -7.412 -1.824 1.00 0.00 C ATOM 1297 CD1 ILE A 76 4.750 -5.687 -0.450 1.00 0.00 C ATOM 0 H ILE A 76 1.555 -3.499 -1.533 1.00 0.00 H new ATOM 0 HA ILE A 76 1.835 -5.566 -3.575 1.00 0.00 H new ATOM 0 HB ILE A 76 1.995 -5.804 -0.537 1.00 0.00 H new ATOM 0 HG12 ILE A 76 4.273 -5.372 -2.507 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.643 -4.144 -1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 76 3.299 -7.849 -1.085 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.663 -7.917 -1.782 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.057 -7.531 -2.819 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.689 -5.139 -0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.302 -5.507 0.527 1.00 0.00 H new ATOM 0 HD13 ILE A 76 4.941 -6.753 -0.570 1.00 0.00 H new ATOM 1309 N SER A 77 -0.588 -5.281 -1.369 1.00 0.00 N ATOM 1310 CA SER A 77 -1.917 -5.707 -1.016 1.00 0.00 C ATOM 1311 C SER A 77 -2.681 -4.557 -0.387 1.00 0.00 C ATOM 1312 O SER A 77 -2.079 -3.633 0.185 1.00 0.00 O ATOM 1313 CB SER A 77 -1.855 -6.922 -0.075 1.00 0.00 C ATOM 1314 OG SER A 77 -1.232 -8.030 -0.725 1.00 0.00 O ATOM 0 H SER A 77 -0.229 -4.516 -0.798 1.00 0.00 H new ATOM 0 HA SER A 77 -2.448 -6.012 -1.918 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.299 -6.663 0.826 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.862 -7.197 0.239 1.00 0.00 H new ATOM 0 HG SER A 77 -1.200 -8.793 -0.111 1.00 0.00 H new ATOM 1320 N VAL A 78 -3.977 -4.595 -0.509 1.00 0.00 N ATOM 1321 CA VAL A 78 -4.834 -3.555 -0.003 1.00 0.00 C ATOM 1322 C VAL A 78 -6.161 -4.182 0.398 1.00 0.00 C ATOM 1323 O VAL A 78 -6.544 -5.196 -0.153 1.00 0.00 O ATOM 1324 CB VAL A 78 -5.041 -2.427 -1.078 1.00 0.00 C ATOM 1325 CG1 VAL A 78 -5.664 -2.968 -2.352 1.00 0.00 C ATOM 1326 CG2 VAL A 78 -5.861 -1.272 -0.535 1.00 0.00 C ATOM 0 H VAL A 78 -4.477 -5.357 -0.968 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.374 -3.085 0.866 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.049 -2.048 -1.323 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.790 -2.156 -3.069 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.014 -3.732 -2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.636 -3.405 -2.124 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -5.980 -0.515 -1.310 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.842 -1.635 -0.228 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.351 -0.835 0.324 1.00 0.00 H new ATOM 1336 N GLY A 79 -6.799 -3.650 1.391 1.00 0.00 N ATOM 1337 CA GLY A 79 -8.076 -4.157 1.772 1.00 0.00 C ATOM 1338 C GLY A 79 -8.238 -4.158 3.253 1.00 0.00 C ATOM 1339 O GLY A 79 -8.287 -3.100 3.883 1.00 0.00 O ATOM 0 H GLY A 79 -6.458 -2.868 1.950 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.860 -3.551 1.319 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.196 -5.171 1.390 1.00 0.00 H new ATOM 1343 N LYS A 80 -8.290 -5.313 3.833 1.00 0.00 N ATOM 1344 CA LYS A 80 -8.476 -5.406 5.245 1.00 0.00 C ATOM 1345 C LYS A 80 -7.382 -6.209 5.888 1.00 0.00 C ATOM 1346 O LYS A 80 -6.886 -7.186 5.320 1.00 0.00 O ATOM 1347 CB LYS A 80 -9.837 -6.008 5.587 1.00 0.00 C ATOM 1348 CG LYS A 80 -11.024 -5.182 5.110 1.00 0.00 C ATOM 1349 CD LYS A 80 -12.343 -5.837 5.477 1.00 0.00 C ATOM 1350 CE LYS A 80 -12.531 -5.930 6.986 1.00 0.00 C ATOM 1351 NZ LYS A 80 -13.783 -6.622 7.355 1.00 0.00 N ATOM 0 H LYS A 80 -8.206 -6.207 3.350 1.00 0.00 H new ATOM 0 HA LYS A 80 -8.438 -4.391 5.641 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -9.902 -7.004 5.148 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -9.906 -6.131 6.668 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -10.976 -4.186 5.551 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -10.969 -5.055 4.029 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.164 -5.267 5.043 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -12.385 -6.836 5.044 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -11.684 -6.459 7.423 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -12.534 -4.927 7.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -13.866 -6.660 8.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.595 -6.104 6.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -13.771 -7.589 6.973 1.00 0.00 H new ATOM 1365 N ALA A 81 -7.002 -5.777 7.047 1.00 0.00 N ATOM 1366 CA ALA A 81 -6.046 -6.448 7.859 1.00 0.00 C ATOM 1367 C ALA A 81 -6.705 -6.657 9.182 1.00 0.00 C ATOM 1368 O ALA A 81 -7.090 -5.686 9.840 1.00 0.00 O ATOM 1369 CB ALA A 81 -4.791 -5.604 8.018 1.00 0.00 C ATOM 0 H ALA A 81 -7.362 -4.919 7.466 1.00 0.00 H new ATOM 0 HA ALA A 81 -5.739 -7.393 7.411 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.072 -6.135 8.642 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.352 -5.417 7.038 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -5.048 -4.655 8.488 1.00 0.00 H new ATOM 1375 N GLU A 82 -6.902 -7.881 9.537 1.00 0.00 N ATOM 1376 CA GLU A 82 -7.567 -8.207 10.757 1.00 0.00 C ATOM 1377 C GLU A 82 -6.710 -9.157 11.589 1.00 0.00 C ATOM 1378 O GLU A 82 -6.690 -9.067 12.817 1.00 0.00 O ATOM 1379 CB GLU A 82 -8.946 -8.793 10.447 1.00 0.00 C ATOM 1380 CG GLU A 82 -9.819 -9.040 11.658 1.00 0.00 C ATOM 1381 CD GLU A 82 -11.213 -9.442 11.275 1.00 0.00 C ATOM 1382 OE1 GLU A 82 -12.057 -8.553 11.059 1.00 0.00 O ATOM 1383 OE2 GLU A 82 -11.493 -10.657 11.179 1.00 0.00 O ATOM 0 H GLU A 82 -6.606 -8.689 8.989 1.00 0.00 H new ATOM 0 HA GLU A 82 -7.713 -7.305 11.352 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.469 -8.116 9.772 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.813 -9.735 9.914 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -9.373 -9.821 12.273 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.857 -8.137 12.268 1.00 0.00 H new ATOM 1390 N ALA A 83 -5.990 -10.044 10.933 1.00 0.00 N ATOM 1391 CA ALA A 83 -5.106 -10.955 11.637 1.00 0.00 C ATOM 1392 C ALA A 83 -3.690 -10.912 11.068 1.00 0.00 C ATOM 1393 O ALA A 83 -2.775 -10.412 11.727 1.00 0.00 O ATOM 1394 CB ALA A 83 -5.655 -12.376 11.658 1.00 0.00 C ATOM 0 H ALA A 83 -5.998 -10.155 9.919 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.055 -10.616 12.672 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.963 -13.025 12.194 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -6.623 -12.385 12.159 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.772 -12.736 10.636 1.00 0.00 H new ATOM 1400 N SER A 84 -3.499 -11.408 9.856 1.00 0.00 N ATOM 1401 CA SER A 84 -2.162 -11.420 9.263 1.00 0.00 C ATOM 1402 C SER A 84 -2.259 -11.561 7.728 1.00 0.00 C ATOM 1403 O SER A 84 -1.298 -11.960 7.043 1.00 0.00 O ATOM 1404 CB SER A 84 -1.333 -12.575 9.883 1.00 0.00 C ATOM 1405 OG SER A 84 0.051 -12.477 9.560 1.00 0.00 O ATOM 0 H SER A 84 -4.234 -11.802 9.269 1.00 0.00 H new ATOM 0 HA SER A 84 -1.658 -10.478 9.478 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.453 -12.565 10.966 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.721 -13.530 9.528 1.00 0.00 H new ATOM 0 HG SER A 84 0.536 -13.222 9.971 1.00 0.00 H new ATOM 1411 N GLU A 85 -3.396 -11.153 7.194 1.00 0.00 N ATOM 1412 CA GLU A 85 -3.727 -11.295 5.777 1.00 0.00 C ATOM 1413 C GLU A 85 -2.739 -10.528 4.924 1.00 0.00 C ATOM 1414 O GLU A 85 -2.091 -11.084 4.041 1.00 0.00 O ATOM 1415 CB GLU A 85 -5.148 -10.749 5.487 1.00 0.00 C ATOM 1416 CG GLU A 85 -6.303 -11.372 6.284 1.00 0.00 C ATOM 1417 CD GLU A 85 -6.174 -11.137 7.763 1.00 0.00 C ATOM 1418 OE1 GLU A 85 -6.123 -9.989 8.190 1.00 0.00 O ATOM 1419 OE2 GLU A 85 -5.978 -12.100 8.511 1.00 0.00 O ATOM 0 H GLU A 85 -4.133 -10.705 7.738 1.00 0.00 H new ATOM 0 HA GLU A 85 -3.685 -12.357 5.534 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -5.145 -9.675 5.676 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -5.355 -10.886 4.426 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -7.248 -10.956 5.934 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -6.336 -12.444 6.091 1.00 0.00 H new ATOM 1426 N VAL A 86 -2.559 -9.267 5.265 1.00 0.00 N ATOM 1427 CA VAL A 86 -1.705 -8.375 4.497 1.00 0.00 C ATOM 1428 C VAL A 86 -0.219 -8.661 4.705 1.00 0.00 C ATOM 1429 O VAL A 86 0.611 -8.083 4.051 1.00 0.00 O ATOM 1430 CB VAL A 86 -2.003 -6.882 4.794 1.00 0.00 C ATOM 1431 CG1 VAL A 86 -3.440 -6.536 4.425 1.00 0.00 C ATOM 1432 CG2 VAL A 86 -1.720 -6.544 6.258 1.00 0.00 C ATOM 0 H VAL A 86 -2.997 -8.831 6.077 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.941 -8.573 3.451 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.337 -6.277 4.178 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.628 -5.484 4.641 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.598 -6.722 3.363 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.124 -7.154 5.007 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.938 -5.491 6.437 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.349 -7.159 6.902 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.671 -6.740 6.481 1.00 0.00 H new ATOM 1442 N TYR A 87 0.102 -9.527 5.641 1.00 0.00 N ATOM 1443 CA TYR A 87 1.482 -9.902 5.862 1.00 0.00 C ATOM 1444 C TYR A 87 1.817 -11.132 5.048 1.00 0.00 C ATOM 1445 O TYR A 87 2.773 -11.135 4.273 1.00 0.00 O ATOM 1446 CB TYR A 87 1.769 -10.157 7.339 1.00 0.00 C ATOM 1447 CG TYR A 87 1.618 -8.946 8.226 1.00 0.00 C ATOM 1448 CD1 TYR A 87 2.681 -8.077 8.430 1.00 0.00 C ATOM 1449 CD2 TYR A 87 0.427 -8.685 8.874 1.00 0.00 C ATOM 1450 CE1 TYR A 87 2.552 -6.979 9.253 1.00 0.00 C ATOM 1451 CE2 TYR A 87 0.288 -7.597 9.704 1.00 0.00 C ATOM 1452 CZ TYR A 87 1.351 -6.746 9.891 1.00 0.00 C ATOM 1453 OH TYR A 87 1.215 -5.662 10.733 1.00 0.00 O ATOM 0 H TYR A 87 -0.570 -9.983 6.259 1.00 0.00 H new ATOM 0 HA TYR A 87 2.110 -9.070 5.543 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.099 -10.939 7.696 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.785 -10.539 7.438 1.00 0.00 H new ATOM 0 HD1 TYR A 87 3.623 -8.264 7.936 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.412 -9.348 8.726 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.384 -6.306 9.397 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -0.651 -7.413 10.206 1.00 0.00 H new ATOM 0 HH TYR A 87 0.306 -5.644 11.099 1.00 0.00 H new ATOM 1463 N SER A 88 0.991 -12.154 5.202 1.00 0.00 N ATOM 1464 CA SER A 88 1.192 -13.439 4.559 1.00 0.00 C ATOM 1465 C SER A 88 1.173 -13.312 3.035 1.00 0.00 C ATOM 1466 O SER A 88 2.106 -13.756 2.350 1.00 0.00 O ATOM 1467 CB SER A 88 0.101 -14.401 5.022 1.00 0.00 C ATOM 1468 OG SER A 88 0.016 -14.424 6.448 1.00 0.00 O ATOM 0 H SER A 88 0.154 -12.113 5.783 1.00 0.00 H new ATOM 0 HA SER A 88 2.172 -13.822 4.842 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.858 -14.100 4.601 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.312 -15.403 4.650 1.00 0.00 H new ATOM 0 HG SER A 88 -0.522 -13.665 6.756 1.00 0.00 H new ATOM 1474 N GLU A 89 0.152 -12.652 2.522 1.00 0.00 N ATOM 1475 CA GLU A 89 -0.018 -12.510 1.092 1.00 0.00 C ATOM 1476 C GLU A 89 1.060 -11.602 0.507 1.00 0.00 C ATOM 1477 O GLU A 89 1.489 -11.781 -0.631 1.00 0.00 O ATOM 1478 CB GLU A 89 -1.415 -11.968 0.783 1.00 0.00 C ATOM 1479 CG GLU A 89 -2.548 -12.811 1.373 1.00 0.00 C ATOM 1480 CD GLU A 89 -2.581 -14.232 0.855 1.00 0.00 C ATOM 1481 OE1 GLU A 89 -1.834 -15.077 1.345 1.00 0.00 O ATOM 1482 OE2 GLU A 89 -3.387 -14.522 -0.061 1.00 0.00 O ATOM 0 H GLU A 89 -0.575 -12.204 3.080 1.00 0.00 H new ATOM 0 HA GLU A 89 0.085 -13.491 0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.493 -10.951 1.167 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -1.542 -11.911 -0.298 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -2.447 -12.831 2.458 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.501 -12.330 1.151 1.00 0.00 H new ATOM 1489 N ALA A 90 1.532 -10.665 1.316 1.00 0.00 N ATOM 1490 CA ALA A 90 2.542 -9.724 0.886 1.00 0.00 C ATOM 1491 C ALA A 90 3.897 -10.385 0.776 1.00 0.00 C ATOM 1492 O ALA A 90 4.541 -10.297 -0.264 1.00 0.00 O ATOM 1493 CB ALA A 90 2.615 -8.524 1.805 1.00 0.00 C ATOM 0 H ALA A 90 1.225 -10.540 2.281 1.00 0.00 H new ATOM 0 HA ALA A 90 2.249 -9.373 -0.104 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.385 -7.840 1.449 1.00 0.00 H new ATOM 0 HB2 ALA A 90 1.652 -8.014 1.814 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.861 -8.853 2.815 1.00 0.00 H new ATOM 1499 N VAL A 91 4.318 -11.086 1.831 1.00 0.00 N ATOM 1500 CA VAL A 91 5.633 -11.726 1.843 1.00 0.00 C ATOM 1501 C VAL A 91 5.732 -12.786 0.739 1.00 0.00 C ATOM 1502 O VAL A 91 6.770 -12.926 0.081 1.00 0.00 O ATOM 1503 CB VAL A 91 6.020 -12.318 3.251 1.00 0.00 C ATOM 1504 CG1 VAL A 91 5.093 -13.445 3.692 1.00 0.00 C ATOM 1505 CG2 VAL A 91 7.478 -12.768 3.284 1.00 0.00 C ATOM 0 H VAL A 91 3.772 -11.224 2.681 1.00 0.00 H new ATOM 0 HA VAL A 91 6.364 -10.944 1.637 1.00 0.00 H new ATOM 0 HB VAL A 91 5.895 -11.507 3.969 1.00 0.00 H new ATOM 0 HG11 VAL A 91 5.408 -13.814 4.668 1.00 0.00 H new ATOM 0 HG12 VAL A 91 4.071 -13.071 3.757 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.136 -14.257 2.966 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.712 -13.171 4.269 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.638 -13.538 2.529 1.00 0.00 H new ATOM 0 HG23 VAL A 91 8.126 -11.917 3.077 1.00 0.00 H new ATOM 1515 N LYS A 92 4.622 -13.459 0.480 1.00 0.00 N ATOM 1516 CA LYS A 92 4.570 -14.468 -0.553 1.00 0.00 C ATOM 1517 C LYS A 92 4.535 -13.838 -1.941 1.00 0.00 C ATOM 1518 O LYS A 92 4.825 -14.496 -2.933 1.00 0.00 O ATOM 1519 CB LYS A 92 3.366 -15.401 -0.364 1.00 0.00 C ATOM 1520 CG LYS A 92 3.434 -16.304 0.863 1.00 0.00 C ATOM 1521 CD LYS A 92 4.643 -17.227 0.812 1.00 0.00 C ATOM 1522 CE LYS A 92 4.675 -18.181 1.997 1.00 0.00 C ATOM 1523 NZ LYS A 92 3.525 -19.112 2.015 1.00 0.00 N ATOM 0 H LYS A 92 3.742 -13.320 0.977 1.00 0.00 H new ATOM 0 HA LYS A 92 5.480 -15.062 -0.468 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.463 -14.795 -0.300 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.268 -16.026 -1.251 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.480 -15.692 1.764 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.523 -16.899 0.928 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.625 -17.800 -0.115 1.00 0.00 H new ATOM 0 HD3 LYS A 92 5.555 -16.631 0.800 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.601 -18.755 1.970 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.684 -17.604 2.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 3.689 -19.853 2.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 2.659 -18.589 2.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 3.418 -19.549 1.077 1.00 0.00 H new ATOM 1537 N ARG A 93 4.212 -12.570 -2.015 1.00 0.00 N ATOM 1538 CA ARG A 93 4.116 -11.911 -3.296 1.00 0.00 C ATOM 1539 C ARG A 93 5.443 -11.259 -3.682 1.00 0.00 C ATOM 1540 O ARG A 93 5.699 -10.974 -4.856 1.00 0.00 O ATOM 1541 CB ARG A 93 2.961 -10.903 -3.303 1.00 0.00 C ATOM 1542 CG ARG A 93 2.640 -10.313 -4.665 1.00 0.00 C ATOM 1543 CD ARG A 93 2.272 -11.403 -5.663 1.00 0.00 C ATOM 1544 NE ARG A 93 1.914 -10.844 -6.950 1.00 0.00 N ATOM 1545 CZ ARG A 93 1.670 -11.516 -8.061 1.00 0.00 C ATOM 1546 NH1 ARG A 93 1.648 -12.839 -8.066 1.00 0.00 N ATOM 1547 NH2 ARG A 93 1.436 -10.843 -9.171 1.00 0.00 N ATOM 0 H ARG A 93 4.012 -11.976 -1.210 1.00 0.00 H new ATOM 0 HA ARG A 93 3.898 -12.665 -4.053 1.00 0.00 H new ATOM 0 HB2 ARG A 93 2.068 -11.392 -2.915 1.00 0.00 H new ATOM 0 HB3 ARG A 93 3.202 -10.090 -2.618 1.00 0.00 H new ATOM 0 HG2 ARG A 93 1.815 -9.606 -4.573 1.00 0.00 H new ATOM 0 HG3 ARG A 93 3.500 -9.753 -5.034 1.00 0.00 H new ATOM 0 HD2 ARG A 93 3.112 -12.087 -5.783 1.00 0.00 H new ATOM 0 HD3 ARG A 93 1.438 -11.988 -5.274 1.00 0.00 H new ATOM 0 HE ARG A 93 1.843 -9.828 -7.004 1.00 0.00 H new ATOM 0 HH11 ARG A 93 1.821 -13.355 -7.203 1.00 0.00 H new ATOM 0 HH12 ARG A 93 1.458 -13.343 -8.932 1.00 0.00 H new ATOM 0 HH21 ARG A 93 1.446 -9.823 -9.161 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.245 -11.342 -10.040 1.00 0.00 H new ATOM 1561 N ILE A 94 6.285 -11.052 -2.708 1.00 0.00 N ATOM 1562 CA ILE A 94 7.577 -10.434 -2.937 1.00 0.00 C ATOM 1563 C ILE A 94 8.540 -11.432 -3.579 1.00 0.00 C ATOM 1564 O ILE A 94 9.200 -11.124 -4.584 1.00 0.00 O ATOM 1565 CB ILE A 94 8.152 -9.887 -1.612 1.00 0.00 C ATOM 1566 CG1 ILE A 94 7.183 -8.849 -1.048 1.00 0.00 C ATOM 1567 CG2 ILE A 94 9.539 -9.270 -1.826 1.00 0.00 C ATOM 1568 CD1 ILE A 94 7.479 -8.433 0.360 1.00 0.00 C ATOM 0 H ILE A 94 6.104 -11.302 -1.736 1.00 0.00 H new ATOM 0 HA ILE A 94 7.448 -9.598 -3.624 1.00 0.00 H new ATOM 0 HB ILE A 94 8.267 -10.707 -0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 94 7.202 -7.966 -1.687 1.00 0.00 H new ATOM 0 HG13 ILE A 94 6.171 -9.252 -1.091 1.00 0.00 H new ATOM 0 HG21 ILE A 94 9.920 -8.893 -0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 94 10.219 -10.029 -2.214 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.466 -8.449 -2.539 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.745 -7.695 0.683 1.00 0.00 H new ATOM 0 HD12 ILE A 94 7.431 -9.303 1.014 1.00 0.00 H new ATOM 0 HD13 ILE A 94 8.477 -7.997 0.409 1.00 0.00 H new ATOM 1580 N LEU A 95 8.582 -12.625 -3.043 1.00 0.00 N ATOM 1581 CA LEU A 95 9.472 -13.641 -3.544 1.00 0.00 C ATOM 1582 C LEU A 95 8.615 -14.678 -4.269 1.00 0.00 C ATOM 1583 O LEU A 95 8.065 -15.563 -3.614 1.00 0.00 O ATOM 1584 CB LEU A 95 10.259 -14.268 -2.354 1.00 0.00 C ATOM 1585 CG LEU A 95 11.598 -15.007 -2.653 1.00 0.00 C ATOM 1586 CD1 LEU A 95 11.422 -16.236 -3.533 1.00 0.00 C ATOM 1587 CD2 LEU A 95 12.614 -14.052 -3.266 1.00 0.00 C ATOM 1588 OXT LEU A 95 8.441 -14.581 -5.498 1.00 0.00 O ATOM 0 H LEU A 95 8.006 -12.918 -2.254 1.00 0.00 H new ATOM 0 HA LEU A 95 10.206 -13.232 -4.238 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.473 -13.471 -1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.596 -14.974 -1.854 1.00 0.00 H new ATOM 0 HG LEU A 95 11.972 -15.364 -1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 95 12.392 -16.704 -3.703 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.758 -16.946 -3.039 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.990 -15.940 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 95 13.542 -14.588 -3.467 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.218 -13.649 -4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 95 12.810 -13.235 -2.572 1.00 0.00 H new TER 1600 LEU A 95